A0A077Z2X9_TRITR Loading...

Tyrosine protein kinase transmembrane receptor

AlphaFold DB , UniProt , Accession A0A077Z2X9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 678 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	37.7	Very low	37.4	Very low	250 Å²	250	141.1 Å²	141.1	100%	1.232	83%	0.826	S	S	*	*				0	120.2	0	-81.6	169.2	141.7	0	0	107.2
2	S	36.7	Very low	38.1	Very low	115 Å²	115	134.8 Å²	134.8	80%	0.804	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-70.4	141.7	-157.6	22.4	0	0	0	0	114.3	Y4	S2-Y4 PolarHBondContact O-N 3.45Å
3	S	34.8	Very low	38.7	Very low	116 Å²	116	131.2 Å²	131.2	81%	0.811	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-58.2	118.4	175.9	48.1	0	0	0	0	112.4	S5	S3-S5 PolarHBondContact O-N 2.94Å
4	Y	33.6	Very low	39.7	Very low	233 Å²	233	129.4 Å²	129.4	91%	0.914	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-67.8	117.4	163.3	-99.6	-103.1	0	0	0	108.9	S2 S6	S2-Y4 PolarHBondContact O-N 3.45Å; Y4-S6 PolarHBondContact O-N 2.89Å
5	S	34.8	Very low	41	Very low	109 Å²	109	132.5 Å²	132.5	76%	0.762	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-64.6	117	168.5	51.2	0	0	0	0	109.1	S3 V7	S3-S5 PolarHBondContact O-N 2.94Å; S5-V7 PolarHBondContact O-N 3.26Å
6	S	34.3	Very low	43.5	Very low	102 Å²	102	138.4 Å²	138.4	71%	0.713	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-57.6	118.4	175.5	46.4	0	0	0	0	110.7	Y4 D8	Y4-S6 PolarHBondContact O-N 2.89Å; S6-D8 PolarHBondContact O-N 3.32Å
7	V	40.3	Very low	45.9	Very low	137 Å²	137	133.2 Å²	133.2	83%	0.83	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-65.6	119.6	158.7	176.7	0	0	0	0	106.1	S5 A9	S5-V7 PolarHBondContact O-N 3.26Å; V7-A9 VanDerWaalsContact C-N 3.27Å; V7-A9 PolarHBondContact O-N 3.42Å
8	D	37.7	Very low	48.4	Very low	153 Å²	153	130.8 Å²	130.8	82%	0.818	75%	0.751	S	S	*	*			trans	-59.3	86.7	177	-72.2	-45.2	0	0	0	110.6	S6 N10	S6-D8 PolarHBondContact O-N 3.32Å; D8-N10 VanDerWaalsContact C-N 3.31Å; D8-N10 PolarHBondContact O-N 3.38Å
9	A	37.7	Very low	50.7	Low	85 Å²	85	124.6 Å²	124.6	70%	0.702	72%	0.715	S	S	*	*			trans	-69.8	94.8	160.7	0	0	0	0	0	106.4	V7 P11	V7-A9 VanDerWaalsContact C-N 3.27Å; V7-A9 PolarHBondContact O-N 3.42Å; A9-P11 WeakPolarHBondContact O-CD 3.37Å; A9-P11 VanDerWaalsContact O-CG 3.26Å; A9-P11 WeakPolarHBondContact O-CG 3.4Å
10	N	41.2	Very low	52.7	Low	123 Å²	123	123 Å²	123	66%	0.658	70%	0.704	S	S	*	*			trans	-62.9	107.7	172.9	-167	-1.5	0	0	0	108.4	D8 S12	D8-N10 VanDerWaalsContact C-N 3.31Å; D8-N10 PolarHBondContact O-N 3.38Å; N10-S12 PolarHBondContact O-N 2.82Å; N10-S12 VanDerWaalsContact O-N 3.15Å; N10-S12 PolarHBondContact OD1-OG 3.41Å
11	P	42.4	Very low	54.2	Low	129 Å²	129	119.3 Å²	119.3	84%	0.838	68%	0.682	S	S	*	*			trans	-81.5	7.3	-167.5	-7.7	26	0	0	0	113.5	A9	A9-P11 WeakPolarHBondContact O-CD 3.37Å; A9-P11 VanDerWaalsContact O-CG 3.26Å; A9-P11 WeakPolarHBondContact O-CG 3.4Å
12	S	46.3	Very low	56.6	Low	66 Å²	66	111.2 Å²	111.2	46%	0.462	64%	0.644	S	S	.	*			trans	-104	107.6	174.1	28.2	0	0	0	0	108.2	N10 T14	N10-S12 PolarHBondContact O-N 2.82Å; N10-S12 VanDerWaalsContact O-N 3.15Å; N10-S12 PolarHBondContact OD1-OG 3.41Å; S12-T14 PolarHBondContact O-N 3.37Å; S12-T14 PolarHBondContact O-OG1 3.17Å
13	G	46.2	Very low	58.4	Low	87 Å²	87	108 Å²	108	90%	0.897	63%	0.629	S	S	*	*			trans	-65.3	35.6	172.5	0	0	0	0	0	113.7	Q15	G13-Q15 VanDerWaalsContact C-N 3.28Å; G13-Q15 PolarHBondContact O-N 3.4Å
14	T	52.9	Low	60.8	Low	106 Å²	106	109.2 Å²	109.2	65%	0.65	63%	0.626	S	S	*	*			trans	-75.2	85.3	172.7	36.5	0	0	0	0	108.1	S12 R16	S12-T14 PolarHBondContact O-N 3.37Å; S12-T14 PolarHBondContact O-OG1 3.17Å; T14-R16 PolarHBondContact O-N 2.92Å
15	Q	59.2	Low	63.1	Low	177 Å²	177	98.7 Å²	98.7	83%	0.827	59%	0.585	S	S	*	*			trans	-51.1	111.9	166.3	-169.2	172.7	8.7	0	0	107.9	G13 S17	G13-Q15 VanDerWaalsContact C-N 3.28Å; G13-Q15 PolarHBondContact O-N 3.4Å; Q15-S17 PolarHBondContact O-N 2.74Å
16	R	80	Confident	65.2	Low	226 Å²	226	97.4 Å²	97.4	85%	0.853	57%	0.574	S	S	*	*			trans	-57.5	132.2	-179.5	-79.6	-176.7	176.7	178.6	-0.6	108.8	T14	T14-R16 PolarHBondContact O-N 2.92Å
17	S	85	Confident	67.8	Low	51 Å²	51	97.9 Å²	97.9	36%	0.357	57%	0.568	S	S	.	*			trans	-60.1	143.1	173.8	53.5	0	0	0	0	110	Q15 S45 A98	Q15-S17 PolarHBondContact O-N 2.74Å; S17-S45 VanDerWaalsContact CA-OG 3.3Å; S17-S45 WeakPolarHBondContact CA-OG 3.29Å; S17-A98 WeakPolarHBondContact O-CB 3.46Å; S17-A98 PolarHBondContact OG-N 2.86Å
18	F	90.4	Very high	69.6	Low	89 Å²	89	93.3 Å²	93.3	39%	0.39	54%	0.539	S	S	.	.			trans	-138.9	161.6	177.7	70.6	-81.5	0	0	0	110.9	G44 S45 N96	F18-G44 CarbonylContact O-C 3.29Å; F18-G44 WeakPolarHBondContact O-CA 3.45Å; F18-S45 PolarHBondContact N-OG 2.91Å; F18-S45 PolarHBondContact O-N 3.23Å; F18-N96 PolarHBondContact O-ND2 3.25Å
19	I	91.7	Very high	71.7	Confident	14 Å²	14	90 Å²	90	7%	0.072	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	132.3	169.5	-168.5	170.6	0	0	0	110.1	T43 I48 A94 N96 A98 V101	I19-T43 CarbonylContact C-O 3.52Å; I19-T43 WeakPolarHBondContact CA-O 3.41Å; I19-I48 HydrophobicContact CD1-CG1 4.32Å; I19-I48 HydrophobicContact CD1-CG2 3.99Å; I19-A94 HydrophobicContact CD1-CB 4.14Å; I19-N96 HydrophobicContact CD1-CB 4.35Å; I19-N96 WeakPolarHBondContact CG2-OD1 3.41Å; I19-A98 HydrophobicContact CG2-CB 4.4Å; I19-V101 HydrophobicContact CD1-CG2 4.15Å; I19-V101 HydrophobicContact CG1-CG2 3.91Å; I19-V101 HydrophobicContact CG2-CG1 4.23Å
20	N	90.6	Very high	73.9	Confident	91 Å²	91	89.8 Å²	89.8	49%	0.487	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	146.3	-177.9	-67.3	-44	0	0	0	110.6	V42 T43	N20-V42 CarbonylContact O-C 3.59Å; N20-V42 WeakPolarHBondContact O-CA 3.44Å; N20-V42 VanDerWaalsContact O-CB 3.23Å; N20-V42 WeakPolarHBondContact O-CB 3.5Å; N20-T43 PolarHBondContact N-O 2.86Å; N20-T43 PolarHBondContact O-N 2.71Å
21	L	85.4	Confident	75.8	Confident	46 Å²	46	89.7 Å²	89.7	24%	0.241	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	136.1	171.8	-79.8	155.9	0	0	0	111.2	G23 V42 V101 Q102 T103	L21-G23 VanDerWaalsContact C-N 3.3Å; L21-G23 PolarHBondContact O-N 3.41Å; L21-V42 HydrophobicContact CD2-CG1 3.96Å; L21-V101 HydrophobicContact CD1-CB 3.85Å; L21-V101 HydrophobicContact CD1-CG2 4.29Å; L21-V101 HydrophobicContact CD2-CG2 4.26Å; L21-V101 HydrophobicContact CG-CB 3.8Å; L21-V101 HydrophobicContact CG-CG2 3.7Å; L21-Q102 VanDerWaalsContact CD1-C 3.47Å; L21-Q102 WeakPolarHBondContact CD1-O 3.45Å; L21-T103 HydrophobicContact CD2-CG2 3.78Å
22	N	86.8	Confident	77.5	Confident	81 Å²	81	85.1 Å²	85.1	43%	0.433	48%	0.475	S	S	.	.	S	Bend	trans	-95.4	63.2	172.5	-63.7	-5.2	0	0	0	109.4	R41 T43	N22-R41 HydrophobicContact CB-CB 3.9Å; N22-R41 PolarHBondContact N-O 3.46Å; N22-T43 VanDerWaalsContact ND2-CG2 3.33Å; N22-T43 WeakPolarHBondContact ND2-CG2 3.38Å; N22-T43 WeakPolarHBondContact OD1-CG2 3.44Å; N22-T43 PolarHBondContact OD1-N 2.94Å; N22-T43 PolarHBondContact OD1-OG1 2.91Å
23	G	76.1	Confident	79.1	Confident	48 Å²	48	84 Å²	84	50%	0.495	47%	0.474	S	S	.	.	S	Bend	trans	98.6	162.1	-178.9	0	0	0	0	0	114.4	L21	L21-G23 VanDerWaalsContact C-N 3.3Å; L21-G23 PolarHBondContact O-N 3.41Å
24	L	84	Confident	81	Confident	141 Å²	141	82.4 Å²	82.4	74%	0.738	44%	0.444	S	S	*	.	P	Polyproline II helix	trans	-93.7	150.1	178.4	-60.4	174	0	0	0	110.6	T103	L24-T103 VanDerWaalsContact CA-OG1 3.32Å; L24-T103 WeakPolarHBondContact CA-OG1 3.33Å
25	L	81.9	Confident	82.6	Confident	12 Å²	12	79.7 Å²	79.7	6%	0.063	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-68.6	130.6	170.5	-69.4	171.1	0	0	0	109.5	L38 K39 W52 C92 T103 S105	L25-L38 HydrophobicContact CD2-CB 4.16Å; L25-L38 HydrophobicContact CD2-CD2 4.45Å; L25-K39 WeakPolarHBondContact CD2-O 3.3Å; L25-W52 HydrophobicContact CD1-CH2 3.81Å; L25-W52 HydrophobicContact CD1-CZ3 3.76Å; L25-W52 HydrophobicContact CD2-CH2 4.33Å; L25-C92 HydrophobicContact CD1-CB 4.33Å; L25-T103 HydrophobicContact CB-CG2 4.46Å; L25-T103 HydrophobicContact CD1-CG2 3.84Å; L25-T103 HydrophobicContact CG-CG2 3.68Å; L25-T103 PolarHBondContact N-OG1 2.86Å; L25-S105 VanDerWaalsContact CB-CB 3.48Å
26	P	80.1	Confident	83.9	Confident	81 Å²	81	71.4 Å²	71.4	53%	0.526	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-75.9	145.4	177.3	31.2	-34.4	0	0	0	110.9	L28 S105	P26-L28 HydrophobicContact CG-CD2 4.28Å; P26-S105 VanDerWaalsContact O-CB 3.25Å; P26-S105 WeakPolarHBondContact O-CB 3.36Å; P26-S105 PolarHBondContact O-OG 2.86Å
27	N	87.3	Confident	84.5	Confident	112 Å²	112	65 Å²	65	60%	0.599	36%	0.363	S	S	*	.	P	Polyproline II helix	trans	-67.1	140.5	167.2	-65.2	-24	0	0	0	109.8	L106	N27-L106 CarbonylContact C-O 3.58Å; N27-L106 WeakPolarHBondContact CA-O 3.31Å; N27-L106 HydrophobicContact CB-CB 4.26Å; N27-L106 WeakPolarHBondContact OD1-CB 3.46Å; N27-L106 PolarHBondContact OD1-N 3.4Å
28	L	79.1	Confident	84.7	Confident	42 Å²	42	62.7 Å²	62.7	22%	0.22	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	136.6	-174.3	-61.9	177.8	0	0	0	111.1	P26 V36 L38 L106 L107 K108	P26-L28 HydrophobicContact CG-CD2 4.28Å; L28-V36 HydrophobicContact CD1-CG2 3.61Å; L28-L38 HydrophobicContact CD1-CD2 3.72Å; L28-L106 PolarHBondContact N-O 3.13Å; L28-L107 HydrophobicContact CB-CD1 3.84Å; L28-L107 CarbonylContact O-C 3.52Å; L28-L107 WeakPolarHBondContact O-CA 3.44Å; L28-K108 PolarHBondContact O-N 3.44Å
29	T	81.6	Confident	84.7	Confident	83 Å²	83	61.7 Å²	61.7	51%	0.509	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	124.9	163.2	-58.1	0	0	0	0	108.9	K108 Q110	T29-K108 CarbonylContact C-O 3.53Å; T29-K108 VanDerWaalsContact CA-O 3.28Å; T29-K108 WeakPolarHBondContact CA-O 3.33Å; T29-K108 HydrophobicContact CG2-CB 4.47Å; T29-Q110 HydrophobicContact CG2-CG 3.98Å
30	K	83.9	Confident	84.6	Confident	80 Å²	80	61.1 Å²	61.1	35%	0.348	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	166.1	-179.1	-66.5	-65.4	-177.8	-177.2	0	110.7	D34 L82 L107 K108 I109 Q110	K30-D34 HydrophobicContact CB-CB 4.41Å; K30-L82 HydrophobicContact CB-CD1 3.78Å; K30-L82 HydrophobicContact CG-CD1 4.25Å; K30-L107 HydrophobicContact CG-CD1 4.24Å; K30-K108 PolarHBondContact N-O 2.91Å; K30-I109 HydrophobicContact CB-CD1 3.79Å; K30-I109 CarbonylContact O-C 3.52Å; K30-I109 VanDerWaalsContact O-CA 3.3Å; K30-I109 WeakPolarHBondContact O-CA 3.31Å; K30-Q110 PolarHBondContact O-N 2.99Å
31	K	80.4	Confident	84.7	Confident	122 Å²	122	60 Å²	60	53%	0.53	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	155.4	176.4	-64.8	-178.7	-177.3	178.8	0	110.6	G33 D34	K31-G33 PolarHBondContact O-N 3.5Å; K31-D34 PolarHBondContact N-OD2 3.46Å; K31-D34 VanDerWaalsContact O-CB 3.28Å; K31-D34 WeakPolarHBondContact O-CB 3.27Å; K31-D34 PolarHBondContact O-N 2.95Å
32	A	79.4	Confident	85	Confident	33 Å²	33	57.9 Å²	57.9	27%	0.273	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	138.3	172.3	0	0	0	0	0	110.7	L82 I109 Q110	A32-L82 CarbonylContact C-O 3.56Å; A32-L82 WeakPolarHBondContact CA-O 3.49Å; A32-I109 HydrophobicContact CB-CG2 4.3Å; A32-Q110 PolarHBondContact N-O 2.97Å
33	G	79.3	Confident	85.1	Confident	43 Å²	43	56.8 Å²	56.8	44%	0.443	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.8	-17.9	-174.4	0	0	0	0	0	114.6	K31 L82	K31-G33 PolarHBondContact O-N 3.5Å; G33-L82 PolarHBondContact N-O 3.3Å
34	D	85.1	Confident	85.7	Confident	52 Å²	52	54.8 Å²	54.8	28%	0.278	29%	0.293	S	S	.	.			trans	-65.4	168	178.6	-74.4	-21.2	0	0	0	112.5	K30 K31 N81 L82	K30-D34 HydrophobicContact CB-CB 4.41Å; K31-D34 PolarHBondContact N-OD2 3.46Å; K31-D34 VanDerWaalsContact O-CB 3.28Å; K31-D34 WeakPolarHBondContact O-CB 3.27Å; K31-D34 PolarHBondContact O-N 2.95Å; D34-N81 PolarHBondContact O-N 3.28Å; D34-L82 HydrophobicContact CB-CD1 3.86Å; D34-L82 WeakPolarHBondContact O-CB 3.23Å; D34-L82 VanDerWaalsContact O-CG 3.29Å; D34-L82 WeakPolarHBondContact O-CG 3.34Å; D34-L82 PolarHBondContact O-N 3.42Å
35	L	87	Confident	86.1	Confident	49 Å²	49	49.7 Å²	49.7	26%	0.257	27%	0.27	S	S	.	.			trans	-106.9	132.7	169.4	169.7	68.3	0	0	0	109.1	R78 I79 A80	L35-R78 HydrophobicContact CD1-CG 3.69Å; L35-R78 VanDerWaalsContact CD1-CZ 3.46Å; L35-R78 VanDerWaalsContact CD2-NH1 3.35Å; L35-I79 WeakPolarHBondContact CD1-O 3.21Å; L35-A80 HydrophobicContact CD1-CB 3.99Å
36	V	87.8	Confident	86.6	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.024	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	144	171.9	68.2	0	0	0	0	111.5	L28 R78 I79 L82 L107	L28-V36 HydrophobicContact CD1-CG2 3.61Å; V36-R78 WeakPolarHBondContact O-CA 3.32Å; V36-I79 HydrophobicContact CG1-CB 3.73Å; V36-I79 HydrophobicContact CG1-CD1 4.18Å; V36-I79 HydrophobicContact CG1-CG1 4.2Å; V36-I79 PolarHBondContact N-O 3.36Å; V36-I79 PolarHBondContact O-N 3.45Å; V36-L82 HydrophobicContact CB-CD1 3.96Å; V36-L82 HydrophobicContact CG1-CD1 4.01Å; V36-L82 HydrophobicContact CG1-CD2 3.83Å; V36-L82 HydrophobicContact CG1-CG 4.25Å; V36-L107 HydrophobicContact CG1-CD2 3.92Å; V36-L107 HydrophobicContact CG2-CD1 4.15Å
37	R	91	Very high	87.2	Confident	91 Å²	91	54.4 Å²	54.4	34%	0.343	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	120.8	171.9	-65.5	-176.2	-179	92.6	-10.6	109.8	L77 R78 D282	R37-L77 CarbonylContact C-O 3.53Å; R37-L77 VanDerWaalsContact CA-O 3.27Å; R37-L77 WeakPolarHBondContact CA-O 3.35Å; R37-R78 HydrophobicContact CG-CG 4.39Å; R37-D282 IonicContact CZ-OD2 3.8Å; R37-D282 IonicContact NH1-OD2 3.34Å; R37-D282 PolarHBondContact NH1-OD2 3.24Å; R37-D282 IonicContact NH2-OD1 3.36Å; R37-D282 PolarHBondContact NH2-OD1 3.08Å; R37-D282 IonicContact NH2-OD2 3.58Å; R37-D282 PolarHBondContact NH2-OD2 2.79Å
38	L	89.1	Confident	87.5	Confident	3 Å²	3	50 Å²	50	2%	0.016	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	123.3	171.8	-64.9	174.7	0	0	0	108.2	L25 L28 W52 R76 L77 Y90	L25-L38 HydrophobicContact CD2-CB 4.16Å; L25-L38 HydrophobicContact CD2-CD2 4.45Å; L28-L38 HydrophobicContact CD1-CD2 3.72Å; L38-W52 HydrophobicContact CB-CH2 3.58Å; L38-W52 HydrophobicContact CB-CZ3 3.82Å; L38-W52 HydrophobicContact CD1-CZ3 4.26Å; L38-W52 WeakPolarHBondContact O-CH2 3.45Å; L38-W52 WeakPolarHBondContact O-CZ2 3.34Å; L38-R76 CarbonylContact O-C 3.49Å; L38-R76 WeakPolarHBondContact O-CA 3.47Å; L38-L77 HydrophobicContact CB-CB 4.36Å; L38-L77 HydrophobicContact CD1-CD2 4.34Å; L38-L77 PolarHBondContact N-O 3.41Å; L38-L77 PolarHBondContact O-N 3.42Å; L38-Y90 HydrophobicContact CD1-CD2 4.48Å; L38-Y90 HydrophobicContact CD1-CG 3.97Å
39	K	90.9	Very high	88.2	Confident	67 Å²	67	50.4 Å²	50.4	29%	0.291	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	114.2	-177	-170.3	-179.5	175.5	-173	0	110	L25 R41 S75 R76	L25-K39 WeakPolarHBondContact CD2-O 3.3Å; K39-R41 HydrophobicContact CD-CG 4.43Å; K39-R41 HydrophobicContact CG-CG 4.21Å; K39-R41 VanDerWaalsContact NZ-NH2 3.11Å; K39-S75 WeakPolarHBondContact CA-O 3.46Å; K39-R76 HydrophobicContact CB-CG 4.42Å
40	C	90.1	Very high	88.9	Confident	2 Å²	2	47.7 Å²	47.7	1%	0.014	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	122.3	176.5	-179.1	0	0	0	0	108.7	W52 W74 S75 C92	C40-W52 HydrophobicContact CB-CH2 4.09Å; C40-W52 HydrophobicContact CB-CZ2 3.72Å; C40-W74 CarbonylContact O-C 3.42Å; C40-W74 WeakPolarHBondContact O-CA 3.42Å; C40-W74 WeakPolarHBondContact O-CB 3.36Å; C40-S75 PolarHBondContact N-O 2.95Å; C40-S75 PolarHBondContact O-N 3.41Å; C40-C92 HydrophobicContact CB-CB 3.48Å; C40-C92 VanDerWaalsContact CB-CB 3.48Å; C40-C92 WeakPolarHBondContact CB-SG 3.37Å; C40-C92 WeakPolarHBondContact SG-CB 3.36Å; C40-C92 CovalentContact SG-SG 2.04Å; C40-C92 PolarHBondContact SG-SG 2.75Å
41	R	92.6	Very high	89.5	Confident	69 Å²	69	51.1 Å²	51.1	26%	0.26	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	141.2	-177.6	-60.1	-178.3	-172.6	-156.2	-0.4	109.4	N22 K39 W74 E261	N22-R41 HydrophobicContact CB-CB 3.9Å; N22-R41 PolarHBondContact N-O 3.46Å; K39-R41 HydrophobicContact CD-CG 4.43Å; K39-R41 HydrophobicContact CG-CG 4.21Å; K39-R41 VanDerWaalsContact NZ-NH2 3.11Å; R41-W74 HydrophobicContact CG-CB 4.26Å; R41-E261 IonicContact CZ-OE1 3.61Å; R41-E261 IonicContact NH1-OE1 3.15Å; R41-E261 PolarHBondContact NH1-OE1 3.34Å
42	V	91	Very high	90.2	Very high	1 Å²	1	46 Å²	46	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	158.6	179	-60.4	0	0	0	0	111.2	N20 L21 I48 F50 Y73 A94 V101	N20-V42 CarbonylContact O-C 3.59Å; N20-V42 WeakPolarHBondContact O-CA 3.44Å; N20-V42 VanDerWaalsContact O-CB 3.23Å; N20-V42 WeakPolarHBondContact O-CB 3.5Å; L21-V42 HydrophobicContact CD2-CG1 3.96Å; V42-I48 HydrophobicContact CG2-CD1 3.93Å; V42-I48 HydrophobicContact CG2-CG2 4.05Å; V42-F50 HydrophobicContact CG1-CE1 4.18Å; V42-F50 HydrophobicContact CG2-CE1 4.07Å; V42-F50 HydrophobicContact CG2-CZ 3.58Å; V42-Y73 PolarHBondContact N-O 3.25Å; V42-Y73 WeakPolarHBondContact O-CB 3.34Å; V42-A94 HydrophobicContact CG1-CB 3.57Å; V42-A94 HydrophobicContact CG2-CB 4.46Å; V42-V101 HydrophobicContact CG1-CG2 4.06Å
43	T	88.8	Confident	90.7	Very high	57 Å²	57	46.2 Å²	46.2	35%	0.35	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	146.6	160.2	46.9	0	0	0	0	108.8	I19 N20 N22	I19-T43 CarbonylContact C-O 3.52Å; I19-T43 WeakPolarHBondContact CA-O 3.41Å; N20-T43 PolarHBondContact N-O 2.86Å; N20-T43 PolarHBondContact O-N 2.71Å; N22-T43 VanDerWaalsContact ND2-CG2 3.33Å; N22-T43 WeakPolarHBondContact ND2-CG2 3.38Å; N22-T43 WeakPolarHBondContact OD1-CG2 3.44Å; N22-T43 PolarHBondContact OD1-N 2.94Å; N22-T43 PolarHBondContact OD1-OG1 2.91Å
44	G	89.2	Confident	91.1	Very high	7 Å²	7	46.7 Å²	46.7	7%	0.072	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.7	176.5	179.2	0	0	0	0	0	114.4	F18 Y73	F18-G44 CarbonylContact O-C 3.29Å; F18-G44 WeakPolarHBondContact O-CA 3.45Å; G44-Y73 WeakPolarHBondContact O-CE1 3.38Å
45	S	92.3	Very high	90.4	Very high	34 Å²	34	48.1 Å²	48.1	24%	0.238	24%	0.239	C	C	.	.	S	Bend	trans	-79.2	131.4	175	-48.3	0	0	0	0	111.1	S17 F18 N96	S17-S45 VanDerWaalsContact CA-OG 3.3Å; S17-S45 WeakPolarHBondContact CA-OG 3.29Å; F18-S45 PolarHBondContact N-OG 2.91Å; F18-S45 PolarHBondContact O-N 3.23Å; S45-N96 PolarHBondContact N-ND2 3.38Å; S45-N96 WeakPolarHBondContact O-CB 3.25Å; S45-N96 PolarHBondContact O-ND2 3.12Å
46	L	92.8	Very high	89.5	Confident	83 Å²	83	51.6 Å²	51.6	44%	0.435	26%	0.258	S	S	.	.	S	Bend	trans	-75.3	156.8	178.5	-67.7	176.4	0	0	0	112.7	I48 D72 Y73	L46-I48 HydrophobicContact CD2-CB 4.35Å; L46-I48 HydrophobicContact CD2-CD1 4.12Å; L46-I48 HydrophobicContact CD2-CG1 4.08Å; L46-D72 HydrophobicContact CD1-CB 4.26Å; L46-D72 HydrophobicContact CD2-CB 3.8Å; L46-D72 WeakPolarHBondContact CD2-O 3.38Å; L46-Y73 HydrophobicContact CD1-CE2 4.43Å; L46-Y73 WeakPolarHBondContact CD1-OH 3.46Å; L46-Y73 HydrophobicContact CD2-CE1 3.92Å; L46-Y73 HydrophobicContact CG-CE1 4.15Å
47	P	93.2	Very high	88.5	Confident	108 Å²	108	53.9 Å²	53.9	70%	0.701	28%	0.278	S	S	*	.	P	Polyproline II helix	cis	-79.2	140.3	-3.9	32.1	-34.1	0	0	0	112.4
48	I	92.6	Very high	88.2	Confident	19 Å²	19	54.1 Å²	54.1	10%	0.097	29%	0.291	C	S	.	.			trans	-106.1	130.2	175.3	-63.3	166.3	0	0	0	108.9	I19 V42 L46 F50 Y73 A94 S95 N96	I19-I48 HydrophobicContact CD1-CG1 4.32Å; I19-I48 HydrophobicContact CD1-CG2 3.99Å; V42-I48 HydrophobicContact CG2-CD1 3.93Å; V42-I48 HydrophobicContact CG2-CG2 4.05Å; L46-I48 HydrophobicContact CD2-CB 4.35Å; L46-I48 HydrophobicContact CD2-CD1 4.12Å; L46-I48 HydrophobicContact CD2-CG1 4.08Å; I48-F50 HydrophobicContact CG2-CD2 4.32Å; I48-F50 HydrophobicContact CG2-CE2 3.8Å; I48-F50 HydrophobicContact CG2-CZ 4.03Å; I48-Y73 HydrophobicContact CD1-CD1 3.84Å; I48-Y73 HydrophobicContact CD1-CE1 3.96Å; I48-A94 HydrophobicContact CG2-CB 4.28Å; I48-S95 WeakPolarHBondContact CA-O 3.47Å; I48-N96 HydrophobicContact CG1-CB 4.11Å
49	S	94	Very high	88.1	Confident	52 Å²	52	55 Å²	55	36%	0.364	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	144	176.3	81.6	0	0	0	0	110.8	A94 S95	S49-A94 CarbonylContact O-C 3.55Å; S49-A94 VanDerWaalsContact O-CA 3.3Å; S49-A94 WeakPolarHBondContact O-CA 3.3Å; S49-S95 PolarHBondContact N-O 3.39Å; S49-S95 PolarHBondContact O-N 3.16Å; S49-S95 PolarHBondContact OG-OG 2.93Å
50	F	96.5	Very high	87.8	Confident	25 Å²	25	58.5 Å²	58.5	11%	0.11	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	137.7	179	-68.6	-92.2	0	0	0	111.5	V42 I48 R71 W74 S75 D93 A94	V42-F50 HydrophobicContact CG1-CE1 4.18Å; V42-F50 HydrophobicContact CG2-CE1 4.07Å; V42-F50 HydrophobicContact CG2-CZ 3.58Å; I48-F50 HydrophobicContact CG2-CD2 4.32Å; I48-F50 HydrophobicContact CG2-CE2 3.8Å; I48-F50 HydrophobicContact CG2-CZ 4.03Å; F50-R71 VanDerWaalsContact CE2-O 3.3Å; F50-R71 WeakPolarHBondContact CE2-O 3.32Å; F50-W74 VanDerWaalsContact CZ-CA 3.47Å; F50-S75 VanDerWaalsContact CG-CB 3.42Å; F50-D93 CarbonylContact C-O 3.54Å; F50-D93 VanDerWaalsContact CA-O 3.28Å; F50-D93 WeakPolarHBondContact CA-O 3.29Å; F50-A94 HydrophobicContact CD1-CB 3.77Å; F50-A94 HydrophobicContact CE1-CB 3.64Å; F50-A94 HydrophobicContact CZ-CB 4.36Å
51	R	95.8	Very high	87.4	Confident	152 Å²	152	65.3 Å²	65.3	57%	0.574	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.2	144.8	171.5	-61.5	-176.8	-155.9	-165.6	5.9	110.2	Y53 C92 D93	R51-Y53 HydrophobicContact CB-CE2 3.74Å; R51-C92 WeakPolarHBondContact O-CA 3.46Å; R51-D93 PolarHBondContact N-O 3.05Å; R51-D93 PolarHBondContact O-N 2.92Å
52	W	96	Very high	87.1	Confident	14 Å²	14	65.8 Å²	65.8	5%	0.053	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	143.1	177.2	-75.2	85.6	0	0	0	110	L25 L38 C40 L59 V68 S75 L77 R91 C92	L25-W52 HydrophobicContact CD1-CH2 3.81Å; L25-W52 HydrophobicContact CD1-CZ3 3.76Å; L25-W52 HydrophobicContact CD2-CH2 4.33Å; L38-W52 HydrophobicContact CB-CH2 3.58Å; L38-W52 HydrophobicContact CB-CZ3 3.82Å; L38-W52 HydrophobicContact CD1-CZ3 4.26Å; L38-W52 WeakPolarHBondContact O-CH2 3.45Å; L38-W52 WeakPolarHBondContact O-CZ2 3.34Å; C40-W52 HydrophobicContact CB-CH2 4.09Å; C40-W52 HydrophobicContact CB-CZ2 3.72Å; W52-L59 HydrophobicContact CB-CB 3.97Å; W52-L59 HydrophobicContact CB-CD2 3.94Å; W52-L59 VanDerWaalsContact O-CB 3.32Å; W52-L59 WeakPolarHBondContact O-CB 3.48Å; W52-L59 PolarHBondContact O-N 2.88Å; W52-V68 HydrophobicContact CG-CG2 4.38Å; W52-S75 PolarHBondContact NE1-OG 3.39Å; W52-L77 HydrophobicContact CD2-CB 3.8Å; W52-L77 HydrophobicContact CD2-CD2 4.16Å; W52-L77 HydrophobicContact CE3-CB 3.92Å; W52-L77 HydrophobicContact CE3-CD2 3.66Å; W52-L77 HydrophobicContact CE3-CG 4.46Å; W52-L77 HydrophobicContact CG-CB 4.45Å; W52-L77 HydrophobicContact CH2-CB 3.98Å; W52-L77 HydrophobicContact CZ2-CB 3.86Å; W52-L77 HydrophobicContact CZ3-CB 4.01Å; W52-L77 HydrophobicContact CZ3-CD2 4Å; W52-R91 CarbonylContact C-O 3.57Å; W52-R91 WeakPolarHBondContact CA-O 3.42Å; W52-C92 HydrophobicContact CD2-CB 4.13Å; W52-C92 HydrophobicContact CE3-CB 4.06Å; W52-C92 HydrophobicContact CH2-CB 3.9Å; W52-C92 HydrophobicContact CZ2-CB 3.95Å; W52-C92 HydrophobicContact CZ3-CB 3.95Å
53	Y	90.1	Very high	86.2	Confident	38 Å²	38	75.5 Å²	75.5	15%	0.149	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	149.7	179.6	-61.4	-101.4	0	0	0	109.8	R51 A57 P58 Y90 R91 D93	R51-Y53 HydrophobicContact CB-CE2 3.74Å; Y53-A57 CarbonylContact C-O 3.46Å; Y53-A57 WeakPolarHBondContact CA-O 3.11Å; Y53-A57 WeakPolarHBondContact CB-O 3.43Å; Y53-P58 HydrophobicContact CD1-CG 4.32Å; Y53-P58 HydrophobicContact CE1-CG 4.03Å; Y53-Y90 WeakPolarHBondContact O-CA 3.41Å; Y53-R91 PolarHBondContact N-O 3.45Å; Y53-R91 PolarHBondContact O-N 2.88Å; Y53-D93 HydrophobicContact CE2-CB 4.24Å
54	K	87	Confident	85.5	Confident	53 Å²	53	80.1 Å²	80.1	23%	0.23	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	121.7	167.7	-176.5	-168.1	-179.6	-164	0	107.8	D56 A57 L59 L85 D86 Y89 Y90	K54-D56 VanDerWaalsContact C-N 3.28Å; K54-D56 PolarHBondContact O-N 3.35Å; K54-A57 PolarHBondContact N-O 3.29Å; K54-A57 PolarHBondContact O-N 2.89Å; K54-L59 HydrophobicContact CB-CD1 3.98Å; K54-L85 PolarHBondContact NZ-O 3.41Å; K54-D86 WeakPolarHBondContact CE-O 3.43Å; K54-Y89 CarbonylContact C-O 3.51Å; K54-Y89 WeakPolarHBondContact CA-O 3.49Å; K54-Y90 HydrophobicContact CB-CD1 4.33Å; K54-Y90 HydrophobicContact CB-CE1 4.06Å; K54-Y90 HydrophobicContact CD-CE1 4.23Å; K54-Y90 HydrophobicContact CD-CE2 4.49Å; K54-Y90 WeakPolarHBondContact CE-OH 3.34Å; K54-Y90 HydrophobicContact CG-CD1 4.48Å; K54-Y90 HydrophobicContact CG-CE1 4Å; K54-Y90 HydrophobicContact CG-CE2 4.19Å
55	N	71.4	Confident	85.5	Confident	83 Å²	83	81.7 Å²	81.7	44%	0.444	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	50.7	-177.2	-55.9	-25.7	0	0	0	111.4	A57 G88 Y89	N55-A57 PolarHBondContact O-N 3.04Å; N55-G88 VanDerWaalsContact OD1-CA 3.28Å; N55-G88 WeakPolarHBondContact OD1-CA 3.26Å; N55-Y89 PolarHBondContact N-O 2.92Å; N55-Y89 PolarHBondContact OD1-N 2.97Å
56	D	66.9	Low	85.4	Confident	122 Å²	122	80.5 Å²	80.5	65%	0.652	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	-1.7	179.7	-57.3	-50.9	0	0	0	117.4	K54 R91	K54-D56 VanDerWaalsContact C-N 3.28Å; K54-D56 PolarHBondContact O-N 3.35Å; D56-R91 IonicContact OD1-NH2 3.96Å
57	A	68	Low	85.3	Confident	52 Å²	52	78.6 Å²	78.6	43%	0.43	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	147.5	170.3	0	0	0	0	0	111.9	Y53 K54 N55 L59	Y53-A57 CarbonylContact C-O 3.46Å; Y53-A57 WeakPolarHBondContact CA-O 3.11Å; Y53-A57 WeakPolarHBondContact CB-O 3.43Å; K54-A57 PolarHBondContact N-O 3.29Å; K54-A57 PolarHBondContact O-N 2.89Å; N55-A57 PolarHBondContact O-N 3.04Å; A57-L59 PolarHBondContact O-N 2.84Å
58	P	84.1	Confident	85.3	Confident	95 Å²	95	74.7 Å²	74.7	62%	0.617	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.8	133.8	175.9	-25.7	34.2	0	0	0	112.4	Y53 L60	Y53-P58 HydrophobicContact CD1-CG 4.32Å; Y53-P58 HydrophobicContact CE1-CG 4.03Å; P58-L60 PolarHBondContact O-N 3.37Å
59	L	87.2	Confident	85.2	Confident	22 Å²	22	81.1 Å²	81.1	12%	0.115	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-66.6	123.2	-177.8	-176.8	80.6	0	0	0	111.3	W52 K54 A57 K61 I66 V68 L77 Y90	W52-L59 HydrophobicContact CB-CB 3.97Å; W52-L59 HydrophobicContact CB-CD2 3.94Å; W52-L59 VanDerWaalsContact O-CB 3.32Å; W52-L59 WeakPolarHBondContact O-CB 3.48Å; W52-L59 PolarHBondContact O-N 2.88Å; K54-L59 HydrophobicContact CB-CD1 3.98Å; A57-L59 PolarHBondContact O-N 2.84Å; L59-K61 PolarHBondContact O-N 3.5Å; L59-I66 HydrophobicContact CD1-CG2 4.22Å; L59-I66 HydrophobicContact CD2-CG2 3.72Å; L59-I66 HydrophobicContact CG-CG2 4.05Å; L59-V68 HydrophobicContact CD2-CG2 3.85Å; L59-L77 HydrophobicContact CD2-CD1 3.35Å; L59-L77 HydrophobicContact CD2-CD2 3.95Å; L59-L77 HydrophobicContact CD2-CG 4.26Å; L59-Y90 HydrophobicContact CD1-CD1 4.2Å; L59-Y90 HydrophobicContact CD1-CE1 3.68Å
60	L	84.1	Confident	85.1	Confident	141 Å²	141	81.7 Å²	81.7	74%	0.738	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-76.9	117.6	172.7	-59	177.9	0	0	0	110	P58	P58-L60 PolarHBondContact O-N 3.37Å
61	K	81.3	Confident	84.7	Confident	145 Å²	145	88.8 Å²	88.8	63%	0.63	43%	0.434	S	S	*	.	P	Polyproline II helix	trans	-81.1	142.8	176.7	-59.7	-179.2	-169.9	-179.1	0	110.2	L59 I66 V68	L59-K61 PolarHBondContact O-N 3.5Å; K61-I66 CarbonylContact C-O 3.58Å; K61-I66 WeakPolarHBondContact CA-O 3.45Å; K61-V68 HydrophobicContact CD-CB 4.42Å; K61-V68 HydrophobicContact CG-CG2 4.48Å
62	E	86.1	Confident	84.4	Confident	79 Å²	79	86.3 Å²	86.3	37%	0.369	43%	0.432	S	S	.	.			trans	-127.1	123.6	176.2	-66.4	175.4	-151.3	0	0	108.5	N64 R65 I66	E62-N64 PolarHBondContact O-N 2.89Å; E62-R65 HydrophobicContact CB-CB 4.13Å; E62-R65 PolarHBondContact O-N 3.45Å; E62-R65 VanDerWaalsContact O-N 3.11Å; E62-R65 IonicContact OE1-CZ 3.98Å; E62-R65 IonicContact OE1-NE 3.47Å; E62-R65 IonicContact OE1-NH2 3.93Å; E62-R65 PolarHBondContact OE1-NH2 3.12Å; E62-R65 WeakPolarHBondContact OE2-CB 3.47Å; E62-R65 IonicContact OE2-CZ 2.66Å; E62-R65 IonicContact OE2-NE 3.62Å; E62-R65 PolarHBondContact OE2-NE 3.08Å; E62-R65 IonicContact OE2-NH2 3.82Å; E62-R65 PolarHBondContact OE2-NH2 2.79Å; E62-I66 HydrophobicContact CB-CB 4.23Å; E62-I66 HydrophobicContact CG-CB 4.5Å; E62-I66 PolarHBondContact N-O 2.86Å; E62-I66 CarbonylContact O-C 3.51Å; E62-I66 PolarHBondContact O-N 2.93Å
63	K	72.1	Confident	84.2	Confident	204 Å²	204	90.8 Å²	90.8	89%	0.887	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.5	-30.8	-167.3	-75.9	-177.1	177.5	177.5	0	114.5
64	N	74.9	Confident	84.4	Confident	154 Å²	154	91.6 Å²	91.6	82%	0.824	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.6	-13.9	-176.3	-61.2	-19.6	0	0	0	114.8	E62	E62-N64 PolarHBondContact O-N 2.89Å
65	R	89.7	Confident	84.7	Confident	41 Å²	41	89 Å²	89	16%	0.155	44%	0.441	C	S	.	.	S	Bend	trans	-114.5	-60.7	-171.2	-162.2	-179.4	65.6	93.4	-6.2	112.3	E62 I79 A80 D86	E62-R65 HydrophobicContact CB-CB 4.13Å; E62-R65 PolarHBondContact O-N 3.45Å; E62-R65 VanDerWaalsContact O-N 3.11Å; E62-R65 IonicContact OE1-CZ 3.98Å; E62-R65 IonicContact OE1-NE 3.47Å; E62-R65 IonicContact OE1-NH2 3.93Å; E62-R65 PolarHBondContact OE1-NH2 3.12Å; E62-R65 WeakPolarHBondContact OE2-CB 3.47Å; E62-R65 IonicContact OE2-CZ 2.66Å; E62-R65 IonicContact OE2-NE 3.62Å; E62-R65 PolarHBondContact OE2-NE 3.08Å; E62-R65 IonicContact OE2-NH2 3.82Å; E62-R65 PolarHBondContact OE2-NH2 2.79Å; R65-I79 WeakPolarHBondContact O-CA 3.26Å; R65-A80 WeakPolarHBondContact CG-O 3.32Å; R65-A80 PolarHBondContact O-N 2.95Å; R65-D86 IonicContact CZ-OD1 2.75Å; R65-D86 IonicContact NH1-OD1 3.23Å; R65-D86 PolarHBondContact NH1-OD1 2.99Å; R65-D86 IonicContact NH1-OD2 2.87Å; R65-D86 PolarHBondContact NH1-OD2 3.01Å; R65-D86 IonicContact NH2-OD1 2.8Å; R65-D86 PolarHBondContact NH2-OD1 3.27Å
66	I	90	Very high	85.9	Confident	9 Å²	9	89.1 Å²	89.1	5%	0.046	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	101.6	-178.9	-57.7	-176	0	0	0	109.3	L59 K61 E62 L77 R78 I79	L59-I66 HydrophobicContact CD1-CG2 4.22Å; L59-I66 HydrophobicContact CD2-CG2 3.72Å; L59-I66 HydrophobicContact CG-CG2 4.05Å; K61-I66 CarbonylContact C-O 3.58Å; K61-I66 WeakPolarHBondContact CA-O 3.45Å; E62-I66 HydrophobicContact CB-CB 4.23Å; E62-I66 HydrophobicContact CG-CB 4.5Å; E62-I66 PolarHBondContact N-O 2.86Å; E62-I66 CarbonylContact O-C 3.51Å; E62-I66 PolarHBondContact O-N 2.93Å; I66-L77 HydrophobicContact CG2-CD1 3.85Å; I66-R78 CarbonylContact C-O 3.56Å; I66-R78 WeakPolarHBondContact CA-O 3.32Å; I66-I79 HydrophobicContact CG1-CG1 4.22Å; I66-I79 HydrophobicContact CG1-CG2 4.03Å; I66-I79 HydrophobicContact CG2-CG1 4.35Å
67	T	90.3	Very high	87.2	Confident	42 Å²	42	83.3 Å²	83.3	26%	0.258	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	144.1	-178	59	0	0	0	0	111.5	R78	T67-R78 PolarHBondContact N-O 3.48Å; T67-R78 PolarHBondContact O-N 3.34Å
68	V	93.1	Very high	88.4	Confident	26 Å²	26	84.9 Å²	84.9	16%	0.158	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	126.8	177	176.6	0	0	0	0	108.9	W52 L59 K61 R76 L77	W52-V68 HydrophobicContact CG-CG2 4.38Å; L59-V68 HydrophobicContact CD2-CG2 3.85Å; K61-V68 HydrophobicContact CD-CB 4.42Å; K61-V68 HydrophobicContact CG-CG2 4.48Å; V68-R76 WeakPolarHBondContact CA-O 3.3Å; V68-L77 HydrophobicContact CG2-CB 4.48Å; V68-L77 HydrophobicContact CG2-CD1 3.9Å
69	K	91.4	Very high	88.7	Confident	155 Å²	155	80.3 Å²	80.3	67%	0.674	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	126.6	171.6	-67.5	-172.4	178.9	-177.9	0	109.5	S75 R76	K69-S75 CarbonylContact O-C 3.48Å; K69-S75 WeakPolarHBondContact O-CA 3.34Å; K69-R76 PolarHBondContact N-O 2.84Å; K69-R76 PolarHBondContact O-N 2.99Å
70	S	91.4	Very high	88.7	Confident	64 Å²	64	80.2 Å²	80.2	45%	0.448	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	143.3	179.2	-56.5	0	0	0	0	110.7	S75	S70-S75 WeakPolarHBondContact OG-CB 3.21Å; S70-S75 PolarHBondContact OG-OG 3.32Å
71	R	88.6	Confident	88.7	Confident	174 Å²	174	78 Å²	78	66%	0.657	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.1	-179.6	170.6	-67.2	-162	177.7	173.1	-2.6	108.8	F50 Y73 W74	F50-R71 VanDerWaalsContact CE2-O 3.3Å; F50-R71 WeakPolarHBondContact CE2-O 3.32Å; R71-Y73 VanDerWaalsContact C-N 3.27Å; R71-Y73 PolarHBondContact O-N 3.06Å; R71-Y73 VanDerWaalsContact O-N 3.09Å; R71-W74 HydrophobicContact CB-CD2 4.43Å; R71-W74 HydrophobicContact CB-CZ2 4.25Å; R71-W74 HydrophobicContact CG-CH2 4.3Å; R71-W74 HydrophobicContact CG-CZ2 3.74Å; R71-W74 PolarHBondContact N-O 2.77Å; R71-W74 PolarHBondContact O-N 2.65Å; R71-W74 VanDerWaalsContact O-O 3.12Å
72	D	89.4	Confident	88.7	Confident	100 Å²	100	71 Å²	71	54%	0.535	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.6	-40.6	-174	-61.5	-13.2	0	0	0	115.4	L46	L46-D72 HydrophobicContact CD1-CB 4.26Å; L46-D72 HydrophobicContact CD2-CB 3.8Å; L46-D72 WeakPolarHBondContact CD2-O 3.38Å
73	Y	91.8	Very high	88.3	Confident	107 Å²	107	71.3 Å²	71.3	42%	0.42	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.6	7.7	-172.6	-61.8	-64.8	0	0	0	114	V42 G44 L46 I48 R71	V42-Y73 PolarHBondContact N-O 3.25Å; V42-Y73 WeakPolarHBondContact O-CB 3.34Å; G44-Y73 WeakPolarHBondContact O-CE1 3.38Å; L46-Y73 HydrophobicContact CD1-CE2 4.43Å; L46-Y73 WeakPolarHBondContact CD1-OH 3.46Å; L46-Y73 HydrophobicContact CD2-CE1 3.92Å; L46-Y73 HydrophobicContact CG-CE1 4.15Å; I48-Y73 HydrophobicContact CD1-CD1 3.84Å; I48-Y73 HydrophobicContact CD1-CE1 3.96Å; R71-Y73 VanDerWaalsContact C-N 3.27Å; R71-Y73 PolarHBondContact O-N 3.06Å; R71-Y73 VanDerWaalsContact O-N 3.09Å
74	W	94	Very high	88.3	Confident	55 Å²	55	65.2 Å²	65.2	21%	0.208	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	154	177.1	64	-92	0	0	0	113.2	C40 R41 F50 R71 R76	C40-W74 CarbonylContact O-C 3.42Å; C40-W74 WeakPolarHBondContact O-CA 3.42Å; C40-W74 WeakPolarHBondContact O-CB 3.36Å; R41-W74 HydrophobicContact CG-CB 4.26Å; F50-W74 VanDerWaalsContact CZ-CA 3.47Å; R71-W74 HydrophobicContact CB-CD2 4.43Å; R71-W74 HydrophobicContact CB-CZ2 4.25Å; R71-W74 HydrophobicContact CG-CH2 4.3Å; R71-W74 HydrophobicContact CG-CZ2 3.74Å; R71-W74 PolarHBondContact N-O 2.77Å; R71-W74 PolarHBondContact O-N 2.65Å; R71-W74 VanDerWaalsContact O-O 3.12Å; W74-R76 HydrophobicContact CE3-CB 3.97Å; W74-R76 HydrophobicContact CZ3-CB 3.55Å
75	S	93.8	Very high	88.4	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	141.8	168	-171.9	0	0	0	0	110.7	K39 C40 F50 W52 K69 S70	K39-S75 WeakPolarHBondContact CA-O 3.46Å; C40-S75 PolarHBondContact N-O 2.95Å; C40-S75 PolarHBondContact O-N 3.41Å; F50-S75 VanDerWaalsContact CG-CB 3.42Å; W52-S75 PolarHBondContact NE1-OG 3.39Å; K69-S75 CarbonylContact O-C 3.48Å; K69-S75 WeakPolarHBondContact O-CA 3.34Å; S70-S75 WeakPolarHBondContact OG-CB 3.21Å; S70-S75 PolarHBondContact OG-OG 3.32Å
76	R	95	Very high	88.1	Confident	84 Å²	84	63.5 Å²	63.5	32%	0.317	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	118.9	-179.3	-169.3	-174.5	-52.7	-161.5	4.5	109.8	L38 K39 V68 K69 W74	L38-R76 CarbonylContact O-C 3.49Å; L38-R76 WeakPolarHBondContact O-CA 3.47Å; K39-R76 HydrophobicContact CB-CG 4.42Å; V68-R76 WeakPolarHBondContact CA-O 3.3Å; K69-R76 PolarHBondContact N-O 2.84Å; K69-R76 PolarHBondContact O-N 2.99Å; W74-R76 HydrophobicContact CE3-CB 3.97Å; W74-R76 HydrophobicContact CZ3-CB 3.55Å
77	L	94.8	Very high	87.3	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	130.7	165.7	168.7	57.5	0	0	0	109	R37 L38 W52 L59 I66 V68 I79 Y90	R37-L77 CarbonylContact C-O 3.53Å; R37-L77 VanDerWaalsContact CA-O 3.27Å; R37-L77 WeakPolarHBondContact CA-O 3.35Å; L38-L77 HydrophobicContact CB-CB 4.36Å; L38-L77 HydrophobicContact CD1-CD2 4.34Å; L38-L77 PolarHBondContact N-O 3.41Å; L38-L77 PolarHBondContact O-N 3.42Å; W52-L77 HydrophobicContact CD2-CB 3.8Å; W52-L77 HydrophobicContact CD2-CD2 4.16Å; W52-L77 HydrophobicContact CE3-CB 3.92Å; W52-L77 HydrophobicContact CE3-CD2 3.66Å; W52-L77 HydrophobicContact CE3-CG 4.46Å; W52-L77 HydrophobicContact CG-CB 4.45Å; W52-L77 HydrophobicContact CH2-CB 3.98Å; W52-L77 HydrophobicContact CZ2-CB 3.86Å; W52-L77 HydrophobicContact CZ3-CB 4.01Å; W52-L77 HydrophobicContact CZ3-CD2 4Å; L59-L77 HydrophobicContact CD2-CD1 3.35Å; L59-L77 HydrophobicContact CD2-CD2 3.95Å; L59-L77 HydrophobicContact CD2-CG 4.26Å; I66-L77 HydrophobicContact CG2-CD1 3.85Å; V68-L77 HydrophobicContact CG2-CB 4.48Å; V68-L77 HydrophobicContact CG2-CD1 3.9Å; L77-I79 HydrophobicContact CD1-CG1 3.97Å; L77-I79 HydrophobicContact CD2-CD1 4.32Å; L77-I79 HydrophobicContact CG-CD1 4.47Å; L77-I79 HydrophobicContact CG-CG1 4.19Å; L77-Y90 HydrophobicContact CD2-CD1 3.4Å; L77-Y90 VanDerWaalsContact CD2-CD1 3.4Å; L77-Y90 HydrophobicContact CD2-CE1 3.84Å; L77-Y90 HydrophobicContact CD2-CG 4.3Å
78	R	93	Very high	86.5	Confident	84 Å²	84	63.2 Å²	63.2	32%	0.317	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	127	172.9	177.6	-169.9	168.9	97	-1.9	108.8	L35 V36 R37 I66 T67	L35-R78 HydrophobicContact CD1-CG 3.69Å; L35-R78 VanDerWaalsContact CD1-CZ 3.46Å; L35-R78 VanDerWaalsContact CD2-NH1 3.35Å; V36-R78 WeakPolarHBondContact O-CA 3.32Å; R37-R78 HydrophobicContact CG-CG 4.39Å; I66-R78 CarbonylContact C-O 3.56Å; I66-R78 WeakPolarHBondContact CA-O 3.32Å; T67-R78 PolarHBondContact N-O 3.48Å; T67-R78 PolarHBondContact O-N 3.34Å
79	I	90.3	Very high	85.9	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	108.4	172.3	-51.2	171.5	0	0	0	107.5	L35 V36 R65 I66 L77 L82 Y90 L107	L35-I79 WeakPolarHBondContact CD1-O 3.21Å; V36-I79 HydrophobicContact CG1-CB 3.73Å; V36-I79 HydrophobicContact CG1-CD1 4.18Å; V36-I79 HydrophobicContact CG1-CG1 4.2Å; V36-I79 PolarHBondContact N-O 3.36Å; V36-I79 PolarHBondContact O-N 3.45Å; R65-I79 WeakPolarHBondContact O-CA 3.26Å; I66-I79 HydrophobicContact CG1-CG1 4.22Å; I66-I79 HydrophobicContact CG1-CG2 4.03Å; I66-I79 HydrophobicContact CG2-CG1 4.35Å; L77-I79 HydrophobicContact CD1-CG1 3.97Å; L77-I79 HydrophobicContact CD2-CD1 4.32Å; L77-I79 HydrophobicContact CG-CD1 4.47Å; L77-I79 HydrophobicContact CG-CG1 4.19Å; I79-L82 HydrophobicContact CB-CD2 4.19Å; I79-L82 HydrophobicContact CG2-CD2 3.73Å; I79-Y90 HydrophobicContact CD1-CD1 4.45Å; I79-Y90 HydrophobicContact CD1-CE1 3.54Å; I79-Y90 HydrophobicContact CD1-CE2 4.44Å; I79-Y90 WeakPolarHBondContact CD1-OH 3.36Å; I79-L107 HydrophobicContact CD1-CD2 4.48Å
80	A	87.9	Confident	85.9	Confident	20 Å²	20	61.1 Å²	61.1	17%	0.165	29%	0.292	C	S	.	.			trans	-86.2	157.6	173.8	0	0	0	0	0	110.9	L35 R65	L35-A80 HydrophobicContact CD1-CB 3.99Å; R65-A80 WeakPolarHBondContact CG-O 3.32Å; R65-A80 PolarHBondContact O-N 2.95Å
81	N	84.3	Confident	85.9	Confident	93 Å²	93	60.1 Å²	60.1	50%	0.497	28%	0.279	S	S	.	.	S	Bend	trans	49.2	64.7	176.4	-169.4	30.7	0	0	0	112.5	D34 H83	D34-N81 PolarHBondContact O-N 3.28Å; N81-H83 PolarHBondContact O-N 3.24Å
82	L	80.1	Confident	86.1	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.248	C	C	.	.			trans	-58.3	133.7	-173.8	-81.6	168.5	0	0	0	112.9	K30 A32 G33 D34 V36 I79 D86 L107 I109	K30-L82 HydrophobicContact CB-CD1 3.78Å; K30-L82 HydrophobicContact CG-CD1 4.25Å; A32-L82 CarbonylContact C-O 3.56Å; A32-L82 WeakPolarHBondContact CA-O 3.49Å; G33-L82 PolarHBondContact N-O 3.3Å; D34-L82 HydrophobicContact CB-CD1 3.86Å; D34-L82 WeakPolarHBondContact O-CB 3.23Å; D34-L82 VanDerWaalsContact O-CG 3.29Å; D34-L82 WeakPolarHBondContact O-CG 3.34Å; D34-L82 PolarHBondContact O-N 3.42Å; V36-L82 HydrophobicContact CB-CD1 3.96Å; V36-L82 HydrophobicContact CG1-CD1 4.01Å; V36-L82 HydrophobicContact CG1-CD2 3.83Å; V36-L82 HydrophobicContact CG1-CG 4.25Å; I79-L82 HydrophobicContact CB-CD2 4.19Å; I79-L82 HydrophobicContact CG2-CD2 3.73Å; L82-D86 HydrophobicContact CD2-CB 3.93Å; L82-L107 HydrophobicContact CD2-CD2 4.1Å; L82-I109 HydrophobicContact CB-CD1 4.23Å; L82-I109 HydrophobicContact CB-CG2 4.38Å; L82-I109 HydrophobicContact CD1-CD1 3.61Å; L82-I109 HydrophobicContact CD2-CD1 3.83Å; L82-I109 HydrophobicContact CD2-CG1 4.27Å; L82-I109 HydrophobicContact CG-CD1 4.1Å
83	H	78	Confident	86.3	Confident	85 Å²	85	48.5 Å²	48.5	39%	0.394	23%	0.23	S	C	.	.			trans	-106.1	154.5	172	-62.6	-60.3	0	0	0	110.8	N81 L85 D86	N81-H83 PolarHBondContact O-N 3.24Å; H83-L85 PolarHBondContact O-N 2.97Å; H83-L85 VanDerWaalsContact O-N 3.16Å; H83-D86 IonicContact CD2-OD2 3.64Å; H83-D86 PolarHBondContact N-OD2 3.48Å; H83-D86 VanDerWaalsContact O-CB 3.27Å; H83-D86 WeakPolarHBondContact O-CB 3.39Å; H83-D86 PolarHBondContact O-N 3.47Å
84	V	71.6	Confident	86.4	Confident	76 Å²	76	43.4 Å²	43.4	46%	0.461	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-54.7	-37.4	176.2	178.8	0	0	0	0	111.1	D86 S87 A111	V84-D86 PolarHBondContact O-N 2.98Å; V84-S87 WeakPolarHBondContact O-CB 3.36Å; V84-S87 PolarHBondContact O-N 3.27Å; V84-S87 VanDerWaalsContact O-N 3.12Å; V84-S87 PolarHBondContact O-OG 2.91Å; V84-A111 HydrophobicContact CG2-CB 4.11Å
85	L	76.8	Confident	86.4	Confident	151 Å²	151	42.6 Å²	42.6	79%	0.791	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-68.4	-12.8	176	-64.4	175.4	0	0	0	114.4	K54 H83 S87	K54-L85 PolarHBondContact NZ-O 3.41Å; H83-L85 PolarHBondContact O-N 2.97Å; H83-L85 VanDerWaalsContact O-N 3.16Å; L85-S87 PolarHBondContact O-N 3.44Å
86	D	83.5	Confident	86.3	Confident	7 Å²	7	43.7 Å²	43.7	4%	0.037	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-73.9	-11	171.3	-66.4	-42	0	0	0	112	K54 R65 L82 H83 V84 Y90 I109	K54-D86 WeakPolarHBondContact CE-O 3.43Å; R65-D86 IonicContact CZ-OD1 2.75Å; R65-D86 IonicContact NH1-OD1 3.23Å; R65-D86 PolarHBondContact NH1-OD1 2.99Å; R65-D86 IonicContact NH1-OD2 2.87Å; R65-D86 PolarHBondContact NH1-OD2 3.01Å; R65-D86 IonicContact NH2-OD1 2.8Å; R65-D86 PolarHBondContact NH2-OD1 3.27Å; L82-D86 HydrophobicContact CD2-CB 3.93Å; H83-D86 IonicContact CD2-OD2 3.64Å; H83-D86 PolarHBondContact N-OD2 3.48Å; H83-D86 VanDerWaalsContact O-CB 3.27Å; H83-D86 WeakPolarHBondContact O-CB 3.39Å; H83-D86 PolarHBondContact O-N 3.47Å; V84-D86 PolarHBondContact O-N 2.98Å; D86-Y90 VanDerWaalsContact O-CE2 3.27Å; D86-Y90 WeakPolarHBondContact O-CE2 3.47Å; D86-Y90 PolarHBondContact O-OH 2.9Å; D86-I109 HydrophobicContact CB-CG1 4.43Å
87	S	74.1	Confident	86.1	Confident	37 Å²	37	48.9 Å²	48.9	26%	0.259	24%	0.243	S	C	.	.			trans	-56.4	142.7	173.7	-54	0	0	0	0	111.6	V84 L85 L107 I109	V84-S87 WeakPolarHBondContact O-CB 3.36Å; V84-S87 PolarHBondContact O-N 3.27Å; V84-S87 VanDerWaalsContact O-N 3.12Å; V84-S87 PolarHBondContact O-OG 2.91Å; L85-S87 PolarHBondContact O-N 3.44Å; S87-L107 CarbonylContact C-O 3.48Å; S87-L107 WeakPolarHBondContact CA-O 3.46Å; S87-I109 WeakPolarHBondContact OG-CB 2.98Å; S87-I109 PolarHBondContact OG-N 3.4Å
88	G	73.4	Confident	85.7	Confident	9 Å²	9	51.1 Å²	51.1	9%	0.093	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	153.5	-176.5	178.7	0	0	0	0	0	113.6	N55 L107	N55-G88 VanDerWaalsContact OD1-CA 3.28Å; N55-G88 WeakPolarHBondContact OD1-CA 3.26Å; G88-L107 PolarHBondContact N-O 2.59Å; G88-L107 PolarHBondContact O-N 2.77Å
89	Y	81.4	Confident	85.6	Confident	136 Å²	136	48.7 Å²	48.7	53%	0.533	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	115.6	178.5	-65.5	-84.4	0	0	0	109.9	K54 N55 T104 L106	K54-Y89 CarbonylContact C-O 3.51Å; K54-Y89 WeakPolarHBondContact CA-O 3.49Å; N55-Y89 PolarHBondContact N-O 2.92Å; N55-Y89 PolarHBondContact OD1-N 2.97Å; Y89-T104 HydrophobicContact CD1-CG2 4.25Å; Y89-L106 HydrophobicContact CD1-CB 4.12Å; Y89-L106 HydrophobicContact CD1-CD1 4.19Å; Y89-L106 HydrophobicContact CD2-CD1 4.49Å; Y89-L106 HydrophobicContact CE1-CB 3.94Å; Y89-L106 HydrophobicContact CE1-CD1 3.9Å; Y89-L106 HydrophobicContact CE1-CD2 4.47Å; Y89-L106 HydrophobicContact CE1-CG 4.31Å; Y89-L106 HydrophobicContact CE2-CD1 4.23Å; Y89-L106 HydrophobicContact CG-CD1 4.48Å
90	Y	89.6	Confident	85.6	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	114.6	176.9	-74.6	-93.6	0	0	0	110.1	L38 Y53 K54 L59 L77 I79 D86 T104 S105 L107	L38-Y90 HydrophobicContact CD1-CD2 4.48Å; L38-Y90 HydrophobicContact CD1-CG 3.97Å; Y53-Y90 WeakPolarHBondContact O-CA 3.41Å; K54-Y90 HydrophobicContact CB-CD1 4.33Å; K54-Y90 HydrophobicContact CB-CE1 4.06Å; K54-Y90 HydrophobicContact CD-CE1 4.23Å; K54-Y90 HydrophobicContact CD-CE2 4.49Å; K54-Y90 WeakPolarHBondContact CE-OH 3.34Å; K54-Y90 HydrophobicContact CG-CD1 4.48Å; K54-Y90 HydrophobicContact CG-CE1 4Å; K54-Y90 HydrophobicContact CG-CE2 4.19Å; L59-Y90 HydrophobicContact CD1-CD1 4.2Å; L59-Y90 HydrophobicContact CD1-CE1 3.68Å; L77-Y90 HydrophobicContact CD2-CD1 3.4Å; L77-Y90 VanDerWaalsContact CD2-CD1 3.4Å; L77-Y90 HydrophobicContact CD2-CE1 3.84Å; L77-Y90 HydrophobicContact CD2-CG 4.3Å; I79-Y90 HydrophobicContact CD1-CD1 4.45Å; I79-Y90 HydrophobicContact CD1-CE1 3.54Å; I79-Y90 HydrophobicContact CD1-CE2 4.44Å; I79-Y90 WeakPolarHBondContact CD1-OH 3.36Å; D86-Y90 VanDerWaalsContact O-CE2 3.27Å; D86-Y90 WeakPolarHBondContact O-CE2 3.47Å; D86-Y90 PolarHBondContact O-OH 2.9Å; Y90-T104 CarbonylContact O-C 3.58Å; Y90-T104 WeakPolarHBondContact O-CA 3.47Å; Y90-S105 PolarHBondContact N-O 3.11Å; Y90-S105 PolarHBondContact O-N 2.79Å; Y90-L107 HydrophobicContact CD2-CB 3.83Å; Y90-L107 HydrophobicContact CD2-CD2 4.25Å; Y90-L107 HydrophobicContact CE2-CB 3.92Å; Y90-L107 HydrophobicContact CE2-CD2 3.75Å; Y90-L107 HydrophobicContact CE2-CG 4.44Å
91	R	92.4	Very high	85.7	Confident	44 Å²	44	53.3 Å²	53.3	17%	0.166	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	134.3	179.3	177.1	175.6	61.4	155.6	-7.3	111.1	W52 Y53 D56 D93 Q102 T103 T104	W52-R91 CarbonylContact C-O 3.57Å; W52-R91 WeakPolarHBondContact CA-O 3.42Å; Y53-R91 PolarHBondContact N-O 3.45Å; Y53-R91 PolarHBondContact O-N 2.88Å; D56-R91 IonicContact OD1-NH2 3.96Å; R91-D93 IonicContact NE-OD1 2.71Å; R91-D93 IonicContact NH1-OD1 4Å; R91-Q102 HydrophobicContact CG-CB 4.42Å; R91-T103 CarbonylContact C-O 3.57Å; R91-T103 WeakPolarHBondContact CA-O 3.13Å; R91-T104 HydrophobicContact CB-CG2 4.31Å
92	C	93.7	Very high	86.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.2	166.5	172.6	0	0	0	0	109.8	L25 C40 R51 W52 Q102 T103	L25-C92 HydrophobicContact CD1-CB 4.33Å; C40-C92 HydrophobicContact CB-CB 3.48Å; C40-C92 VanDerWaalsContact CB-CB 3.48Å; C40-C92 WeakPolarHBondContact CB-SG 3.37Å; C40-C92 WeakPolarHBondContact SG-CB 3.36Å; C40-C92 CovalentContact SG-SG 2.04Å; C40-C92 PolarHBondContact SG-SG 2.75Å; R51-C92 WeakPolarHBondContact O-CA 3.46Å; W52-C92 HydrophobicContact CD2-CB 4.13Å; W52-C92 HydrophobicContact CE3-CB 4.06Å; W52-C92 HydrophobicContact CH2-CB 3.9Å; W52-C92 HydrophobicContact CZ2-CB 3.95Å; W52-C92 HydrophobicContact CZ3-CB 3.95Å; C92-Q102 VanDerWaalsContact O-CA 3.26Å; C92-Q102 WeakPolarHBondContact O-CA 3.43Å; C92-T103 HydrophobicContact CB-CG2 4.28Å; C92-T103 PolarHBondContact N-O 3.35Å; C92-T103 PolarHBondContact O-N 2.83Å
93	D	93.4	Very high	86.4	Confident	30 Å²	30	54 Å²	54	16%	0.16	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	129.4	168.4	-81.2	0.5	0	0	0	109.5	F50 R51 Y53 R91 Q102	F50-D93 CarbonylContact C-O 3.54Å; F50-D93 VanDerWaalsContact CA-O 3.28Å; F50-D93 WeakPolarHBondContact CA-O 3.29Å; R51-D93 PolarHBondContact N-O 3.05Å; R51-D93 PolarHBondContact O-N 2.92Å; Y53-D93 HydrophobicContact CE2-CB 4.24Å; R91-D93 IonicContact NE-OD1 2.71Å; R91-D93 IonicContact NH1-OD1 4Å; D93-Q102 WeakPolarHBondContact OD1-CB 3.41Å; D93-Q102 PolarHBondContact OD1-OE1 2.76Å
94	A	94.1	Very high	86.7	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	131.7	170.5	0	0	0	0	0	109.7	I19 V42 I48 S49 F50 S100 V101	I19-A94 HydrophobicContact CD1-CB 4.14Å; V42-A94 HydrophobicContact CG1-CB 3.57Å; V42-A94 HydrophobicContact CG2-CB 4.46Å; I48-A94 HydrophobicContact CG2-CB 4.28Å; S49-A94 CarbonylContact O-C 3.55Å; S49-A94 VanDerWaalsContact O-CA 3.3Å; S49-A94 WeakPolarHBondContact O-CA 3.3Å; F50-A94 HydrophobicContact CD1-CB 3.77Å; F50-A94 HydrophobicContact CE1-CB 3.64Å; F50-A94 HydrophobicContact CZ-CB 4.36Å; A94-S100 CarbonylContact O-C 3.57Å; A94-S100 VanDerWaalsContact O-CA 3.27Å; A94-S100 WeakPolarHBondContact O-CA 3.23Å; A94-V101 HydrophobicContact CB-CG2 4.1Å; A94-V101 PolarHBondContact N-O 3.32Å; A94-V101 PolarHBondContact O-N 3.37Å
95	S	93.5	Very high	87.1	Confident	37 Å²	37	48.9 Å²	48.9	26%	0.259	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	147.4	-176.7	64.4	0	0	0	0	113.6	I48 S49 G99	I48-S95 WeakPolarHBondContact CA-O 3.47Å; S49-S95 PolarHBondContact N-O 3.39Å; S49-S95 PolarHBondContact O-N 3.16Å; S49-S95 PolarHBondContact OG-OG 2.93Å; S95-G99 WeakPolarHBondContact CA-O 3.48Å
96	N	91.1	Very high	87.6	Confident	23 Å²	23	44.3 Å²	44.3	12%	0.123	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	-166.5	170.1	72.1	-0.2	0	0	0	110.1	F18 I19 S45 I48 A98 G99	F18-N96 PolarHBondContact O-ND2 3.25Å; I19-N96 HydrophobicContact CD1-CB 4.35Å; I19-N96 WeakPolarHBondContact CG2-OD1 3.41Å; S45-N96 PolarHBondContact N-ND2 3.38Å; S45-N96 WeakPolarHBondContact O-CB 3.25Å; S45-N96 PolarHBondContact O-ND2 3.12Å; I48-N96 HydrophobicContact CG1-CB 4.11Å; N96-A98 PolarHBondContact O-N 3.01Å; N96-A98 WeakPolarHBondContact OD1-CA 3.36Å; N96-A98 WeakPolarHBondContact OD1-CB 3.44Å; N96-A98 PolarHBondContact OD1-N 3.36Å; N96-G99 PolarHBondContact N-O 3.06Å; N96-G99 PolarHBondContact O-N 3.32Å; N96-G99 VanDerWaalsContact O-O 3.09Å
97	K	90.5	Very high	87.4	Confident	194 Å²	194	44 Å²	44	84%	0.843	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-22.3	179.3	-69.2	-174	176.6	-177.9	0	114.6
98	A	87.6	Confident	87.6	Confident	47 Å²	47	48.2 Å²	48.2	39%	0.388	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-25.1	179.6	0	0	0	0	0	112.8	S17 I19 N96	S17-A98 WeakPolarHBondContact O-CB 3.46Å; S17-A98 PolarHBondContact OG-N 2.86Å; I19-A98 HydrophobicContact CG2-CB 4.4Å; N96-A98 PolarHBondContact O-N 3.01Å; N96-A98 WeakPolarHBondContact OD1-CA 3.36Å; N96-A98 WeakPolarHBondContact OD1-CB 3.44Å; N96-A98 PolarHBondContact OD1-N 3.36Å
99	G	90.6	Very high	87.6	Confident	34 Å²	34	48.2 Å²	48.2	35%	0.351	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	146	-155.5	-175.1	0	0	0	0	0	111.6	S95 N96	S95-G99 WeakPolarHBondContact CA-O 3.48Å; N96-G99 PolarHBondContact N-O 3.06Å; N96-G99 PolarHBondContact O-N 3.32Å; N96-G99 VanDerWaalsContact O-O 3.09Å
100	S	89.8	Confident	87.2	Confident	88 Å²	88	46.3 Å²	46.3	62%	0.615	25%	0.25	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-134.4	145.7	179.7	57	0	0	0	0	111.7	A94	A94-S100 CarbonylContact O-C 3.57Å; A94-S100 VanDerWaalsContact O-CA 3.27Å; A94-S100 WeakPolarHBondContact O-CA 3.23Å
101	V	90.8	Very high	86.2	Confident	29 Å²	29	49.5 Å²	49.5	18%	0.176	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	147	172.7	-68.8	0	0	0	0	108.8	I19 L21 V42 A94	I19-V101 HydrophobicContact CD1-CG2 4.15Å; I19-V101 HydrophobicContact CG1-CG2 3.91Å; I19-V101 HydrophobicContact CG2-CG1 4.23Å; L21-V101 HydrophobicContact CD1-CB 3.85Å; L21-V101 HydrophobicContact CD1-CG2 4.29Å; L21-V101 HydrophobicContact CD2-CG2 4.26Å; L21-V101 HydrophobicContact CG-CB 3.8Å; L21-V101 HydrophobicContact CG-CG2 3.7Å; V42-V101 HydrophobicContact CG1-CG2 4.06Å; A94-V101 HydrophobicContact CB-CG2 4.1Å; A94-V101 PolarHBondContact N-O 3.32Å; A94-V101 PolarHBondContact O-N 3.37Å
102	Q	92.6	Very high	84.2	Confident	101 Å²	101	50.6 Å²	50.6	47%	0.472	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	147.9	-175.4	67.2	172.3	44.9	0	0	113.2	L21 R91 C92 D93	L21-Q102 VanDerWaalsContact CD1-C 3.47Å; L21-Q102 WeakPolarHBondContact CD1-O 3.45Å; R91-Q102 HydrophobicContact CG-CB 4.42Å; C92-Q102 VanDerWaalsContact O-CA 3.26Å; C92-Q102 WeakPolarHBondContact O-CA 3.43Å; D93-Q102 WeakPolarHBondContact OD1-CB 3.41Å; D93-Q102 PolarHBondContact OD1-OE1 2.76Å
103	T	85.2	Confident	81.9	Confident	5 Å²	5	57.1 Å²	57.1	3%	0.031	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	143.2	174	-177.8	0	0	0	0	110.7	L21 L24 L25 R91 C92	L21-T103 HydrophobicContact CD2-CG2 3.78Å; L24-T103 VanDerWaalsContact CA-OG1 3.32Å; L24-T103 WeakPolarHBondContact CA-OG1 3.33Å; L25-T103 HydrophobicContact CB-CG2 4.46Å; L25-T103 HydrophobicContact CD1-CG2 3.84Å; L25-T103 HydrophobicContact CG-CG2 3.68Å; L25-T103 PolarHBondContact N-OG1 2.86Å; R91-T103 CarbonylContact C-O 3.57Å; R91-T103 WeakPolarHBondContact CA-O 3.13Å; C92-T103 HydrophobicContact CB-CG2 4.28Å; C92-T103 PolarHBondContact N-O 3.35Å; C92-T103 PolarHBondContact O-N 2.83Å
104	T	85.2	Confident	79.2	Confident	55 Å²	55	61 Å²	61	34%	0.337	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	142.4	-173.4	-54.8	0	0	0	0	110.2	Y89 Y90 R91	Y89-T104 HydrophobicContact CD1-CG2 4.25Å; Y90-T104 CarbonylContact O-C 3.58Å; Y90-T104 WeakPolarHBondContact O-CA 3.47Å; R91-T104 HydrophobicContact CB-CG2 4.31Å
105	S	80.7	Confident	76.5	Confident	0 Å²	0	72.4 Å²	72.4	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	131.3	174.1	141.4	0	0	0	0	110	L25 P26 Y90	L25-S105 VanDerWaalsContact CB-CB 3.48Å; P26-S105 VanDerWaalsContact O-CB 3.25Å; P26-S105 WeakPolarHBondContact O-CB 3.36Å; P26-S105 PolarHBondContact O-OG 2.86Å; Y90-S105 PolarHBondContact N-O 3.11Å; Y90-S105 PolarHBondContact O-N 2.79Å
106	L	85.9	Confident	73.7	Confident	55 Å²	55	78.1 Å²	78.1	29%	0.288	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	117.3	166	176.2	60.5	0	0	0	109.8	N27 L28 Y89	N27-L106 CarbonylContact C-O 3.58Å; N27-L106 WeakPolarHBondContact CA-O 3.31Å; N27-L106 HydrophobicContact CB-CB 4.26Å; N27-L106 WeakPolarHBondContact OD1-CB 3.46Å; N27-L106 PolarHBondContact OD1-N 3.4Å; L28-L106 PolarHBondContact N-O 3.13Å; Y89-L106 HydrophobicContact CD1-CB 4.12Å; Y89-L106 HydrophobicContact CD1-CD1 4.19Å; Y89-L106 HydrophobicContact CD2-CD1 4.49Å; Y89-L106 HydrophobicContact CE1-CB 3.94Å; Y89-L106 HydrophobicContact CE1-CD1 3.9Å; Y89-L106 HydrophobicContact CE1-CD2 4.47Å; Y89-L106 HydrophobicContact CE1-CG 4.31Å; Y89-L106 HydrophobicContact CE2-CD1 4.23Å; Y89-L106 HydrophobicContact CG-CD1 4.48Å
107	L	80.7	Confident	70.8	Confident	0 Å²	0	88.7 Å²	88.7	0%	0	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	117.5	169.5	179.8	63.5	0	0	0	108.9	L28 K30 V36 I79 L82 S87 G88 Y90 I109	L28-L107 HydrophobicContact CB-CD1 3.84Å; L28-L107 CarbonylContact O-C 3.52Å; L28-L107 WeakPolarHBondContact O-CA 3.44Å; K30-L107 HydrophobicContact CG-CD1 4.24Å; V36-L107 HydrophobicContact CG1-CD2 3.92Å; V36-L107 HydrophobicContact CG2-CD1 4.15Å; I79-L107 HydrophobicContact CD1-CD2 4.48Å; L82-L107 HydrophobicContact CD2-CD2 4.1Å; S87-L107 CarbonylContact C-O 3.48Å; S87-L107 WeakPolarHBondContact CA-O 3.46Å; G88-L107 PolarHBondContact N-O 2.59Å; G88-L107 PolarHBondContact O-N 2.77Å; Y90-L107 HydrophobicContact CD2-CB 3.83Å; Y90-L107 HydrophobicContact CD2-CD2 4.25Å; Y90-L107 HydrophobicContact CE2-CB 3.92Å; Y90-L107 HydrophobicContact CE2-CD2 3.75Å; Y90-L107 HydrophobicContact CE2-CG 4.44Å; L107-I109 HydrophobicContact CD1-CD1 3.75Å; L107-I109 HydrophobicContact CD2-CD1 4.06Å; L107-I109 HydrophobicContact CG-CD1 3.7Å; L107-I109 HydrophobicContact CG-CG1 4.31Å
108	K	76.5	Confident	68	Low	126 Å²	126	85.2 Å²	85.2	55%	0.548	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	121.4	176.2	-170.9	173.5	-175.2	174.9	0	109.9	L28 T29 K30	L28-K108 PolarHBondContact O-N 3.44Å; T29-K108 CarbonylContact C-O 3.53Å; T29-K108 VanDerWaalsContact CA-O 3.28Å; T29-K108 WeakPolarHBondContact CA-O 3.33Å; T29-K108 HydrophobicContact CG2-CB 4.47Å; K30-K108 PolarHBondContact N-O 2.91Å
109	I	74	Confident	65.2	Low	8 Å²	8	91 Å²	91	4%	0.041	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	119.2	-179.9	-51.5	-55.1	0	0	0	109.9	K30 A32 L82 D86 S87 L107	K30-I109 HydrophobicContact CB-CD1 3.79Å; K30-I109 CarbonylContact O-C 3.52Å; K30-I109 VanDerWaalsContact O-CA 3.3Å; K30-I109 WeakPolarHBondContact O-CA 3.31Å; A32-I109 HydrophobicContact CB-CG2 4.3Å; L82-I109 HydrophobicContact CB-CD1 4.23Å; L82-I109 HydrophobicContact CB-CG2 4.38Å; L82-I109 HydrophobicContact CD1-CD1 3.61Å; L82-I109 HydrophobicContact CD2-CD1 3.83Å; L82-I109 HydrophobicContact CD2-CG1 4.27Å; L82-I109 HydrophobicContact CG-CD1 4.1Å; D86-I109 HydrophobicContact CB-CG1 4.43Å; S87-I109 WeakPolarHBondContact OG-CB 2.98Å; S87-I109 PolarHBondContact OG-N 3.4Å; L107-I109 HydrophobicContact CD1-CD1 3.75Å; L107-I109 HydrophobicContact CD2-CD1 4.06Å; L107-I109 HydrophobicContact CG-CD1 3.7Å; L107-I109 HydrophobicContact CG-CG1 4.31Å
110	Q	73.7	Confident	62.1	Low	96 Å²	96	94.2 Å²	94.2	45%	0.449	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	136.9	174.7	-66.1	177.8	-30.8	0	0	109.9	T29 K30 A32 S112	T29-Q110 HydrophobicContact CG2-CG 3.98Å; K30-Q110 PolarHBondContact O-N 2.99Å; A32-Q110 PolarHBondContact N-O 2.97Å; Q110-S112 PolarHBondContact O-N 3.36Å
111	A	68.8	Low	59.1	Low	68 Å²	68	99 Å²	99	56%	0.562	51%	0.508	S	S	*	.			trans	-58.3	134.1	171.8	0	0	0	0	0	109.4	V84 T113	V84-A111 HydrophobicContact CG2-CB 4.11Å; A111-T113 PolarHBondContact O-N 2.86Å; A111-T113 VanDerWaalsContact O-N 3.08Å
112	S	49.4	Very low	55.9	Low	66 Å²	66	103.8 Å²	103.8	46%	0.462	54%	0.543	S	S	.	.			trans	-62.2	115	169.8	175.4	0	0	0	0	107.7	Q110 T114	Q110-S112 PolarHBondContact O-N 3.36Å; S112-T114 PolarHBondContact O-N 3.24Å; S112-T114 PolarHBondContact OG-OG1 3.25Å
113	T	45.3	Very low	52.7	Low	138 Å²	138	102.5 Å²	102.5	85%	0.847	55%	0.549	S	S	*	.			trans	-71.6	69.4	168	50.3	0	0	0	0	108.4	A111 R115	A111-T113 PolarHBondContact O-N 2.86Å; A111-T113 VanDerWaalsContact O-N 3.08Å; T113-R115 PolarHBondContact O-N 3.18Å; T113-R115 VanDerWaalsContact O-N 3.11Å
114	T	37.8	Very low	49.9	Very low	110 Å²	110	108.7 Å²	108.7	68%	0.675	58%	0.582	S	S	*	*			trans	-74.2	103.6	170.3	-45.1	0	0	0	0	106	S112 N116	S112-T114 PolarHBondContact O-N 3.24Å; S112-T114 PolarHBondContact OG-OG1 3.25Å; T114-N116 PolarHBondContact O-N 3.5Å
115	R	36.7	Very low	46.9	Very low	240 Å²	240	115.5 Å²	115.5	91%	0.906	61%	0.612	S	S	*	*			trans	-43.7	126.8	165.7	-91.2	177	170.3	154.7	-3.7	108.1	T113 R117	T113-R115 PolarHBondContact O-N 3.18Å; T113-R115 VanDerWaalsContact O-N 3.11Å; R115-R117 PolarHBondContact O-N 3.29Å
116	N	34.2	Very low	44.3	Very low	158 Å²	158	122.4 Å²	122.4	85%	0.845	65%	0.646	S	S	*	*			trans	-44.8	101.3	173.8	-71.9	-27.9	0	0	0	110.8	T114	T114-N116 PolarHBondContact O-N 3.5Å
117	R	31.2	Very low	41.7	Very low	245 Å²	245	124.9 Å²	124.9	93%	0.925	67%	0.668	S	S	*	*			trans	-125.8	83.5	152.9	-145	177	-172.3	173.8	1.6	105.8	R115 E119	R115-R117 PolarHBondContact O-N 3.29Å; R117-E119 PolarHBondContact O-N 3.11Å
118	V	30.6	Very low	39.2	Very low	120 Å²	120	130.8 Å²	130.8	73%	0.727	71%	0.706	S	S	*	*			trans	-70.9	114.4	165.8	176.6	0	0	0	0	105.7
119	E	28.6	Very low	37	Very low	168 Å²	168	131.9 Å²	131.9	79%	0.785	72%	0.718	S	S	*	*			trans	172	110.2	132.4	-95.6	165	-179.1	0	0	110.8	R117	R117-E119 PolarHBondContact O-N 3.11Å
120	S	26	Very low	35.1	Very low	103 Å²	103	138.4 Å²	138.4	72%	0.72	75%	0.753	S	S	*	*				57.3	101.4	127	-43.8	0	0	0	0	119
121	Q	27.9	Very low	33.1	Very low	189 Å²	189	141.9 Å²	141.9	88%	0.883	78%	0.775	S	S	*	*				171.7	95.8	115.1	-91.5	174.5	-0.2	0	0	111.1	A123	Q121-A123 PolarHBondContact O-N 3.04Å
122	S	22.5	Very low	31.1	Very low	128 Å²	128	147.6 Å²	147.6	90%	0.895	78%	0.783	S	S	*	*			trans	-82.1	90.6	156	56.6	0	0	0	0	109.1
123	A	26.3	Very low	30.1	Very low	74 Å²	74	149.7 Å²	149.7	61%	0.612	80%	0.795	S	S	*	*			trans	-175.4	117.6	156.3	0	0	0	0	0	103.2	Q121	Q121-A123 PolarHBondContact O-N 3.04Å
124	L	26.7	Very low	29.4	Very low	135 Å²	135	149.5 Å²	149.5	71%	0.707	79%	0.788	S	S	*	*				-164.2	106.7	82.7	-79.2	155.3	0	0	0	107.2	M126	L124-M126 HydrophobicContact CB-CE 4.02Å; L124-M126 HydrophobicContact CB-CG 4.38Å; L124-M126 HydrophobicContact CD1-CE 3.63Å; L124-M126 HydrophobicContact CD2-CE 3.63Å; L124-M126 HydrophobicContact CD2-CG 4.3Å; L124-M126 HydrophobicContact CD2-SD 4.33Å; L124-M126 HydrophobicContact CG-CE 3.92Å; L124-M126 PolarHBondContact O-N 3.24Å
125	M	21.3	Very low	29.1	Very low	198 Å²	198	152.6 Å²	152.6	98%	0.975	79%	0.794	S	S	*	*			trans	-72.7	110.7	152.3	-70	171.6	66.2	0	0	105.5
126	M	26.1	Very low	28.9	Very low	145 Å²	145	148.2 Å²	148.2	71%	0.714	78%	0.778	S	S	*	*			trans	-128	149.2	170.6	-79	-160.5	-87	0	0	110.9	L124	L124-M126 HydrophobicContact CB-CE 4.02Å; L124-M126 HydrophobicContact CB-CG 4.38Å; L124-M126 HydrophobicContact CD1-CE 3.63Å; L124-M126 HydrophobicContact CD2-CE 3.63Å; L124-M126 HydrophobicContact CD2-CG 4.3Å; L124-M126 HydrophobicContact CD2-SD 4.33Å; L124-M126 HydrophobicContact CG-CE 3.92Å; L124-M126 PolarHBondContact O-N 3.24Å
127	S	30.6	Very low	29.1	Very low	108 Å²	108	147.9 Å²	147.9	76%	0.755	78%	0.781	S	S	*	*			trans	-70.5	167.4	-153.1	-49.9	0	0	0	0	116.5	D129	S127-D129 PolarHBondContact O-N 3.39Å
128	P	29	Very low	29.4	Very low	123 Å²	123	138.3 Å²	138.3	80%	0.799	76%	0.759	S	S	*	*	S	Bend	trans	-79.6	5.9	-164.3	-11.7	28.9	0	0	0	118.1
129	D	31.2	Very low	29.8	Very low	149 Å²	149	141 Å²	141	80%	0.797	76%	0.763	S	S	*	*			trans	-121.1	76.5	-170.6	-63.3	-44.6	0	0	0	111.7	S127	S127-D129 PolarHBondContact O-N 3.39Å
130	N	33	Very low	30.6	Very low	146 Å²	146	137.7 Å²	137.7	78%	0.781	76%	0.756	S	S	*	*			trans	-163.4	126.4	147.7	-122.3	-13.3	0	0	0	111.9	Y132	N130-Y132 PolarHBondContact O-N 3.33Å
131	D	31.2	Very low	31.7	Very low	168 Å²	168	136.6 Å²	136.6	90%	0.898	74%	0.742	S	S	*	*			trans	-72.5	41.9	-177.7	-165.1	24.1	0	0	0	112.9
132	Y	27	Very low	32.8	Very low	188 Å²	188	130.5 Å²	130.5	74%	0.737	72%	0.72	S	S	*	*			trans	-84.8	131.2	176.2	-116.4	-93	0	0	0	110.1	N130 I134	N130-Y132 PolarHBondContact O-N 3.33Å; Y132-I134 PolarHBondContact O-N 2.69Å
133	P	28.2	Very low	34.7	Very low	111 Å²	111	125.9 Å²	125.9	72%	0.721	69%	0.693	S	S	*	*			trans	-59.1	112.7	178.3	23	-31.4	0	0	0	108.7	Q135	P133-Q135 PolarHBondContact O-N 2.87Å
134	I	31.8	Very low	36.7	Very low	134 Å²	134	125.9 Å²	125.9	69%	0.687	69%	0.685	S	S	*	*			trans	-58.7	106.6	-175.1	-60.9	168.7	0	0	0	108	Y132 W136	Y132-I134 PolarHBondContact O-N 2.69Å; I134-W136 PolarHBondContact O-N 3.49Å
135	Q	31.3	Very low	38.9	Very low	174 Å²	174	122.1 Å²	122.1	81%	0.813	67%	0.67	S	S	*	*			trans	-58.8	116.5	176	-170.8	172.1	-2.2	0	0	108.3	P133 V137	P133-Q135 PolarHBondContact O-N 2.87Å; Q135-V137 PolarHBondContact O-N 3.26Å
136	W	31.3	Very low	41.3	Very low	149 Å²	149	114.3 Å²	114.3	56%	0.564	63%	0.631	S	S	*	*			trans	-56.3	129	179.4	-86.6	81.7	0	0	0	110.6	I134 G138 P242	I134-W136 PolarHBondContact O-N 3.49Å; W136-G138 VanDerWaalsContact C-N 3.32Å; W136-P242 HydrophobicContact CH2-CB 4.13Å; W136-P242 HydrophobicContact CZ2-CB 3.85Å
137	V	40.2	Very low	43.8	Very low	151 Å²	151	110.9 Å²	110.9	92%	0.915	62%	0.619	S	S	*	*	S	Bend	trans	-92.3	4.2	176.1	-168.3	0	0	0	0	111.4	Q135	Q135-V137 PolarHBondContact O-N 3.26Å
138	G	37.3	Very low	46.2	Very low	43 Å²	43	107 Å²	107	44%	0.443	59%	0.588	S	S	.	*	S	Bend	trans	-93.6	130.2	168.5	0	0	0	0	0	109.6	W136	W136-G138 VanDerWaalsContact C-N 3.32Å
139	E	38.9	Very low	48.3	Very low	176 Å²	176	107.7 Å²	107.7	82%	0.822	58%	0.575	S	S	*	*			trans	-54.9	133.4	169.6	-70.5	-171	167.8	0	0	109.3	I141	E139-I141 PolarHBondContact O-N 3.5Å
140	P	45.6	Very low	50.5	Low	99 Å²	99	101 Å²	101	64%	0.643	54%	0.542	S	S	*	.			trans	-61	110.2	171.4	23.4	-30	0	0	0	108.3	S142	P140-S142 PolarHBondContact O-N 3.04Å
141	I	48.4	Very low	52.6	Low	80 Å²	80	100.5 Å²	100.5	41%	0.41	53%	0.533	S	S	.	.			trans	-69.5	119.5	-179.8	-72.9	172.5	0	0	0	108	E139 G143 H165 I243	E139-I141 PolarHBondContact O-N 3.5Å; I141-G143 PolarHBondContact O-N 3.37Å; I141-H165 WeakPolarHBondContact CG2-CE1 3.35Å; I141-H165 WeakPolarHBondContact CG2-ND1 3.36Å; I141-I243 HydrophobicContact CB-CD1 4.01Å; I141-I243 HydrophobicContact CD1-CD1 3.47Å; I141-I243 VanDerWaalsContact CD1-CD1 3.47Å; I141-I243 HydrophobicContact CG1-CD1 4.27Å; I141-I243 HydrophobicContact CG2-CD1 4.03Å
142	S	50.8	Low	54.9	Low	62 Å²	62	92.9 Å²	92.9	43%	0.434	49%	0.493	S	S	.	.			trans	-69.1	121.4	179.2	-34.9	0	0	0	0	109.6	P140 H165 S166 D167	P140-S142 PolarHBondContact O-N 3.04Å; S142-H165 PolarHBondContact O-CE1 2.86Å; S142-H165 PolarHBondContact O-ND1 2.93Å; S142-S166 WeakPolarHBondContact CB-OG 3.2Å; S142-S166 PolarHBondContact O-N 2.95Å; S142-S166 VanDerWaalsContact O-N 3.08Å; S142-S166 PolarHBondContact O-OG 2.97Å; S142-S166 VanDerWaalsContact O-OG 3.1Å; S142-D167 WeakPolarHBondContact CB-OD2 3.17Å; S142-D167 PolarHBondContact OG-OD2 3.14Å
143	G	63.6	Low	57.7	Low	31 Å²	31	83.9 Å²	83.9	32%	0.32	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	158.9	179.6	0	0	0	0	0	111.8	I141 V164	I141-G143 PolarHBondContact O-N 3.37Å; G143-V164 CarbonylContact C-O 3.54Å; G143-V164 WeakPolarHBondContact CA-O 3.23Å
144	T	66.4	Low	60.4	Low	74 Å²	74	81.5 Å²	81.5	45%	0.454	44%	0.443	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	131.7	175.6	58.6	0	0	0	0	109.8	Q146 V164	T144-Q146 PolarHBondContact O-N 2.98Å; T144-Q146 PolarHBondContact OG1-NE2 3.47Å; T144-V164 PolarHBondContact N-O 3.32Å; T144-V164 PolarHBondContact O-N 3.28Å
145	C	73.6	Confident	62.7	Low	56 Å²	56	82 Å²	82	38%	0.378	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	115.6	173	-73.9	0	0	0	0	109.7	K161 C229	C145-K161 HydrophobicContact CB-CB 4.48Å; C145-C229 VanDerWaalsContact CA-SG 3.54Å; C145-C229 HydrophobicContact CB-CB 3.8Å; C145-C229 WeakPolarHBondContact CB-SG 3.3Å; C145-C229 WeakPolarHBondContact SG-CB 3.44Å; C145-C229 CovalentContact SG-SG 2.03Å; C145-C229 PolarHBondContact SG-SG 2.74Å
146	Q	71.6	Confident	65.2	Low	33 Å²	33	74.7 Å²	74.7	15%	0.154	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	146.8	-178	-63.2	-171	-10.6	0	0	110.8	T144 Y148 K161 V162 V164	T144-Q146 PolarHBondContact O-N 2.98Å; T144-Q146 PolarHBondContact OG1-NE2 3.47Å; Q146-Y148 PolarHBondContact O-N 3.38Å; Q146-K161 CarbonylContact O-C 3.56Å; Q146-K161 VanDerWaalsContact O-CA 3.26Å; Q146-K161 WeakPolarHBondContact O-CA 3.42Å; Q146-V162 PolarHBondContact N-O 2.82Å; Q146-V162 PolarHBondContact O-N 3.46Å; Q146-V164 HydrophobicContact CB-CG2 4.11Å; Q146-V164 HydrophobicContact CG-CG2 4.32Å
147	P	79.3	Confident	67.6	Low	74 Å²	74	67.6 Å²	67.6	48%	0.481	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.3	135	171.7	-23.6	33.6	0	0	0	110.9	R149	P147-R149 PolarHBondContact O-N 3.34Å
148	Y	80.2	Confident	69.3	Low	26 Å²	26	65.1 Å²	65.1	10%	0.102	37%	0.366	C	S	.	.			trans	-65.2	124.1	175.1	175.3	-95.5	0	0	0	110.5	Q146 G150 A152 C153 L157 Q160 V162 E193 Y226	Q146-Y148 PolarHBondContact O-N 3.38Å; Y148-G150 WeakPolarHBondContact CE1-O 3.45Å; Y148-G150 VanDerWaalsContact OH-CA 3.26Å; Y148-G150 WeakPolarHBondContact OH-CA 3.38Å; Y148-A152 PolarHBondContact OH-N 3.06Å; Y148-C153 VanDerWaalsContact CE1-C 3.45Å; Y148-C153 HydrophobicContact CE1-CB 4.03Å; Y148-C153 HydrophobicContact CE2-CB 4.14Å; Y148-C153 WeakPolarHBondContact OH-CA 3.33Å; Y148-C153 WeakPolarHBondContact OH-CB 3.36Å; Y148-C153 PolarHBondContact OH-N 3.22Å; Y148-L157 HydrophobicContact CD1-CB 3.89Å; Y148-L157 HydrophobicContact CD2-CB 4.49Å; Y148-L157 HydrophobicContact CD2-CD1 3.87Å; Y148-L157 HydrophobicContact CE1-CB 4.45Å; Y148-L157 HydrophobicContact CE2-CD1 4.09Å; Y148-L157 HydrophobicContact CG-CB 3.91Å; Y148-L157 HydrophobicContact CG-CD1 4.14Å; Y148-Q160 PolarHBondContact N-O 3.04Å; Y148-V162 HydrophobicContact CD2-CG1 4.34Å; Y148-V162 HydrophobicContact CD2-CG2 4.24Å; Y148-E193 PolarHBondContact OH-OE1 3.07Å; Y148-Y226 HydrophobicContact CD2-CD1 4.43Å; Y148-Y226 HydrophobicContact CD2-CG 4.44Å; Y148-Y226 HydrophobicContact CE2-CD1 4.39Å; Y148-Y226 AromaticContact CE2-CD2 3.99Å; Y148-Y226 HydrophobicContact CE2-CD2 3.99Å; Y148-Y226 HydrophobicContact CE2-CE1 4.15Å; Y148-Y226 AromaticContact CE2-CE2 3.7Å; Y148-Y226 HydrophobicContact CE2-CE2 3.7Å; Y148-Y226 HydrophobicContact CE2-CG 4.33Å; Y148-Y226 AromaticContact CE2-CZ 3.82Å
149	R	73.5	Confident	71	Confident	137 Å²	137	67 Å²	67	52%	0.517	39%	0.386	S	S	.	.			trans	-114.4	8	-179.4	-60.6	-179.5	178.5	-172.6	-0.9	113.9	P147 D182 F185	P147-R149 PolarHBondContact O-N 3.34Å; R149-D182 IonicContact NH1-OD1 3.65Å; R149-D182 PolarHBondContact NH1-OD1 3.46Å; R149-F185 HydrophobicContact CB-CD1 4.29Å; R149-F185 HydrophobicContact CB-CD2 4.22Å; R149-F185 HydrophobicContact CB-CE1 3.81Å; R149-F185 HydrophobicContact CB-CE2 3.73Å; R149-F185 HydrophobicContact CB-CG 4.5Å; R149-F185 HydrophobicContact CB-CZ 3.54Å; R149-F185 HydrophobicContact CG-CE2 4.46Å
150	G	76.6	Confident	72.9	Confident	10 Å²	10	60.4 Å²	60.4	10%	0.103	36%	0.355	C	S	.	.			trans	-78.6	170.4	-177	0	0	0	0	0	111.9	Y148 F185	Y148-G150 WeakPolarHBondContact CE1-O 3.45Å; Y148-G150 VanDerWaalsContact OH-CA 3.26Å; Y148-G150 WeakPolarHBondContact OH-CA 3.38Å; G150-F185 VanDerWaalsContact N-CZ 3.33Å
151	K	77.1	Confident	74.4	Confident	135 Å²	135	59.7 Å²	59.7	59%	0.587	34%	0.342	S	S	*	.	S	Bend	trans	-98.1	-37.6	176.1	-69.5	-173.9	178	-175	0	111.6	C153 S154 E193 L197	K151-C153 VanDerWaalsContact C-N 3.32Å; K151-C153 PolarHBondContact O-N 3.3Å; K151-S154 WeakPolarHBondContact O-CB 3.38Å; K151-S154 PolarHBondContact O-N 2.91Å; K151-S154 PolarHBondContact O-OG 3.46Å; K151-E193 PolarHBondContact N-OE2 3.45Å; K151-L197 HydrophobicContact CB-CD1 4.39Å; K151-L197 HydrophobicContact CB-CD2 4.18Å
152	A	80.8	Confident	75.9	Confident	7 Å²	7	56.1 Å²	56.1	6%	0.058	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-47	-172	0	0	0	0	0	112.8	Y148 E193 L196 L197 I200	Y148-A152 PolarHBondContact OH-N 3.06Å; A152-E193 WeakPolarHBondContact CB-OE1 3.31Å; A152-E193 WeakPolarHBondContact CB-OE2 3.19Å; A152-E193 PolarHBondContact N-OE2 2.86Å; A152-L196 HydrophobicContact CB-CB 3.77Å; A152-L196 HydrophobicContact CB-CD2 3.94Å; A152-L196 HydrophobicContact CB-CG 3.75Å; A152-L197 HydrophobicContact CB-CD2 4.03Å; A152-L197 HydrophobicContact CB-CG 3.77Å; A152-I200 HydrophobicContact CB-CD1 4.29Å; A152-I200 WeakPolarHBondContact O-CD1 3.33Å
153	C	85.9	Confident	77	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	17.3	-177.3	-67	0	0	0	0	112.8	Y148 K151 R155 V156 L157 L196 C222 Y226	Y148-C153 VanDerWaalsContact CE1-C 3.45Å; Y148-C153 HydrophobicContact CE1-CB 4.03Å; Y148-C153 HydrophobicContact CE2-CB 4.14Å; Y148-C153 WeakPolarHBondContact OH-CA 3.33Å; Y148-C153 WeakPolarHBondContact OH-CB 3.36Å; Y148-C153 PolarHBondContact OH-N 3.22Å; K151-C153 VanDerWaalsContact C-N 3.32Å; K151-C153 PolarHBondContact O-N 3.3Å; C153-R155 PolarHBondContact O-N 3.38Å; C153-R155 VanDerWaalsContact O-N 3.16Å; C153-V156 PolarHBondContact O-N 3.49Å; C153-L157 HydrophobicContact CB-CB 4.48Å; C153-L157 HydrophobicContact CB-CD1 3.63Å; C153-L157 HydrophobicContact CB-CG 3.93Å; C153-L157 PolarHBondContact O-N 3.21Å; C153-L196 WeakPolarHBondContact SG-CD2 3.19Å; C153-C222 WeakPolarHBondContact CA-SG 3.04Å; C153-C222 HydrophobicContact CB-CB 3.73Å; C153-C222 WeakPolarHBondContact CB-SG 3.43Å; C153-C222 WeakPolarHBondContact SG-CA 3.29Å; C153-C222 WeakPolarHBondContact SG-CB 3.04Å; C153-C222 CovalentContact SG-SG 2.02Å; C153-C222 PolarHBondContact SG-SG 2.89Å; C153-Y226 HydrophobicContact CB-CD2 4.4Å; C153-Y226 HydrophobicContact CB-CE2 4.47Å
154	S	83.6	Confident	77.2	Confident	61 Å²	61	54 Å²	54	43%	0.427	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-34.8	-179.2	56.1	0	0	0	0	112.1	K151 S158	K151-S154 WeakPolarHBondContact O-CB 3.38Å; K151-S154 PolarHBondContact O-N 2.91Å; K151-S154 PolarHBondContact O-OG 3.46Å; S154-S158 VanDerWaalsContact O-CB 3.29Å; S154-S158 WeakPolarHBondContact O-CB 3.47Å; S154-S158 PolarHBondContact O-N 3.12Å
155	R	80.9	Confident	77.2	Confident	143 Å²	143	53.6 Å²	53.6	54%	0.54	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-35.7	177.7	-169.3	175.4	71.6	95.8	-8.9	113.5	C153 E218	C153-R155 PolarHBondContact O-N 3.38Å; C153-R155 VanDerWaalsContact O-N 3.16Å; R155-E218 IonicContact CZ-OE1 2.64Å; R155-E218 IonicContact CZ-OE2 2.76Å; R155-E218 VanDerWaalsContact CZ-OE2 3.3Å; R155-E218 IonicContact NE-OE1 2.59Å; R155-E218 PolarHBondContact NE-OE1 2.91Å; R155-E218 IonicContact NE-OE2 3.04Å; R155-E218 PolarHBondContact NE-OE2 3.45Å; R155-E218 IonicContact NH2-OE1 2.8Å; R155-E218 IonicContact NH2-OE2 3.97Å; R155-E218 PolarHBondContact NH2-OE2 2.91Å
156	V	83.2	Confident	76.2	Confident	21 Å²	21	52.7 Å²	52.7	13%	0.127	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-40.2	-175.8	179.8	0	0	0	0	112	C153 E218 Q219 C222 Y223	C153-V156 PolarHBondContact O-N 3.49Å; V156-E218 HydrophobicContact CG2-CG 3.89Å; V156-Q219 HydrophobicContact CG1-CG 4.31Å; V156-Q219 HydrophobicContact CG2-CG 4.01Å; V156-C222 HydrophobicContact CB-CB 4.04Å; V156-C222 HydrophobicContact CG1-CB 3.92Å; V156-C222 HydrophobicContact CG2-CB 4.38Å; V156-Y223 HydrophobicContact CG1-CD2 4.36Å; V156-Y223 HydrophobicContact CG1-CE1 4.5Å; V156-Y223 HydrophobicContact CG1-CE2 3.75Å
157	L	82.7	Confident	75	Confident	1 Å²	1	55 Å²	55	1%	0.005	30%	0.301	C	S	.	.	S	Bend	trans	-104.5	16.9	-172.3	-56.9	176.5	0	0	0	112.6	Y148 C153 G159 Q160 V162 C222 Y223 Y226 V228	Y148-L157 HydrophobicContact CD1-CB 3.89Å; Y148-L157 HydrophobicContact CD2-CB 4.49Å; Y148-L157 HydrophobicContact CD2-CD1 3.87Å; Y148-L157 HydrophobicContact CE1-CB 4.45Å; Y148-L157 HydrophobicContact CE2-CD1 4.09Å; Y148-L157 HydrophobicContact CG-CB 3.91Å; Y148-L157 HydrophobicContact CG-CD1 4.14Å; C153-L157 HydrophobicContact CB-CB 4.48Å; C153-L157 HydrophobicContact CB-CD1 3.63Å; C153-L157 HydrophobicContact CB-CG 3.93Å; C153-L157 PolarHBondContact O-N 3.21Å; L157-G159 PolarHBondContact O-N 3.42Å; L157-Q160 VanDerWaalsContact CD2-OE1 3.25Å; L157-Q160 WeakPolarHBondContact O-CB 3.42Å; L157-Q160 PolarHBondContact O-N 2.95Å; L157-V162 HydrophobicContact CD1-CG1 4.12Å; L157-C222 HydrophobicContact CD1-CB 4.42Å; L157-C222 HydrophobicContact CG-CB 4.43Å; L157-Y223 HydrophobicContact CD2-CD1 4.03Å; L157-Y223 HydrophobicContact CD2-CE1 3.62Å; L157-Y226 HydrophobicContact CD1-CD2 3.69Å; L157-Y226 HydrophobicContact CD1-CG 3.86Å; L157-V228 HydrophobicContact CD2-CG2 3.88Å
158	S	76	Confident	73.2	Confident	98 Å²	98	55 Å²	55	69%	0.685	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	124.3	178.9	-177.1	0	0	0	0	111.2	S154 Q160	S154-S158 VanDerWaalsContact O-CB 3.29Å; S154-S158 WeakPolarHBondContact O-CB 3.47Å; S154-S158 PolarHBondContact O-N 3.12Å; S158-Q160 PolarHBondContact O-N 3.13Å
159	G	72	Confident	71.3	Confident	83 Å²	83	57.9 Å²	57.9	86%	0.856	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	-3	-179.3	0	0	0	0	0	114.9	L157	L157-G159 PolarHBondContact O-N 3.42Å
160	Q	79	Confident	69.7	Low	37 Å²	37	59.2 Å²	59.2	17%	0.173	33%	0.331	C	S	.	.			trans	-86.8	148	177.4	-62.1	-167.8	-25.2	0	0	111.4	Y148 L157 S158 V228	Y148-Q160 PolarHBondContact N-O 3.04Å; L157-Q160 VanDerWaalsContact CD2-OE1 3.25Å; L157-Q160 WeakPolarHBondContact O-CB 3.42Å; L157-Q160 PolarHBondContact O-N 2.95Å; S158-Q160 PolarHBondContact O-N 3.13Å; Q160-V228 HydrophobicContact CB-CG1 4.26Å; Q160-V228 VanDerWaalsContact OE1-CG2 3.25Å
161	K	77.9	Confident	67.7	Low	85 Å²	85	64.1 Å²	64.1	37%	0.37	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	133.7	169.8	-66.2	173.9	-173.4	161.5	0	108.9	C145 Q146 V228 C229 E231	C145-K161 HydrophobicContact CB-CB 4.48Å; Q146-K161 CarbonylContact O-C 3.56Å; Q146-K161 VanDerWaalsContact O-CA 3.26Å; Q146-K161 WeakPolarHBondContact O-CA 3.42Å; K161-V228 WeakPolarHBondContact O-CA 3.12Å; K161-C229 HydrophobicContact CB-CB 4.21Å; K161-C229 PolarHBondContact O-N 3.04Å; K161-E231 IonicContact NZ-OE1 2.63Å; K161-E231 PolarHBondContact NZ-OE1 3.37Å
162	V	78.9	Confident	65.7	Low	4 Å²	4	65.3 Å²	65.3	2%	0.024	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	148	177.1	-62.8	0	0	0	0	110.7	Q146 Y148 L157 V164 Q227	Q146-V162 PolarHBondContact N-O 2.82Å; Q146-V162 PolarHBondContact O-N 3.46Å; Y148-V162 HydrophobicContact CD2-CG1 4.34Å; Y148-V162 HydrophobicContact CD2-CG2 4.24Å; L157-V162 HydrophobicContact CD1-CG1 4.12Å; V162-V164 PolarHBondContact O-N 2.9Å; V162-Q227 CarbonylContact C-O 3.5Å; V162-Q227 WeakPolarHBondContact CA-O 3.17Å; V162-Q227 WeakPolarHBondContact CB-O 3.41Å
163	L	74.2	Confident	63.6	Low	30 Å²	30	73.2 Å²	73.2	16%	0.157	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	120.8	178.1	-173.4	69.5	0	0	0	110.3	Q227 I243	L163-Q227 HydrophobicContact CB-CB 4.12Å; L163-Q227 HydrophobicContact CB-CG 4.22Å; L163-Q227 PolarHBondContact N-O 3.2Å; L163-I243 HydrophobicContact CD2-CD1 4.34Å; L163-I243 HydrophobicContact CD2-CG1 3.89Å
164	V	68.9	Low	61.3	Low	19 Å²	19	78.5 Å²	78.5	12%	0.115	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	115.9	175.1	-176	0	0	0	0	108.9	G143 T144 Q146 V162 I184	G143-V164 CarbonylContact C-O 3.54Å; G143-V164 WeakPolarHBondContact CA-O 3.23Å; T144-V164 PolarHBondContact N-O 3.32Å; T144-V164 PolarHBondContact O-N 3.28Å; Q146-V164 HydrophobicContact CB-CG2 4.11Å; Q146-V164 HydrophobicContact CG-CG2 4.32Å; V162-V164 PolarHBondContact O-N 2.9Å; V164-I184 HydrophobicContact CG1-CG2 4.4Å
165	H	64.7	Low	59	Low	65 Å²	65	79 Å²	79	30%	0.301	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	137.5	-175.6	-171.9	39.8	0	0	0	112.4	I141 S142 D167 R188	I141-H165 WeakPolarHBondContact CG2-CE1 3.35Å; I141-H165 WeakPolarHBondContact CG2-ND1 3.36Å; S142-H165 PolarHBondContact O-CE1 2.86Å; S142-H165 PolarHBondContact O-ND1 2.93Å; H165-D167 VanDerWaalsContact CE1-CB 3.43Å; H165-D167 WeakPolarHBondContact CE1-CB 3.4Å; H165-D167 IonicContact CE1-OD2 2.72Å; H165-D167 PolarHBondContact CE1-OD2 2.93Å; H165-D167 VanDerWaalsContact CE1-OD2 3.26Å; H165-R188 PolarHBondContact O-NH2 3.31Å
166	S	53.9	Low	57.1	Low	38 Å²	38	75.6 Å²	75.6	27%	0.266	43%	0.433	S	S	.	.			trans	-87.2	-21.9	177.8	48.2	0	0	0	0	114.3	S142 D168 R188	S142-S166 WeakPolarHBondContact CB-OG 3.2Å; S142-S166 PolarHBondContact O-N 2.95Å; S142-S166 VanDerWaalsContact O-N 3.08Å; S142-S166 PolarHBondContact O-OG 2.97Å; S142-S166 VanDerWaalsContact O-OG 3.1Å; S166-D168 PolarHBondContact O-N 2.88Å; S166-R188 PolarHBondContact O-NH2 3.36Å
167	D	45.7	Very low	55.1	Low	81 Å²	81	81.2 Å²	81.2	43%	0.433	46%	0.462	S	S	.	.			trans	-99.6	50.8	-154.5	-47.8	-26.2	0	0	0	115	S142 H165	S142-D167 WeakPolarHBondContact CB-OD2 3.17Å; S142-D167 PolarHBondContact OG-OD2 3.14Å; H165-D167 VanDerWaalsContact CE1-CB 3.43Å; H165-D167 WeakPolarHBondContact CE1-CB 3.4Å; H165-D167 IonicContact CE1-OD2 2.72Å; H165-D167 PolarHBondContact CE1-OD2 2.93Å; H165-D167 VanDerWaalsContact CE1-OD2 3.26Å
168	D	42.5	Very low	53.1	Low	75 Å²	75	84.7 Å²	84.7	40%	0.401	48%	0.483	S	S	.	.			trans	-93.4	137.1	157.2	-99.1	-42.2	0	0	0	109.5	S166 E170 Y171 R188	S166-D168 PolarHBondContact O-N 2.88Å; D168-E170 PolarHBondContact O-N 3.37Å; D168-Y171 WeakPolarHBondContact O-CA 3.44Å; D168-Y171 WeakPolarHBondContact O-CB 3.34Å; D168-Y171 PolarHBondContact O-N 3.14Å; D168-R188 VanDerWaalsContact CB-CZ 3.45Å; D168-R188 VanDerWaalsContact CB-NH1 3.31Å; D168-R188 WeakPolarHBondContact OD2-CD 3.48Å; D168-R188 IonicContact OD2-CZ 2.71Å; D168-R188 VanDerWaalsContact OD2-CZ 3.23Å; D168-R188 IonicContact OD2-NE 2.65Å; D168-R188 IonicContact OD2-NH1 3.66Å; D168-R188 PolarHBondContact OD2-NH1 3.18Å
169	P	40	Very low	51.5	Low	86 Å²	86	89 Å²	89	56%	0.558	49%	0.492	S	S	*	.	H	α-helix	trans	-57.8	-18.4	178.5	-22.1	31.3	0	0	0	114.4	Y171 M172 M173	P169-Y171 PolarHBondContact O-N 2.95Å; P169-M172 PolarHBondContact O-N 2.92Å; P169-M173 PolarHBondContact O-N 3.32Å; P169-M173 VanDerWaalsContact O-N 3.09Å
170	E	39.9	Very low	50.3	Low	165 Å²	165	88.2 Å²	88.2	77%	0.771	47%	0.474	S	S	*	.	H	α-helix	trans	-62.9	-27.6	171.4	-142	163.3	-148.5	0	0	111.3	D168 D174	D168-E170 PolarHBondContact O-N 3.37Å; E170-D174 PolarHBondContact O-N 2.9Å
171	Y	34.8	Very low	48.7	Very low	113 Å²	113	91.3 Å²	91.3	44%	0.443	49%	0.491	S	S	.	.	H	α-helix	trans	-66.9	-35.7	167.8	-160.8	-98.2	0	0	0	112.1	D168 P169 T175 I184	D168-Y171 WeakPolarHBondContact O-CA 3.44Å; D168-Y171 WeakPolarHBondContact O-CB 3.34Å; D168-Y171 PolarHBondContact O-N 3.14Å; P169-Y171 PolarHBondContact O-N 2.95Å; Y171-T175 HydrophobicContact CD1-CG2 3.74Å; Y171-T175 HydrophobicContact CD2-CG2 4.16Å; Y171-T175 HydrophobicContact CE1-CG2 3.59Å; Y171-T175 HydrophobicContact CE2-CG2 4.02Å; Y171-T175 HydrophobicContact CG-CG2 4.01Å; Y171-T175 VanDerWaalsContact O-CB 3.3Å; Y171-T175 WeakPolarHBondContact O-CB 3.26Å; Y171-T175 WeakPolarHBondContact O-CG2 3.24Å; Y171-T175 PolarHBondContact O-N 3.43Å; Y171-T175 PolarHBondContact O-OG1 3.15Å; Y171-I184 HydrophobicContact CE2-CD1 4.01Å; Y171-I184 HydrophobicContact CE2-CG1 4.4Å
172	M	33.2	Very low	47.3	Very low	160 Å²	160	92.1 Å²	92.1	79%	0.788	50%	0.499	S	S	*	.	H	α-helix	trans	-80.6	-23.5	-178.6	-68.4	-148.1	74.1	0	0	113.7	P169	P169-M172 PolarHBondContact O-N 2.92Å
173	M	38.7	Very low	45.8	Very low	173 Å²	173	93.8 Å²	93.8	85%	0.852	51%	0.511	S	S	*	.	H	α-helix	trans	-87.4	-22.3	179.6	-65.4	-164.2	-171.3	0	0	114	P169	P169-M173 PolarHBondContact O-N 3.32Å; P169-M173 VanDerWaalsContact O-N 3.09Å
174	D	36.6	Very low	44.4	Very low	111 Å²	111	94.5 Å²	94.5	59%	0.594	51%	0.514	S	S	*	.	H	α-helix	trans	-117.1	1.7	-174.2	-148.1	17.9	0	0	0	114.9	E170 G176 N177	E170-D174 PolarHBondContact O-N 2.9Å; D174-G176 PolarHBondContact O-N 3.39Å; D174-N177 PolarHBondContact O-N 3.15Å
175	T	35.7	Very low	43.2	Very low	71 Å²	71	95 Å²	95	44%	0.436	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	8.9	178.9	38.6	0	0	0	0	115.1	Y171 N177	Y171-T175 HydrophobicContact CD1-CG2 3.74Å; Y171-T175 HydrophobicContact CD2-CG2 4.16Å; Y171-T175 HydrophobicContact CE1-CG2 3.59Å; Y171-T175 HydrophobicContact CE2-CG2 4.02Å; Y171-T175 HydrophobicContact CG-CG2 4.01Å; Y171-T175 VanDerWaalsContact O-CB 3.3Å; Y171-T175 WeakPolarHBondContact O-CB 3.26Å; Y171-T175 WeakPolarHBondContact O-CG2 3.24Å; Y171-T175 PolarHBondContact O-N 3.43Å; Y171-T175 PolarHBondContact O-OG1 3.15Å; T175-N177 PolarHBondContact O-N 3.27Å
176	G	39.8	Very low	42.4	Very low	71 Å²	71	96.2 Å²	96.2	73%	0.732	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-22.3	165.3	0	0	0	0	0	113.9	D174	D174-G176 PolarHBondContact O-N 3.39Å
177	N	42	Very low	42.1	Very low	140 Å²	140	98 Å²	98	75%	0.749	54%	0.54	S	S	*	.	S	Bend	trans	-150.9	8.8	-171.2	-104.4	-20.8	0	0	0	118.7	D174 T175 Q179	D174-N177 PolarHBondContact O-N 3.15Å; T175-N177 PolarHBondContact O-N 3.27Å; N177-Q179 PolarHBondContact O-N 2.74Å
178	V	41.7	Very low	42.3	Very low	73 Å²	73	98.1 Å²	98.1	44%	0.442	53%	0.534	S	S	.	.			trans	-86.6	86.8	-176.1	-172.9	0	0	0	0	111.5	S180 S183	V178-S180 VanDerWaalsContact C-N 3.27Å; V178-S180 PolarHBondContact O-N 2.84Å; V178-S183 WeakPolarHBondContact CG1-OG 3.35Å
179	Q	40.8	Very low	42.8	Very low	188 Å²	188	95.2 Å²	95.2	88%	0.879	52%	0.519	S	S	*	.			trans	-77.6	14.3	-178.9	-75.1	-171.4	-2	0	0	115.8	N177	N177-Q179 PolarHBondContact O-N 2.74Å
180	S	47.4	Very low	43.8	Very low	67 Å²	67	92.7 Å²	92.7	47%	0.469	50%	0.503	S	S	.	.			trans	-145.8	129.4	177.6	69	0	0	0	0	115	V178 D182 S183	V178-S180 VanDerWaalsContact C-N 3.27Å; V178-S180 PolarHBondContact O-N 2.84Å; S180-D182 PolarHBondContact O-N 3.17Å; S180-D182 VanDerWaalsContact O-N 3.16Å; S180-S183 PolarHBondContact O-N 3.12Å; S180-S183 PolarHBondContact O-OG 3.36Å
181	I	46.2	Very low	44.9	Very low	103 Å²	103	87 Å²	87	53%	0.528	48%	0.481	S	S	.	.	H	α-helix	trans	-55.3	-26.7	175.6	-67.2	165.6	0	0	0	112.1	S183 I184	I181-S183 VanDerWaalsContact C-N 3.29Å; I181-S183 PolarHBondContact O-N 3.01Å; I181-I184 WeakPolarHBondContact O-CB 3.43Å; I181-I184 PolarHBondContact O-N 3.32Å
182	D	48.4	Very low	46.4	Very low	101 Å²	101	84.8 Å²	84.8	54%	0.54	48%	0.476	S	S	.	.	H	α-helix	trans	-61	-35.9	178.5	-106.3	18	0	0	0	112.9	R149 S180 I184 F185 T186	R149-D182 IonicContact NH1-OD1 3.65Å; R149-D182 PolarHBondContact NH1-OD1 3.46Å; S180-D182 PolarHBondContact O-N 3.17Å; S180-D182 VanDerWaalsContact O-N 3.16Å; D182-I184 VanDerWaalsContact C-N 3.3Å; D182-I184 PolarHBondContact O-N 3.04Å; D182-F185 PolarHBondContact O-N 3.33Å; D182-T186 PolarHBondContact O-N 3.41Å; D182-T186 PolarHBondContact O-OG1 3.1Å
183	S	46.5	Very low	48.3	Very low	39 Å²	39	77.8 Å²	77.8	27%	0.273	44%	0.441	S	S	.	.	H	α-helix	trans	-63.5	-35.6	178.8	65.6	0	0	0	0	112.9	V178 S180 I181 T186 S187	V178-S183 WeakPolarHBondContact CG1-OG 3.35Å; S180-S183 PolarHBondContact O-N 3.12Å; S180-S183 PolarHBondContact O-OG 3.36Å; I181-S183 VanDerWaalsContact C-N 3.29Å; I181-S183 PolarHBondContact O-N 3.01Å; S183-T186 VanDerWaalsContact C-OG1 3.28Å; S183-T186 VanDerWaalsContact CA-OG1 3.29Å; S183-T186 WeakPolarHBondContact CA-OG1 3.48Å; S183-T186 PolarHBondContact O-N 3.23Å; S183-T186 PolarHBondContact O-OG1 3.42Å; S183-S187 PolarHBondContact O-N 3.19Å; S183-S187 VanDerWaalsContact O-N 3.13Å
184	I	44.8	Very low	49.7	Very low	45 Å²	45	76.2 Å²	76.2	23%	0.231	43%	0.426	C	S	.	.	H	α-helix	trans	-67.5	-43	-178.4	-58	173.5	0	0	0	110.3	V164 Y171 I181 D182 T186 S187	V164-I184 HydrophobicContact CG1-CG2 4.4Å; Y171-I184 HydrophobicContact CE2-CD1 4.01Å; Y171-I184 HydrophobicContact CE2-CG1 4.4Å; I181-I184 WeakPolarHBondContact O-CB 3.43Å; I181-I184 PolarHBondContact O-N 3.32Å; D182-I184 VanDerWaalsContact C-N 3.3Å; D182-I184 PolarHBondContact O-N 3.04Å; I184-T186 VanDerWaalsContact C-N 3.3Å; I184-T186 PolarHBondContact O-N 3.48Å; I184-S187 PolarHBondContact O-N 3.11Å
185	F	44.6	Very low	51.4	Low	30 Å²	30	74.5 Å²	74.5	13%	0.132	42%	0.415	C	S	.	.	I	π-helix	trans	-62.8	-40.7	175.9	-166.6	-92.9	0	0	0	110.5	R149 G150 D182 V189	R149-F185 HydrophobicContact CB-CD1 4.29Å; R149-F185 HydrophobicContact CB-CD2 4.22Å; R149-F185 HydrophobicContact CB-CE1 3.81Å; R149-F185 HydrophobicContact CB-CE2 3.73Å; R149-F185 HydrophobicContact CB-CG 4.5Å; R149-F185 HydrophobicContact CB-CZ 3.54Å; R149-F185 HydrophobicContact CG-CE2 4.46Å; G150-F185 VanDerWaalsContact N-CZ 3.33Å; D182-F185 PolarHBondContact O-N 3.33Å; F185-V189 HydrophobicContact CD1-CB 4.36Å; F185-V189 HydrophobicContact CD2-CB 4.16Å; F185-V189 HydrophobicContact CD2-CG1 4.4Å; F185-V189 HydrophobicContact CD2-CG2 3.74Å; F185-V189 HydrophobicContact CE1-CB 4.18Å; F185-V189 HydrophobicContact CE1-CG1 4Å; F185-V189 HydrophobicContact CE2-CB 3.96Å; F185-V189 HydrophobicContact CE2-CG1 3.7Å; F185-V189 HydrophobicContact CE2-CG2 3.79Å; F185-V189 HydrophobicContact CG-CB 4.33Å; F185-V189 HydrophobicContact CG-CG2 4.22Å; F185-V189 HydrophobicContact CZ-CB 3.93Å; F185-V189 HydrophobicContact CZ-CG1 3.43Å; F185-V189 VanDerWaalsContact CZ-CG1 3.43Å; F185-V189 HydrophobicContact CZ-CG2 4.29Å; F185-V189 WeakPolarHBondContact O-CB 3.35Å; F185-V189 PolarHBondContact O-N 3.48Å
186	T	46.2	Very low	53.3	Low	91 Å²	91	71.1 Å²	71.1	56%	0.558	39%	0.394	S	S	*	.	I	π-helix	trans	-69.6	-31.1	-179.5	44.3	0	0	0	0	115.2	D182 S183 I184 S190	D182-T186 PolarHBondContact O-N 3.41Å; D182-T186 PolarHBondContact O-OG1 3.1Å; S183-T186 VanDerWaalsContact C-OG1 3.28Å; S183-T186 VanDerWaalsContact CA-OG1 3.29Å; S183-T186 WeakPolarHBondContact CA-OG1 3.48Å; S183-T186 PolarHBondContact O-N 3.23Å; S183-T186 PolarHBondContact O-OG1 3.42Å; I184-T186 VanDerWaalsContact C-N 3.3Å; I184-T186 PolarHBondContact O-N 3.48Å; T186-S190 WeakPolarHBondContact O-CB 3.36Å
187	S	49.4	Very low	55	Low	76 Å²	76	71.3 Å²	71.3	53%	0.531	38%	0.378	S	S	.	.	I	π-helix	trans	-76.9	-45.3	-173.5	75.9	0	0	0	0	113.6	S183 I184 P191	S183-S187 PolarHBondContact O-N 3.19Å; S183-S187 VanDerWaalsContact O-N 3.13Å; I184-S187 PolarHBondContact O-N 3.11Å; S187-P191 WeakPolarHBondContact O-CD 3.25Å
188	R	48.4	Very low	56.2	Low	82 Å²	82	66.5 Å²	66.5	31%	0.309	36%	0.357	S	S	.	.	I	π-helix	trans	-108.4	-30.9	-175.7	-79.3	-162.4	-91	-172.2	-1.1	115.8	H165 S166 D168 S190 P191	H165-R188 PolarHBondContact O-NH2 3.31Å; S166-R188 PolarHBondContact O-NH2 3.36Å; D168-R188 VanDerWaalsContact CB-CZ 3.45Å; D168-R188 VanDerWaalsContact CB-NH1 3.31Å; D168-R188 WeakPolarHBondContact OD2-CD 3.48Å; D168-R188 IonicContact OD2-CZ 2.71Å; D168-R188 VanDerWaalsContact OD2-CZ 3.23Å; D168-R188 IonicContact OD2-NE 2.65Å; D168-R188 IonicContact OD2-NH1 3.66Å; D168-R188 PolarHBondContact OD2-NH1 3.18Å; R188-S190 PolarHBondContact O-N 2.96Å; R188-P191 WeakPolarHBondContact O-CD 3.24Å
189	V	54.2	Low	57.6	Low	14 Å²	14	63.1 Å²	63.1	9%	0.085	34%	0.337	C	S	.	.	I	π-helix	trans	-72.2	-28.1	177.3	-171.6	0	0	0	0	109.9	F185 E193 Y226	F185-V189 HydrophobicContact CD1-CB 4.36Å; F185-V189 HydrophobicContact CD2-CB 4.16Å; F185-V189 HydrophobicContact CD2-CG1 4.4Å; F185-V189 HydrophobicContact CD2-CG2 3.74Å; F185-V189 HydrophobicContact CE1-CB 4.18Å; F185-V189 HydrophobicContact CE1-CG1 4Å; F185-V189 HydrophobicContact CE2-CB 3.96Å; F185-V189 HydrophobicContact CE2-CG1 3.7Å; F185-V189 HydrophobicContact CE2-CG2 3.79Å; F185-V189 HydrophobicContact CG-CB 4.33Å; F185-V189 HydrophobicContact CG-CG2 4.22Å; F185-V189 HydrophobicContact CZ-CB 3.93Å; F185-V189 HydrophobicContact CZ-CG1 3.43Å; F185-V189 VanDerWaalsContact CZ-CG1 3.43Å; F185-V189 HydrophobicContact CZ-CG2 4.29Å; F185-V189 WeakPolarHBondContact O-CB 3.35Å; F185-V189 PolarHBondContact O-N 3.48Å; V189-E193 HydrophobicContact CG1-CG 3.8Å; V189-E193 WeakPolarHBondContact O-CB 3.46Å; V189-E193 VanDerWaalsContact O-CG 3.31Å; V189-E193 WeakPolarHBondContact O-CG 3.2Å; V189-E193 PolarHBondContact O-N 3.15Å; V189-Y226 HydrophobicContact CG1-CE1 3.99Å
190	S	59.8	Low	59.2	Low	33 Å²	33	55.3 Å²	55.3	23%	0.231	30%	0.301	C	S	.	.	H	α-helix	trans	-64.4	-45.8	-175.3	-170	0	0	0	0	115.6	T186 R188 E193 R194	T186-S190 WeakPolarHBondContact O-CB 3.36Å; R188-S190 PolarHBondContact O-N 2.96Å; S190-E193 PolarHBondContact O-N 3.13Å; S190-R194 WeakPolarHBondContact O-CB 3.48Å; S190-R194 VanDerWaalsContact O-CG 3.31Å; S190-R194 WeakPolarHBondContact O-CG 3.46Å; S190-R194 PolarHBondContact O-N 2.89Å; S190-R194 PolarHBondContact OG-NH1 3.48Å
191	P	62.7	Low	60.3	Low	47 Å²	47	54.7 Å²	54.7	31%	0.305	30%	0.297	S	S	.	.	H	α-helix	trans	-62.9	-45.9	178	-22.9	33.2	0	0	0	113.4	S187 R188 R194 Q195	S187-P191 WeakPolarHBondContact O-CD 3.25Å; R188-P191 WeakPolarHBondContact O-CD 3.24Å; P191-R194 PolarHBondContact O-N 3.31Å; P191-Q195 WeakPolarHBondContact O-CG 3.48Å; P191-Q195 PolarHBondContact O-N 3.46Å
192	I	68	Low	61.5	Low	65 Å²	65	52 Å²	52	33%	0.333	29%	0.285	S	S	.	.	H	α-helix	trans	-64.2	-45.6	177.5	-62.5	174.7	0	0	0	109.5	R194 Q195 L196 N225	I192-R194 VanDerWaalsContact C-N 3.32Å; I192-R194 PolarHBondContact O-N 3.01Å; I192-Q195 PolarHBondContact O-N 3.48Å; I192-L196 VanDerWaalsContact O-CB 3.23Å; I192-L196 WeakPolarHBondContact O-CB 3.3Å; I192-L196 PolarHBondContact O-N 3.29Å; I192-N225 HydrophobicContact CG2-CB 4.06Å
193	E	72.8	Confident	62.5	Low	13 Å²	13	47.8 Å²	47.8	6%	0.061	26%	0.262	C	S	.	.	H	α-helix	trans	-54.3	-45.8	173.9	-91.2	-66.4	126.4	0	0	112.6	Y148 K151 A152 V189 S190 L196 L197 Y226	Y148-E193 PolarHBondContact OH-OE1 3.07Å; K151-E193 PolarHBondContact N-OE2 3.45Å; A152-E193 WeakPolarHBondContact CB-OE1 3.31Å; A152-E193 WeakPolarHBondContact CB-OE2 3.19Å; A152-E193 PolarHBondContact N-OE2 2.86Å; V189-E193 HydrophobicContact CG1-CG 3.8Å; V189-E193 WeakPolarHBondContact O-CB 3.46Å; V189-E193 VanDerWaalsContact O-CG 3.31Å; V189-E193 WeakPolarHBondContact O-CG 3.2Å; V189-E193 PolarHBondContact O-N 3.15Å; S190-E193 PolarHBondContact O-N 3.13Å; E193-L196 PolarHBondContact O-N 3.06Å; E193-L197 VanDerWaalsContact O-CB 3.3Å; E193-L197 WeakPolarHBondContact O-CB 3.06Å; E193-L197 VanDerWaalsContact O-CG 3.29Å; E193-L197 WeakPolarHBondContact O-CG 3.08Å; E193-L197 PolarHBondContact O-N 3Å; E193-Y226 WeakPolarHBondContact CG-OH 3.14Å; E193-Y226 PolarHBondContact OE1-OH 3.45Å; E193-Y226 VanDerWaalsContact OE1-OH 3.11Å
194	R	68.3	Low	63.7	Low	140 Å²	140	48 Å²	48	53%	0.528	27%	0.266	S	S	.	.	H	α-helix	trans	-63.4	-44	179.9	-78.3	-173.2	-66.4	-110.3	0.3	111.7	S190 P191 I192 A198	S190-R194 WeakPolarHBondContact O-CB 3.48Å; S190-R194 VanDerWaalsContact O-CG 3.31Å; S190-R194 WeakPolarHBondContact O-CG 3.46Å; S190-R194 PolarHBondContact O-N 2.89Å; S190-R194 PolarHBondContact OG-NH1 3.48Å; P191-R194 PolarHBondContact O-N 3.31Å; I192-R194 VanDerWaalsContact C-N 3.32Å; I192-R194 PolarHBondContact O-N 3.01Å; R194-A198 WeakPolarHBondContact O-CB 3.43Å; R194-A198 PolarHBondContact O-N 2.84Å
195	Q	71.5	Confident	65	Low	76 Å²	76	52.3 Å²	52.3	36%	0.355	29%	0.29	S	S	.	.	H	α-helix	trans	-66.1	-41.8	177.4	-69.8	179.5	14.5	0	0	111.2	P191 I192 A198 A199 L277	P191-Q195 WeakPolarHBondContact O-CG 3.48Å; P191-Q195 PolarHBondContact O-N 3.46Å; I192-Q195 PolarHBondContact O-N 3.48Å; Q195-A198 PolarHBondContact O-N 2.83Å; Q195-A199 PolarHBondContact O-N 2.81Å; Q195-L277 HydrophobicContact CB-CD1 4.17Å
196	L	75.5	Confident	66.2	Low	0 Å²	0	53 Å²	53	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-67.1	-43.7	-179.8	-164.1	52.3	0	0	0	111.9	A152 C153 I192 E193 A198 A199 I200 N225 Y226 L277	A152-L196 HydrophobicContact CB-CB 3.77Å; A152-L196 HydrophobicContact CB-CD2 3.94Å; A152-L196 HydrophobicContact CB-CG 3.75Å; C153-L196 WeakPolarHBondContact SG-CD2 3.19Å; I192-L196 VanDerWaalsContact O-CB 3.23Å; I192-L196 WeakPolarHBondContact O-CB 3.3Å; I192-L196 PolarHBondContact O-N 3.29Å; E193-L196 PolarHBondContact O-N 3.06Å; L196-A198 PolarHBondContact O-N 2.85Å; L196-A199 PolarHBondContact O-N 2.83Å; L196-I200 HydrophobicContact CD1-CD1 3.81Å; L196-I200 HydrophobicContact CD1-CG1 4.15Å; L196-I200 HydrophobicContact CG-CD1 3.67Å; L196-I200 HydrophobicContact CG-CG1 4.41Å; L196-I200 VanDerWaalsContact O-CB 3.3Å; L196-I200 WeakPolarHBondContact O-CB 3.31Å; L196-I200 WeakPolarHBondContact O-CD1 3.35Å; L196-I200 WeakPolarHBondContact O-CG1 3.39Å; L196-I200 PolarHBondContact O-N 2.77Å; L196-N225 HydrophobicContact CD2-CB 4.42Å; L196-Y226 HydrophobicContact CD2-CD2 4.37Å; L196-Y226 HydrophobicContact CD2-CE2 3.72Å; L196-L277 HydrophobicContact CB-CD1 3.86Å; L196-L277 HydrophobicContact CD1-CD1 3.73Å; L196-L277 HydrophobicContact CD1-CD2 3.99Å; L196-L277 HydrophobicContact CD1-CG 3.93Å; L196-L277 HydrophobicContact CG-CD1 4.29Å
197	L	75.2	Confident	67.4	Low	75 Å²	75	54.6 Å²	54.6	39%	0.393	31%	0.311	S	S	.	.	H	α-helix	trans	-57.6	-47.3	171.5	-80	167.6	0	0	0	111.6	K151 A152 E193 S201	K151-L197 HydrophobicContact CB-CD1 4.39Å; K151-L197 HydrophobicContact CB-CD2 4.18Å; A152-L197 HydrophobicContact CB-CD2 4.03Å; A152-L197 HydrophobicContact CB-CG 3.77Å; E193-L197 VanDerWaalsContact O-CB 3.3Å; E193-L197 WeakPolarHBondContact O-CB 3.06Å; E193-L197 VanDerWaalsContact O-CG 3.29Å; E193-L197 WeakPolarHBondContact O-CG 3.08Å; E193-L197 PolarHBondContact O-N 3Å; L197-S201 WeakPolarHBondContact O-CB 3.24Å; L197-S201 PolarHBondContact O-N 3.25Å; L197-S201 PolarHBondContact O-OG 3.49Å
198	A	68	Low	68.4	Low	39 Å²	39	56.5 Å²	56.5	32%	0.322	32%	0.316	S	S	.	.	H	α-helix	trans	-60.5	-50.6	179.5	0	0	0	0	0	110.9	R194 Q195 L196 S201 V202	R194-A198 WeakPolarHBondContact O-CB 3.43Å; R194-A198 PolarHBondContact O-N 2.84Å; Q195-A198 PolarHBondContact O-N 2.83Å; L196-A198 PolarHBondContact O-N 2.85Å; A198-S201 PolarHBondContact O-N 3.31Å; A198-S201 PolarHBondContact O-OG 2.97Å; A198-V202 WeakPolarHBondContact O-CG2 3.46Å; A198-V202 PolarHBondContact O-N 2.97Å
199	A	71.5	Confident	69.6	Low	2 Å²	2	53.5 Å²	53.5	2%	0.017	31%	0.306	C	S	.	.	H	α-helix	trans	-67.3	-44.9	-178.4	0	0	0	0	0	113.5	Q195 L196 S201 V202 I203 I272 L277	Q195-A199 PolarHBondContact O-N 2.81Å; L196-A199 PolarHBondContact O-N 2.83Å; A199-S201 PolarHBondContact O-N 3.26Å; A199-V202 PolarHBondContact O-N 3.13Å; A199-I203 WeakPolarHBondContact O-CG1 3.4Å; A199-I203 PolarHBondContact O-N 2.8Å; A199-I272 HydrophobicContact CB-CB 4.4Å; A199-I272 HydrophobicContact CB-CG1 3.91Å; A199-I272 HydrophobicContact CB-CG2 4.06Å; A199-L277 HydrophobicContact CB-CD2 3.05Å
200	I	73.8	Confident	70.6	Confident	23 Å²	23	53.7 Å²	53.7	12%	0.118	31%	0.308	C	S	.	.	H	α-helix	trans	-59.5	-41.2	175.8	-68.5	166.1	0	0	0	109.5	A152 L196 V202 I203 A204 E218	A152-I200 HydrophobicContact CB-CD1 4.29Å; A152-I200 WeakPolarHBondContact O-CD1 3.33Å; L196-I200 HydrophobicContact CD1-CD1 3.81Å; L196-I200 HydrophobicContact CD1-CG1 4.15Å; L196-I200 HydrophobicContact CG-CD1 3.67Å; L196-I200 HydrophobicContact CG-CG1 4.41Å; L196-I200 VanDerWaalsContact O-CB 3.3Å; L196-I200 WeakPolarHBondContact O-CB 3.31Å; L196-I200 WeakPolarHBondContact O-CD1 3.35Å; L196-I200 WeakPolarHBondContact O-CG1 3.39Å; L196-I200 PolarHBondContact O-N 2.77Å; I200-V202 VanDerWaalsContact C-N 3.35Å; I200-V202 PolarHBondContact O-N 2.67Å; I200-I203 PolarHBondContact O-N 3.25Å; I200-A204 WeakPolarHBondContact O-CB 3.39Å; I200-A204 PolarHBondContact O-N 2.86Å; I200-E218 HydrophobicContact CD1-CG 3.93Å; I200-E218 HydrophobicContact CG1-CG 4.33Å; I200-E218 HydrophobicContact CG2-CG 4.35Å
201	S	71.5	Confident	71.5	Confident	55 Å²	55	58.6 Å²	58.6	39%	0.385	33%	0.328	S	S	.	.	H	α-helix	trans	-64.3	-37.4	178.4	77.6	0	0	0	0	113	L197 A198 A199 N205	L197-S201 WeakPolarHBondContact O-CB 3.24Å; L197-S201 PolarHBondContact O-N 3.25Å; L197-S201 PolarHBondContact O-OG 3.49Å; A198-S201 PolarHBondContact O-N 3.31Å; A198-S201 PolarHBondContact O-OG 2.97Å; A199-S201 PolarHBondContact O-N 3.26Å; S201-N205 VanDerWaalsContact O-CB 3.31Å; S201-N205 WeakPolarHBondContact O-CB 3.37Å; S201-N205 PolarHBondContact O-N 3.13Å; S201-N205 PolarHBondContact O-ND2 3.32Å; S201-N205 VanDerWaalsContact O-ND2 3.12Å
202	V	70.6	Confident	72	Confident	45 Å²	45	56.7 Å²	56.7	27%	0.273	32%	0.316	S	S	.	.	H	α-helix	trans	-66.3	-51.2	175.3	174.1	0	0	0	0	109.5	A198 A199 I200 A204 N205 T206 I272	A198-V202 WeakPolarHBondContact O-CG2 3.46Å; A198-V202 PolarHBondContact O-N 2.97Å; A199-V202 PolarHBondContact O-N 3.13Å; I200-V202 VanDerWaalsContact C-N 3.35Å; I200-V202 PolarHBondContact O-N 2.67Å; V202-A204 VanDerWaalsContact C-N 3.33Å; V202-A204 PolarHBondContact O-N 2.84Å; V202-N205 PolarHBondContact O-N 3.34Å; V202-T206 WeakPolarHBondContact O-CB 3.29Å; V202-T206 PolarHBondContact O-N 2.97Å; V202-T206 PolarHBondContact O-OG1 3.33Å; V202-I272 HydrophobicContact CB-CD1 3.91Å; V202-I272 HydrophobicContact CG1-CD1 3.7Å
203	I	69.5	Low	72.7	Confident	14 Å²	14	53.8 Å²	53.8	7%	0.072	30%	0.301	C	S	.	.	H	α-helix	trans	-59.6	-45.1	-179.5	-63.2	167.5	0	0	0	110.7	A199 I200 N205 T206 V209 K214 S217 I272	A199-I203 WeakPolarHBondContact O-CG1 3.4Å; A199-I203 PolarHBondContact O-N 2.8Å; I200-I203 PolarHBondContact O-N 3.25Å; I203-N205 PolarHBondContact O-N 2.99Å; I203-T206 PolarHBondContact O-N 2.79Å; I203-V209 HydrophobicContact CG2-CG1 4Å; I203-K214 HydrophobicContact CG2-CG 4.23Å; I203-K214 WeakPolarHBondContact O-CE 3.48Å; I203-S217 WeakPolarHBondContact CG2-OG 3.32Å; I203-I272 HydrophobicContact CG1-CD1 4.45Å
204	A	71	Confident	73.2	Confident	42 Å²	42	54.9 Å²	54.9	35%	0.347	31%	0.306	S	S	.	.	H	α-helix	trans	-64.3	-40.6	-178.7	0	0	0	0	0	113.2	I200 V202 K214	I200-A204 WeakPolarHBondContact O-CB 3.39Å; I200-A204 PolarHBondContact O-N 2.86Å; V202-A204 VanDerWaalsContact C-N 3.33Å; V202-A204 PolarHBondContact O-N 2.84Å; A204-K214 WeakPolarHBondContact O-CE 3.38Å; A204-K214 PolarHBondContact O-NZ 3.49Å
205	N	72.3	Confident	73.8	Confident	136 Å²	136	49.9 Å²	49.9	73%	0.727	29%	0.292	S	S	*	.	H	α-helix	trans	-88	-7.8	-177.1	-69.3	-36.4	0	0	0	114	S201 V202 I203 S207	S201-N205 VanDerWaalsContact O-CB 3.31Å; S201-N205 WeakPolarHBondContact O-CB 3.37Å; S201-N205 PolarHBondContact O-N 3.13Å; S201-N205 PolarHBondContact O-ND2 3.32Å; S201-N205 VanDerWaalsContact O-ND2 3.12Å; V202-N205 PolarHBondContact O-N 3.34Å; I203-N205 PolarHBondContact O-N 2.99Å; N205-S207 PolarHBondContact O-N 3.34Å
206	T	69.9	Low	74.4	Confident	46 Å²	46	46.9 Å²	46.9	28%	0.282	28%	0.278	S	S	.	.			trans	-73.5	121.3	178.2	-55.1	0	0	0	0	109.6	V202 I203 N208 V209 K214	V202-T206 WeakPolarHBondContact O-CB 3.29Å; V202-T206 PolarHBondContact O-N 2.97Å; V202-T206 PolarHBondContact O-OG1 3.33Å; I203-T206 PolarHBondContact O-N 2.79Å; T206-N208 VanDerWaalsContact C-N 3.33Å; T206-N208 WeakPolarHBondContact CG2-OD1 3.09Å; T206-N208 PolarHBondContact O-N 3.15Å; T206-V209 HydrophobicContact CG2-CG2 3.77Å; T206-V209 PolarHBondContact O-N 3.14Å; T206-K214 WeakPolarHBondContact O-CE 3.47Å; T206-K214 PolarHBondContact O-NZ 3.08Å
207	S	71.2	Confident	74.8	Confident	123 Å²	123	47 Å²	47	86%	0.86	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-23.7	-173.1	58.7	0	0	0	0	114	N205 V209	N205-S207 PolarHBondContact O-N 3.34Å; S207-V209 VanDerWaalsContact C-N 3.33Å
208	N	71.1	Confident	75.3	Confident	117 Å²	117	44.6 Å²	44.6	63%	0.626	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	1.9	177.7	71	-5.6	0	0	0	113.2	T206	T206-N208 VanDerWaalsContact C-N 3.33Å; T206-N208 WeakPolarHBondContact CG2-OD1 3.09Å; T206-N208 PolarHBondContact O-N 3.15Å
209	V	74.1	Confident	76.2	Confident	18 Å²	18	44 Å²	44	11%	0.109	26%	0.256	C	S	.	.	S	Bend	trans	-93.5	130.7	178.4	178.4	0	0	0	0	109.8	I203 T206 S207 C213 K214 E262	I203-V209 HydrophobicContact CG2-CG1 4Å; T206-V209 HydrophobicContact CG2-CG2 3.77Å; T206-V209 PolarHBondContact O-N 3.14Å; S207-V209 VanDerWaalsContact C-N 3.33Å; V209-C213 HydrophobicContact CG1-CB 3.82Å; V209-K214 HydrophobicContact CB-CG 4.38Å; V209-K214 HydrophobicContact CG1-CG 3.66Å; V209-K214 WeakPolarHBondContact O-CE 3.46Å; V209-E262 VanDerWaalsContact CA-CD 3.47Å; V209-E262 WeakPolarHBondContact CA-OE2 3.38Å; V209-E262 VanDerWaalsContact CG1-OE2 3.25Å; V209-E262 WeakPolarHBondContact CG1-OE2 3.16Å; V209-E262 HydrophobicContact CG2-CB 4.24Å; V209-E262 HydrophobicContact CG2-CG 4.24Å
210	S	75	Confident	76.9	Confident	18 Å²	18	44 Å²	44	13%	0.126	26%	0.255	C	S	.	.			trans	-68.6	149.7	179	69.6	0	0	0	0	113.3	A212 C213 K214 E262	S210-A212 VanDerWaalsContact C-N 3.25Å; S210-A212 PolarHBondContact O-N 3.29Å; S210-C213 WeakPolarHBondContact O-CA 3.23Å; S210-C213 WeakPolarHBondContact O-CB 3.26Å; S210-C213 PolarHBondContact O-N 2.86Å; S210-C213 WeakPolarHBondContact OG-CB 2.97Å; S210-C213 PolarHBondContact OG-N 3.19Å; S210-C213 VanDerWaalsContact OG-N 3.14Å; S210-K214 WeakPolarHBondContact O-CG 3.34Å; S210-K214 PolarHBondContact O-N 3.15Å; S210-E262 PolarHBondContact N-OE1 3.04Å; S210-E262 PolarHBondContact N-OE2 3.5Å; S210-E262 VanDerWaalsContact N-OE2 3.16Å
211	E	78.2	Confident	77.4	Confident	137 Å²	137	43 Å²	43	64%	0.64	25%	0.25	S	S	*	.	H	α-helix	trans	-61.3	-35.4	179	-166.2	58.6	-148.6	0	0	112.3	K214 S215	E211-K214 PolarHBondContact O-N 3.37Å; E211-S215 PolarHBondContact O-N 2.9Å
212	A	74.2	Confident	78.1	Confident	7 Å²	7	40.3 Å²	40.3	6%	0.058	23%	0.232	C	C	.	.	H	α-helix	trans	-62.7	-43.5	172.2	0	0	0	0	0	112	S210 S215 Y216 I258	S210-A212 VanDerWaalsContact C-N 3.25Å; S210-A212 PolarHBondContact O-N 3.29Å; A212-S215 PolarHBondContact O-N 3.48Å; A212-Y216 WeakPolarHBondContact O-CB 3.44Å; A212-Y216 PolarHBondContact O-N 2.84Å; A212-I258 HydrophobicContact CB-CG2 4.03Å
213	C	82.3	Confident	78.9	Confident	3 Å²	3	38.9 Å²	38.9	2%	0.02	22%	0.222	C	C	.	.	H	α-helix	trans	-62.1	-45.6	175.4	176.8	0	0	0	0	111.3	V209 S210 S215 Y216 S217 I258 C259 E262	V209-C213 HydrophobicContact CG1-CB 3.82Å; S210-C213 WeakPolarHBondContact O-CA 3.23Å; S210-C213 WeakPolarHBondContact O-CB 3.26Å; S210-C213 PolarHBondContact O-N 2.86Å; S210-C213 WeakPolarHBondContact OG-CB 2.97Å; S210-C213 PolarHBondContact OG-N 3.19Å; S210-C213 VanDerWaalsContact OG-N 3.14Å; C213-S215 PolarHBondContact O-N 3.5Å; C213-Y216 PolarHBondContact O-N 3.48Å; C213-S217 WeakPolarHBondContact O-CB 3.32Å; C213-S217 PolarHBondContact O-N 2.97Å; C213-S217 PolarHBondContact O-OG 2.9Å; C213-I258 HydrophobicContact CB-CG2 4.24Å; C213-C259 WeakPolarHBondContact CA-SG 3.05Å; C213-C259 HydrophobicContact CB-CB 3.9Å; C213-C259 WeakPolarHBondContact CB-SG 3.21Å; C213-C259 WeakPolarHBondContact SG-CB 3.27Å; C213-C259 CovalentContact SG-SG 2.02Å; C213-C259 PolarHBondContact SG-SG 2.89Å; C213-E262 WeakPolarHBondContact CB-OE2 3.39Å; C213-E262 PolarHBondContact SG-OE2 3.37Å
214	K	81.8	Confident	79.5	Confident	37 Å²	37	41.2 Å²	41.2	16%	0.161	23%	0.232	C	C	.	.	H	α-helix	trans	-56	-51.6	176.5	-67.2	174.2	-176.7	-175.4	0	111.5	I203 A204 T206 V209 S210 E211 S217 E218	I203-K214 HydrophobicContact CG2-CG 4.23Å; I203-K214 WeakPolarHBondContact O-CE 3.48Å; A204-K214 WeakPolarHBondContact O-CE 3.38Å; A204-K214 PolarHBondContact O-NZ 3.49Å; T206-K214 WeakPolarHBondContact O-CE 3.47Å; T206-K214 PolarHBondContact O-NZ 3.08Å; V209-K214 HydrophobicContact CB-CG 4.38Å; V209-K214 HydrophobicContact CG1-CG 3.66Å; V209-K214 WeakPolarHBondContact O-CE 3.46Å; S210-K214 WeakPolarHBondContact O-CG 3.34Å; S210-K214 PolarHBondContact O-N 3.15Å; E211-K214 PolarHBondContact O-N 3.37Å; K214-S217 PolarHBondContact O-OG 3.22Å; K214-S217 VanDerWaalsContact O-OG 3.07Å; K214-E218 PolarHBondContact O-N 3.38Å
215	S	81.5	Confident	80	Confident	35 Å²	35	41 Å²	41	25%	0.245	23%	0.225	C	C	.	.	H	α-helix	trans	-66.5	-44.7	-177.7	-172.7	0	0	0	0	112.9	E211 A212 C213 Q219	E211-S215 PolarHBondContact O-N 2.9Å; A212-S215 PolarHBondContact O-N 3.48Å; C213-S215 PolarHBondContact O-N 3.5Å; S215-Q219 WeakPolarHBondContact O-CG 3.39Å; S215-Q219 PolarHBondContact O-N 3.47Å
216	Y	84.4	Confident	80.4	Confident	13 Å²	13	35.3 Å²	35.3	5%	0.051	19%	0.194	C	C	.	.	H	α-helix	trans	-76.3	-34.8	-175.8	-170.6	-97.2	0	0	0	112.5	A212 C213 E218 Q219 V220 D250 L253 L254 I258 V294 V295 L298	A212-Y216 WeakPolarHBondContact O-CB 3.44Å; A212-Y216 PolarHBondContact O-N 2.84Å; C213-Y216 PolarHBondContact O-N 3.48Å; Y216-E218 VanDerWaalsContact C-N 3.34Å; Y216-E218 PolarHBondContact O-N 3.49Å; Y216-Q219 PolarHBondContact O-N 3.16Å; Y216-V220 HydrophobicContact CD1-CG2 3.78Å; Y216-V220 HydrophobicContact CE1-CG2 3.37Å; Y216-V220 HydrophobicContact CE2-CG2 4.47Å; Y216-V220 PolarHBondContact O-N 2.76Å; Y216-D250 WeakPolarHBondContact CE1-O 3.44Å; Y216-D250 WeakPolarHBondContact OH-CA 3.48Å; Y216-D250 PolarHBondContact OH-O 3.07Å; Y216-L253 HydrophobicContact CE1-CB 3.93Å; Y216-L253 WeakPolarHBondContact OH-CD1 3.29Å; Y216-L254 HydrophobicContact CD1-CD2 3.6Å; Y216-L254 HydrophobicContact CD1-CG 3.88Å; Y216-L254 HydrophobicContact CE1-CD2 4.21Å; Y216-L254 HydrophobicContact CE1-CG 3.97Å; Y216-I258 HydrophobicContact CD1-CD1 3.19Å; Y216-I258 HydrophobicContact CD2-CD1 3.81Å; Y216-I258 HydrophobicContact CE1-CD1 3.57Å; Y216-I258 HydrophobicContact CE2-CD1 4.16Å; Y216-I258 HydrophobicContact CG-CD1 3.3Å; Y216-V294 HydrophobicContact CE2-CG1 4.02Å; Y216-V295 HydrophobicContact CE2-CG2 4.26Å; Y216-L298 HydrophobicContact CD2-CD1 3.97Å; Y216-L298 HydrophobicContact CE2-CD1 4.02Å
217	S	84.4	Confident	80.7	Confident	3 Å²	3	34.9 Å²	34.9	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-64.8	-36.8	174.7	61.5	0	0	0	0	112.4	I203 C213 K214 S221	I203-S217 WeakPolarHBondContact CG2-OG 3.32Å; C213-S217 WeakPolarHBondContact O-CB 3.32Å; C213-S217 PolarHBondContact O-N 2.97Å; C213-S217 PolarHBondContact O-OG 2.9Å; K214-S217 PolarHBondContact O-OG 3.22Å; K214-S217 VanDerWaalsContact O-OG 3.07Å; S217-S221 WeakPolarHBondContact O-CB 3.14Å; S217-S221 PolarHBondContact O-N 3.14Å; S217-S221 PolarHBondContact O-OG 2.85Å
218	E	85.2	Confident	81	Confident	23 Å²	23	30.7 Å²	30.7	11%	0.107	16%	0.158	C	C	.	.	H	α-helix	trans	-60.3	-48.6	171.5	-173.4	179.5	147.8	0	0	110.6	R155 V156 I200 K214 Y216 V220 S221 C222	R155-E218 IonicContact CZ-OE1 2.64Å; R155-E218 IonicContact CZ-OE2 2.76Å; R155-E218 VanDerWaalsContact CZ-OE2 3.3Å; R155-E218 IonicContact NE-OE1 2.59Å; R155-E218 PolarHBondContact NE-OE1 2.91Å; R155-E218 IonicContact NE-OE2 3.04Å; R155-E218 PolarHBondContact NE-OE2 3.45Å; R155-E218 IonicContact NH2-OE1 2.8Å; R155-E218 IonicContact NH2-OE2 3.97Å; R155-E218 PolarHBondContact NH2-OE2 2.91Å; V156-E218 HydrophobicContact CG2-CG 3.89Å; I200-E218 HydrophobicContact CD1-CG 3.93Å; I200-E218 HydrophobicContact CG1-CG 4.33Å; I200-E218 HydrophobicContact CG2-CG 4.35Å; K214-E218 PolarHBondContact O-N 3.38Å; Y216-E218 VanDerWaalsContact C-N 3.34Å; Y216-E218 PolarHBondContact O-N 3.49Å; E218-V220 PolarHBondContact O-N 3.04Å; E218-S221 PolarHBondContact O-N 3.5Å; E218-C222 WeakPolarHBondContact O-CB 3.49Å; E218-C222 PolarHBondContact O-N 2.93Å; E218-C222 PolarHBondContact O-SG 3.22Å
219	Q	86	Confident	81.1	Confident	28 Å²	28	26.2 Å²	26.2	13%	0.131	14%	0.135	C	C	.	.	H	α-helix	trans	-60.3	-50.4	-179.5	-68.8	161	-10.6	0	0	112.2	V156 S215 Y216 S221 C222 Y223 V294 L298	V156-Q219 HydrophobicContact CG1-CG 4.31Å; V156-Q219 HydrophobicContact CG2-CG 4.01Å; S215-Q219 WeakPolarHBondContact O-CG 3.39Å; S215-Q219 PolarHBondContact O-N 3.47Å; Y216-Q219 PolarHBondContact O-N 3.16Å; Q219-S221 VanDerWaalsContact C-N 3.35Å; Q219-S221 PolarHBondContact O-N 3.26Å; Q219-C222 PolarHBondContact O-N 2.76Å; Q219-Y223 WeakPolarHBondContact O-CD2 3.38Å; Q219-Y223 PolarHBondContact O-N 2.84Å; Q219-V294 HydrophobicContact CB-CG1 4.08Å; Q219-L298 HydrophobicContact CG-CD2 4.07Å
220	V	86.8	Confident	80.5	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.2	-43.8	177.3	165.5	0	0	0	0	111.3	Y216 E218 C222 H224 L246 L254 P279 V294	Y216-V220 HydrophobicContact CD1-CG2 3.78Å; Y216-V220 HydrophobicContact CE1-CG2 3.37Å; Y216-V220 HydrophobicContact CE2-CG2 4.47Å; Y216-V220 PolarHBondContact O-N 2.76Å; E218-V220 PolarHBondContact O-N 3.04Å; V220-C222 VanDerWaalsContact C-N 3.33Å; V220-C222 PolarHBondContact O-N 3.2Å; V220-H224 WeakPolarHBondContact O-CB 3.26Å; V220-H224 PolarHBondContact O-N 2.79Å; V220-L246 HydrophobicContact CG1-CD2 3.51Å; V220-L254 HydrophobicContact CB-CD1 3.72Å; V220-L254 HydrophobicContact CG1-CD1 3.4Å; V220-L254 HydrophobicContact CG2-CD1 3.95Å; V220-L254 HydrophobicContact CG2-CG 4.37Å; V220-P279 HydrophobicContact CG1-CG 3.66Å; V220-V294 HydrophobicContact CG2-CG2 4.5Å
221	S	84.3	Confident	79.4	Confident	2 Å²	2	34.2 Å²	34.2	1%	0.014	17%	0.172	C	C	.	.	H	α-helix	trans	-64.4	-39.8	179.3	-55.4	0	0	0	0	111.1	S217 E218 Q219 H224 N225	S217-S221 WeakPolarHBondContact O-CB 3.14Å; S217-S221 PolarHBondContact O-N 3.14Å; S217-S221 PolarHBondContact O-OG 2.85Å; E218-S221 PolarHBondContact O-N 3.5Å; Q219-S221 VanDerWaalsContact C-N 3.35Å; Q219-S221 PolarHBondContact O-N 3.26Å; S221-H224 PolarHBondContact O-N 2.83Å; S221-N225 WeakPolarHBondContact O-CB 3.46Å; S221-N225 PolarHBondContact O-N 3.02Å; S221-N225 VanDerWaalsContact O-N 3.09Å; S221-N225 PolarHBondContact O-ND2 3.41Å
222	C	87.1	Confident	78	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.4	-50.7	177	-69.3	0	0	0	0	112.8	C153 V156 L157 E218 Q219 V220 H224 N225 Y226	C153-C222 WeakPolarHBondContact CA-SG 3.04Å; C153-C222 HydrophobicContact CB-CB 3.73Å; C153-C222 WeakPolarHBondContact CB-SG 3.43Å; C153-C222 WeakPolarHBondContact SG-CA 3.29Å; C153-C222 WeakPolarHBondContact SG-CB 3.04Å; C153-C222 CovalentContact SG-SG 2.02Å; C153-C222 PolarHBondContact SG-SG 2.89Å; V156-C222 HydrophobicContact CB-CB 4.04Å; V156-C222 HydrophobicContact CG1-CB 3.92Å; V156-C222 HydrophobicContact CG2-CB 4.38Å; L157-C222 HydrophobicContact CD1-CB 4.42Å; L157-C222 HydrophobicContact CG-CB 4.43Å; E218-C222 WeakPolarHBondContact O-CB 3.49Å; E218-C222 PolarHBondContact O-N 2.93Å; E218-C222 PolarHBondContact O-SG 3.22Å; Q219-C222 PolarHBondContact O-N 2.76Å; V220-C222 VanDerWaalsContact C-N 3.33Å; V220-C222 PolarHBondContact O-N 3.2Å; C222-H224 VanDerWaalsContact C-N 3.26Å; C222-H224 PolarHBondContact O-N 3.49Å; C222-N225 PolarHBondContact O-N 3.33Å; C222-Y226 WeakPolarHBondContact O-CB 3.18Å; C222-Y226 PolarHBondContact O-N 3.22Å
223	Y	86	Confident	76.5	Confident	14 Å²	14	38.4 Å²	38.4	6%	0.055	19%	0.192	C	C	.	.	H	α-helix	trans	-70.8	-21.4	178.8	-69.3	-57	0	0	0	113.5	V156 L157 Q219 V228 V292 V294 L297	V156-Y223 HydrophobicContact CG1-CD2 4.36Å; V156-Y223 HydrophobicContact CG1-CE1 4.5Å; V156-Y223 HydrophobicContact CG1-CE2 3.75Å; L157-Y223 HydrophobicContact CD2-CD1 4.03Å; L157-Y223 HydrophobicContact CD2-CE1 3.62Å; Q219-Y223 WeakPolarHBondContact O-CD2 3.38Å; Q219-Y223 PolarHBondContact O-N 2.84Å; Y223-V228 HydrophobicContact CD1-CG2 3.96Å; Y223-V228 HydrophobicContact CE1-CG2 3.77Å; Y223-V292 HydrophobicContact CD1-CG1 4.41Å; Y223-V292 HydrophobicContact CG-CG1 4.36Å; Y223-V294 HydrophobicContact CD2-CB 4.47Å; Y223-V294 HydrophobicContact CD2-CG1 4.12Å; Y223-V294 HydrophobicContact CD2-CG2 3.72Å; Y223-V294 HydrophobicContact CE2-CG1 4.37Å; Y223-V294 HydrophobicContact CG-CG2 4.27Å; Y223-L297 HydrophobicContact CD1-CD1 4.14Å; Y223-L297 HydrophobicContact CD2-CD1 4.36Å; Y223-L297 HydrophobicContact CE1-CD1 3.8Å; Y223-L297 HydrophobicContact CE2-CD1 4.01Å; Y223-L297 HydrophobicContact CG-CD1 4.42Å
224	H	83.4	Confident	74.5	Confident	63 Å²	63	41.3 Å²	41.3	29%	0.292	22%	0.216	S	C	.	.	H	α-helix	trans	-73.5	-40.7	172.1	-179.1	46.8	0	0	0	112.3	V220 S221 C222 P279	V220-H224 WeakPolarHBondContact O-CB 3.26Å; V220-H224 PolarHBondContact O-N 2.79Å; S221-H224 PolarHBondContact O-N 2.83Å; C222-H224 VanDerWaalsContact C-N 3.26Å; C222-H224 PolarHBondContact O-N 3.49Å; H224-P279 HydrophobicContact CB-CG 4.38Å
225	N	79.9	Confident	72.4	Confident	38 Å²	38	47.6 Å²	47.6	20%	0.203	25%	0.246	C	C	.	.	H	α-helix	trans	-91.7	-21.5	-174.3	-72.6	-85.3	0	0	0	113.4	I192 L196 S221 C222 L277	I192-N225 HydrophobicContact CG2-CB 4.06Å; L196-N225 HydrophobicContact CD2-CB 4.42Å; S221-N225 WeakPolarHBondContact O-CB 3.46Å; S221-N225 PolarHBondContact O-N 3.02Å; S221-N225 VanDerWaalsContact O-N 3.09Å; S221-N225 PolarHBondContact O-ND2 3.41Å; C222-N225 PolarHBondContact O-N 3.33Å; N225-L277 PolarHBondContact ND2-O 3.27Å; N225-L277 VanDerWaalsContact ND2-O 3.11Å
226	Y	80.9	Confident	70.4	Confident	17 Å²	17	48.4 Å²	48.4	7%	0.067	25%	0.251	C	S	.	.	S	Bend	trans	-125.9	118.5	178.9	-63.7	-69.9	0	0	0	111.6	Y148 C153 L157 V189 E193 L196 C222 V228	Y148-Y226 HydrophobicContact CD2-CD1 4.43Å; Y148-Y226 HydrophobicContact CD2-CG 4.44Å; Y148-Y226 HydrophobicContact CE2-CD1 4.39Å; Y148-Y226 AromaticContact CE2-CD2 3.99Å; Y148-Y226 HydrophobicContact CE2-CD2 3.99Å; Y148-Y226 HydrophobicContact CE2-CE1 4.15Å; Y148-Y226 AromaticContact CE2-CE2 3.7Å; Y148-Y226 HydrophobicContact CE2-CE2 3.7Å; Y148-Y226 HydrophobicContact CE2-CG 4.33Å; Y148-Y226 AromaticContact CE2-CZ 3.82Å; C153-Y226 HydrophobicContact CB-CD2 4.4Å; C153-Y226 HydrophobicContact CB-CE2 4.47Å; L157-Y226 HydrophobicContact CD1-CD2 3.69Å; L157-Y226 HydrophobicContact CD1-CG 3.86Å; V189-Y226 HydrophobicContact CG1-CE1 3.99Å; E193-Y226 WeakPolarHBondContact CG-OH 3.14Å; E193-Y226 PolarHBondContact OE1-OH 3.45Å; E193-Y226 VanDerWaalsContact OE1-OH 3.11Å; L196-Y226 HydrophobicContact CD2-CD2 4.37Å; L196-Y226 HydrophobicContact CD2-CE2 3.72Å; C222-Y226 WeakPolarHBondContact O-CB 3.18Å; C222-Y226 PolarHBondContact O-N 3.22Å; Y226-V228 PolarHBondContact O-N 2.68Å
227	Q	77.7	Confident	68.1	Low	36 Å²	36	59.4 Å²	59.4	17%	0.168	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-75.6	118.3	171.6	179.2	63.5	51.2	0	0	109.8	V162 L163 L244	V162-Q227 CarbonylContact C-O 3.5Å; V162-Q227 WeakPolarHBondContact CA-O 3.17Å; V162-Q227 WeakPolarHBondContact CB-O 3.41Å; L163-Q227 HydrophobicContact CB-CB 4.12Å; L163-Q227 HydrophobicContact CB-CG 4.22Å; L163-Q227 PolarHBondContact N-O 3.2Å; Q227-L244 PolarHBondContact OE1-O 2.96Å
228	V	76.5	Confident	66	Low	36 Å²	36	64.5 Å²	64.5	22%	0.218	33%	0.328	C	S	.	.	B	Isolated β-bridge	trans	-76.1	137.1	170.3	-177.6	0	0	0	0	109.6	L157 Q160 K161 Y223 Y226	L157-V228 HydrophobicContact CD2-CG2 3.88Å; Q160-V228 HydrophobicContact CB-CG1 4.26Å; Q160-V228 VanDerWaalsContact OE1-CG2 3.25Å; K161-V228 WeakPolarHBondContact O-CA 3.12Å; Y223-V228 HydrophobicContact CD1-CG2 3.96Å; Y223-V228 HydrophobicContact CE1-CG2 3.77Å; Y226-V228 PolarHBondContact O-N 2.68Å
229	C	72.6	Confident	63.9	Low	22 Å²	22	67.7 Å²	67.7	15%	0.149	35%	0.349	C	S	.	.	P	Polyproline II helix	trans	-80.5	132.7	174	-65.7	0	0	0	0	110.8	C145 K161	C145-C229 VanDerWaalsContact CA-SG 3.54Å; C145-C229 HydrophobicContact CB-CB 3.8Å; C145-C229 WeakPolarHBondContact CB-SG 3.3Å; C145-C229 WeakPolarHBondContact SG-CB 3.44Å; C145-C229 CovalentContact SG-SG 2.03Å; C145-C229 PolarHBondContact SG-SG 2.74Å; K161-C229 HydrophobicContact CB-CB 4.21Å; K161-C229 PolarHBondContact O-N 3.04Å
230	D	63.1	Low	62	Low	83 Å²	83	68.5 Å²	68.5	44%	0.444	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-91.9	120.5	169.3	-166	-17.7	0	0	0	109.3	E232 I233 A234	D230-E232 VanDerWaalsContact C-N 3.26Å; D230-E232 PolarHBondContact O-N 2.82Å; D230-E232 PolarHBondContact OD1-N 3.44Å; D230-I233 HydrophobicContact CB-CD1 4.17Å; D230-I233 HydrophobicContact CB-CG1 4.2Å; D230-I233 PolarHBondContact O-N 3.28Å; D230-A234 PolarHBondContact O-N 2.79Å
231	E	52	Low	60.2	Low	121 Å²	121	70.4 Å²	70.4	57%	0.565	38%	0.377	S	S	*	.	H	α-helix	trans	-69	-25.5	177.8	-69.5	-159	160	0	0	112	K161 I233 A234	K161-E231 IonicContact NZ-OE1 2.63Å; K161-E231 PolarHBondContact NZ-OE1 3.37Å; E231-I233 PolarHBondContact O-N 2.71Å; E231-A234 WeakPolarHBondContact O-CB 3.4Å; E231-A234 PolarHBondContact O-N 2.98Å; E231-A234 VanDerWaalsContact O-N 3.15Å
232	E	47.7	Very low	58.7	Low	173 Å²	173	72.6 Å²	72.6	81%	0.808	39%	0.391	S	S	*	.	H	α-helix	trans	-67.7	-25.7	177.8	-70.3	-162.1	165.2	0	0	112.1	D230	D230-E232 VanDerWaalsContact C-N 3.26Å; D230-E232 PolarHBondContact O-N 2.82Å; D230-E232 PolarHBondContact OD1-N 3.44Å
233	I	42.5	Very low	57.4	Low	59 Å²	59	76 Å²	76	30%	0.303	41%	0.409	S	S	.	.	H	α-helix	trans	-88.6	-20.4	176.3	-54.1	177.8	0	0	0	111.3	D230 E231 H235 S236 T241	D230-I233 HydrophobicContact CB-CD1 4.17Å; D230-I233 HydrophobicContact CB-CG1 4.2Å; D230-I233 PolarHBondContact O-N 3.28Å; E231-I233 PolarHBondContact O-N 2.71Å; I233-H235 PolarHBondContact O-N 3.33Å; I233-H235 VanDerWaalsContact O-N 3.16Å; I233-S236 VanDerWaalsContact O-CB 3.26Å; I233-S236 WeakPolarHBondContact O-CB 3.39Å; I233-S236 PolarHBondContact O-N 3.41Å; I233-T241 HydrophobicContact CB-CG2 4.04Å; I233-T241 HydrophobicContact CG2-CG2 3.75Å
234	A	39.8	Very low	56.6	Low	65 Å²	65	77.4 Å²	77.4	54%	0.537	42%	0.417	S	S	.	.	H	α-helix	trans	-65	-20.3	179.7	0	0	0	0	0	113.5	D230 E231 S236	D230-A234 PolarHBondContact O-N 2.79Å; E231-A234 WeakPolarHBondContact O-CB 3.4Å; E231-A234 PolarHBondContact O-N 2.98Å; E231-A234 VanDerWaalsContact O-N 3.15Å; A234-S236 VanDerWaalsContact C-N 3.29Å
235	H	38.7	Very low	56.2	Low	168 Å²	168	76.9 Å²	76.9	78%	0.778	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-11.2	172.1	-70.4	-61.2	0	0	0	113.8	I233 R237	I233-H235 PolarHBondContact O-N 3.33Å; I233-H235 VanDerWaalsContact O-N 3.16Å; H235-R237 VanDerWaalsContact C-N 3.32Å; H235-R237 PolarHBondContact O-N 3.2Å
236	S	38.4	Very low	56.3	Low	52 Å²	52	75.1 Å²	75.1	36%	0.364	41%	0.41	S	S	.	.			trans	-76	83.6	166.4	-179.4	0	0	0	0	109.6	I233 A234 S238 T239	I233-S236 VanDerWaalsContact O-CB 3.26Å; I233-S236 WeakPolarHBondContact O-CB 3.39Å; I233-S236 PolarHBondContact O-N 3.41Å; A234-S236 VanDerWaalsContact C-N 3.29Å; S236-S238 PolarHBondContact O-N 3.02Å; S236-T239 PolarHBondContact OG-OG1 3.35Å
237	R	36.7	Very low	56.5	Low	245 Å²	245	74.6 Å²	74.6	93%	0.925	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	3.3	-176.2	-83.2	-176.9	174.1	176.8	-1	115.7	H235	H235-R237 VanDerWaalsContact C-N 3.32Å; H235-R237 PolarHBondContact O-N 3.2Å
238	S	40.1	Very low	57	Low	110 Å²	110	75 Å²	75	77%	0.769	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130	-3.7	-172	56.6	0	0	0	0	116.6	S236	S236-S238 PolarHBondContact O-N 3.02Å
239	T	41.5	Very low	57.4	Low	89 Å²	89	79.6 Å²	79.6	55%	0.546	43%	0.427	S	S	.	.	S	Bend	trans	-137.6	112.3	177.3	59.7	0	0	0	0	108.4	S236 T241	S236-T239 PolarHBondContact OG-OG1 3.35Å; T239-T241 PolarHBondContact O-N 3.4Å
240	G	46.1	Very low	58	Low	45 Å²	45	78.8 Å²	78.8	46%	0.464	42%	0.421	S	S	.	.			trans	-44.6	139.1	179.5	0	0	0	0	0	112	P242	G240-P242 WeakPolarHBondContact O-CD 3.25Å; G240-P242 VanDerWaalsContact O-N 3.12Å
241	T	48.5	Very low	59.1	Low	40 Å²	40	74.8 Å²	74.8	25%	0.245	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-51.7	118	176.1	31.8	0	0	0	0	109.5	I233 T239 I243	I233-T241 HydrophobicContact CB-CG2 4.04Å; I233-T241 HydrophobicContact CG2-CG2 3.75Å; T239-T241 PolarHBondContact O-N 3.4Å; T241-I243 PolarHBondContact O-N 3.46Å
242	P	52.7	Low	60.7	Low	49 Å²	49	70.8 Å²	70.8	32%	0.318	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-64	135	-179.9	22.9	-29.7	0	0	0	109.7	W136 G240 L244	W136-P242 HydrophobicContact CH2-CB 4.13Å; W136-P242 HydrophobicContact CZ2-CB 3.85Å; G240-P242 WeakPolarHBondContact O-CD 3.25Å; G240-P242 VanDerWaalsContact O-N 3.12Å; P242-L244 PolarHBondContact O-N 2.92Å
243	I	59.9	Low	62.4	Low	71 Å²	71	63.6 Å²	63.6	36%	0.364	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-68.4	119.6	171.6	-63.8	172.4	0	0	0	107.5	I141 L163 T241	I141-I243 HydrophobicContact CB-CD1 4.01Å; I141-I243 HydrophobicContact CD1-CD1 3.47Å; I141-I243 VanDerWaalsContact CD1-CD1 3.47Å; I141-I243 HydrophobicContact CG1-CD1 4.27Å; I141-I243 HydrophobicContact CG2-CD1 4.03Å; L163-I243 HydrophobicContact CD2-CD1 4.34Å; L163-I243 HydrophobicContact CD2-CG1 3.89Å; T241-I243 PolarHBondContact O-N 3.46Å
244	L	68.8	Low	64.2	Low	43 Å²	43	60.8 Å²	60.8	23%	0.225	34%	0.335	C	S	.	.			trans	-100.1	110.2	179.2	-65.9	175.6	0	0	0	108.5	Q227 P242 V292	Q227-L244 PolarHBondContact OE1-O 2.96Å; P242-L244 PolarHBondContact O-N 2.92Å; L244-V292 HydrophobicContact CB-CG2 3.9Å; L244-V292 WeakPolarHBondContact O-CG2 3.38Å
245	P	76.7	Confident	66.2	Low	53 Å²	53	59.6 Å²	59.6	34%	0.344	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-63.6	162.7	174.4	29.4	-36.1	0	0	0	110.8	L284 K290 C291 V292	P245-L284 HydrophobicContact CB-CD2 4.07Å; P245-K290 WeakPolarHBondContact CD-O 3.33Å; P245-C291 CarbonylContact O-C 3.57Å; P245-C291 WeakPolarHBondContact O-CA 3.15Å; P245-C291 WeakPolarHBondContact O-CB 3.32Å; P245-V292 PolarHBondContact O-N 2.88Å
246	L	81.5	Confident	68	Low	1 Å²	1	58.2 Å²	58.2	1%	0.005	31%	0.312	C	S	.	.	B	Isolated β-bridge	trans	-56.3	142.3	169.2	-179.1	71.5	0	0	0	111.2	V220 D250 C251 P279 L284 V294	V220-L246 HydrophobicContact CG1-CD2 3.51Å; L246-D250 HydrophobicContact CD1-CB 4.25Å; L246-C251 HydrophobicContact CD2-CB 3.82Å; L246-P279 HydrophobicContact CD2-CB 4.23Å; L246-P279 HydrophobicContact CD2-CG 3.85Å; L246-L284 HydrophobicContact CB-CD1 3.92Å; L246-L284 HydrophobicContact CB-CD2 4.43Å; L246-L284 HydrophobicContact CD2-CD1 3.97Å; L246-L284 HydrophobicContact CG-CD1 4.11Å; L246-L284 WeakPolarHBondContact O-CB 3.28Å; L246-L284 WeakPolarHBondContact O-CD1 3.4Å; L246-L284 WeakPolarHBondContact O-CD2 3.34Å; L246-V294 HydrophobicContact CD1-CB 4.49Å; L246-V294 HydrophobicContact CD1-CG2 3.25Å
247	C	85.9	Confident	69.8	Low	6 Å²	6	56.9 Å²	56.9	4%	0.041	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-67.8	136.7	173.6	-67.8	0	0	0	0	111.5	K249 D250 C251 C291 V292	C247-K249 VanDerWaalsContact C-N 3.31Å; C247-K249 PolarHBondContact O-N 2.89Å; C247-D250 HydrophobicContact CB-CB 4.37Å; C247-D250 WeakPolarHBondContact CB-OD2 3.33Å; C247-D250 PolarHBondContact O-N 2.8Å; C247-C251 PolarHBondContact O-N 3.37Å; C247-C251 VanDerWaalsContact O-N 3.11Å; C247-C291 WeakPolarHBondContact CA-SG 3.47Å; C247-C291 HydrophobicContact CB-CB 3.89Å; C247-C291 WeakPolarHBondContact CB-SG 3.5Å; C247-C291 WeakPolarHBondContact SG-CB 3.13Å; C247-C291 CovalentContact SG-SG 2.03Å; C247-C291 PolarHBondContact SG-SG 3.13Å; C247-V292 PolarHBondContact N-O 2.04Å; C247-V292 PolarHBondContact SG-O 2.85Å; C247-V292 VanDerWaalsContact SG-O 3.37Å
248	K	86.8	Confident	71.7	Confident	44 Å²	44	45.4 Å²	45.4	19%	0.191	26%	0.258	C	S	.	.	H	α-helix	trans	-56.8	-42.5	-180	172.9	164.8	-174.3	175.4	0	112.8	D250 C251 L252 C281 D282 L284 S285 D286	K248-D250 PolarHBondContact O-N 2.98Å; K248-C251 WeakPolarHBondContact O-CB 2.86Å; K248-C251 PolarHBondContact O-N 3.32Å; K248-L252 HydrophobicContact CG-CD1 3.83Å; K248-L252 HydrophobicContact CG-CG 4.21Å; K248-L252 WeakPolarHBondContact O-CG 3.36Å; K248-L252 PolarHBondContact O-N 2.66Å; K248-C281 WeakPolarHBondContact CD-O 3.35Å; K248-C281 VanDerWaalsContact CG-O 3.27Å; K248-C281 WeakPolarHBondContact CG-O 3.44Å; K248-D282 IonicContact NZ-OD1 2.67Å; K248-L284 HydrophobicContact CB-CB 3.82Å; K248-S285 WeakPolarHBondContact CB-O 3.5Å; K248-S285 PolarHBondContact N-O 3.46Å; K248-D286 WeakPolarHBondContact CB-OD1 3.32Å
249	K	84.4	Confident	73.5	Confident	132 Å²	132	40.3 Å²	40.3	57%	0.574	22%	0.222	S	C	*	.	H	α-helix	trans	-59.6	-45.2	178.4	-63	-177.4	-177.6	164.2	0	111.9	C247 C251 L252 L253 D286	C247-K249 VanDerWaalsContact C-N 3.31Å; C247-K249 PolarHBondContact O-N 2.89Å; K249-C251 VanDerWaalsContact C-N 3.31Å; K249-C251 PolarHBondContact O-N 3.39Å; K249-L252 PolarHBondContact O-N 3.36Å; K249-L253 WeakPolarHBondContact O-CG 3.33Å; K249-L253 PolarHBondContact O-N 3.19Å; K249-D286 VanDerWaalsContact CG-OD1 3.3Å; K249-D286 WeakPolarHBondContact CG-OD1 3.33Å
250	D	85.3	Confident	75.3	Confident	5 Å²	5	40.1 Å²	40.1	3%	0.027	22%	0.217	C	C	.	.	H	α-helix	trans	-63.2	-37.7	177.9	-65	-99.7	0	0	0	112.3	Y216 L246 C247 K248 N293 V294 V295	Y216-D250 WeakPolarHBondContact CE1-O 3.44Å; Y216-D250 WeakPolarHBondContact OH-CA 3.48Å; Y216-D250 PolarHBondContact OH-O 3.07Å; L246-D250 HydrophobicContact CD1-CB 4.25Å; C247-D250 HydrophobicContact CB-CB 4.37Å; C247-D250 WeakPolarHBondContact CB-OD2 3.33Å; C247-D250 PolarHBondContact O-N 2.8Å; K248-D250 PolarHBondContact O-N 2.98Å; D250-N293 PolarHBondContact OD1-OD1 3Å; D250-V294 HydrophobicContact CB-CB 4.26Å; D250-V294 HydrophobicContact CB-CG2 4.45Å; D250-V294 PolarHBondContact OD1-N 3.25Å; D250-V295 WeakPolarHBondContact OD1-CG2 3.32Å; D250-V295 PolarHBondContact OD1-N 2.86Å
251	C	87.2	Confident	76.3	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-65.2	-46.3	172.8	-173	0	0	0	0	112.2	L246 C247 K248 K249 L253 L254 P279 C281 L284	L246-C251 HydrophobicContact CD2-CB 3.82Å; C247-C251 PolarHBondContact O-N 3.37Å; C247-C251 VanDerWaalsContact O-N 3.11Å; K248-C251 WeakPolarHBondContact O-CB 2.86Å; K248-C251 PolarHBondContact O-N 3.32Å; K249-C251 VanDerWaalsContact C-N 3.31Å; K249-C251 PolarHBondContact O-N 3.39Å; C251-L253 PolarHBondContact O-N 2.9Å; C251-L254 WeakPolarHBondContact O-CB 3.47Å; C251-L254 PolarHBondContact O-N 2.8Å; C251-P279 VanDerWaalsContact SG-CB 3.58Å; C251-P279 WeakPolarHBondContact SG-CG 2.89Å; C251-C281 HydrophobicContact CB-CB 3.7Å; C251-C281 WeakPolarHBondContact CB-SG 3.39Å; C251-C281 PolarHBondContact O-SG 3.42Å; C251-C281 VanDerWaalsContact O-SG 3.41Å; C251-C281 WeakPolarHBondContact SG-CA 3.03Å; C251-C281 WeakPolarHBondContact SG-CB 3.44Å; C251-C281 CovalentContact SG-SG 2.03Å; C251-C281 PolarHBondContact SG-SG 3.34Å; C251-L284 HydrophobicContact CB-CD1 3.55Å
252	L	86.1	Confident	77.3	Confident	36 Å²	36	44.7 Å²	44.7	19%	0.188	22%	0.223	C	C	.	.	H	α-helix	trans	-63.2	-22.6	-179.2	-72.1	172.1	0	0	0	113	K248 K249 L254 E255 E256 C281	K248-L252 HydrophobicContact CG-CD1 3.83Å; K248-L252 HydrophobicContact CG-CG 4.21Å; K248-L252 WeakPolarHBondContact O-CG 3.36Å; K248-L252 PolarHBondContact O-N 2.66Å; K249-L252 PolarHBondContact O-N 3.36Å; L252-L254 PolarHBondContact O-N 2.87Å; L252-E255 PolarHBondContact O-N 2.96Å; L252-E255 VanDerWaalsContact O-N 3.1Å; L252-E256 WeakPolarHBondContact O-CB 3.3Å; L252-E256 PolarHBondContact O-N 2.78Å; L252-C281 HydrophobicContact CD2-CB 3.77Å; L252-C281 HydrophobicContact CG-CB 4.05Å
253	L	82.7	Confident	78.2	Confident	23 Å²	23	42.6 Å²	42.6	12%	0.12	21%	0.209	C	C	.	.	H	α-helix	trans	-61.1	-30.3	173.6	-69	173.4	0	0	0	112.8	Y216 K249 C251 D257 I258 V295 T352	Y216-L253 HydrophobicContact CE1-CB 3.93Å; Y216-L253 WeakPolarHBondContact OH-CD1 3.29Å; K249-L253 WeakPolarHBondContact O-CG 3.33Å; K249-L253 PolarHBondContact O-N 3.19Å; C251-L253 PolarHBondContact O-N 2.9Å; L253-D257 HydrophobicContact CD2-CB 4.26Å; L253-D257 PolarHBondContact O-N 2.88Å; L253-I258 HydrophobicContact CB-CD1 4.12Å; L253-I258 HydrophobicContact CB-CG1 4.45Å; L253-I258 WeakPolarHBondContact O-CG1 3.46Å; L253-I258 PolarHBondContact O-N 3.45Å; L253-V295 HydrophobicContact CD1-CG2 3.63Å; L253-T352 HydrophobicContact CD1-CG2 4.01Å; L253-T352 HydrophobicContact CD2-CG2 4.35Å
254	L	80.8	Confident	78.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.21	C	C	.	.	I	π-helix	trans	-64.4	-48.6	171.3	-71	166.7	0	0	0	111	Y216 V220 C251 L252 C259 L260 Y263	Y216-L254 HydrophobicContact CD1-CD2 3.6Å; Y216-L254 HydrophobicContact CD1-CG 3.88Å; Y216-L254 HydrophobicContact CE1-CD2 4.21Å; Y216-L254 HydrophobicContact CE1-CG 3.97Å; V220-L254 HydrophobicContact CB-CD1 3.72Å; V220-L254 HydrophobicContact CG1-CD1 3.4Å; V220-L254 HydrophobicContact CG2-CD1 3.95Å; V220-L254 HydrophobicContact CG2-CG 4.37Å; C251-L254 WeakPolarHBondContact O-CB 3.47Å; C251-L254 PolarHBondContact O-N 2.8Å; L252-L254 PolarHBondContact O-N 2.87Å; L254-C259 HydrophobicContact CD2-CB 4.46Å; L254-C259 WeakPolarHBondContact CD2-SG 3.43Å; L254-C259 CarbonylContact O-C 3.55Å; L254-C259 VanDerWaalsContact O-CB 3.29Å; L254-C259 WeakPolarHBondContact O-CB 3.49Å; L254-C259 PolarHBondContact O-N 3.33Å; L254-C259 VanDerWaalsContact O-N 3.16Å; L254-L260 PolarHBondContact O-N 2.96Å; L254-Y263 HydrophobicContact CB-CD1 4.11Å; L254-Y263 HydrophobicContact CB-CD2 3.83Å; L254-Y263 HydrophobicContact CB-CE1 4.09Å; L254-Y263 HydrophobicContact CB-CE2 3.89Å; L254-Y263 HydrophobicContact CB-CG 3.94Å; L254-Y263 HydrophobicContact CD1-CD2 4.14Å; L254-Y263 HydrophobicContact CD1-CE2 3.51Å; L254-Y263 HydrophobicContact CD2-CD2 4.34Å; L254-Y263 HydrophobicContact CD2-CE2 4.49Å; L254-Y263 HydrophobicContact CG-CD2 4.34Å; L254-Y263 HydrophobicContact CG-CE2 4.18Å
255	E	80.6	Confident	78.4	Confident	40 Å²	40	44.8 Å²	44.8	19%	0.187	23%	0.225	C	C	.	.	I	π-helix	trans	-71.4	-35.1	-175.3	-72	-177.2	-170.2	0	0	113.6	L252 L260 Y263 K267 C281	L252-E255 PolarHBondContact O-N 2.96Å; L252-E255 VanDerWaalsContact O-N 3.1Å; E255-L260 WeakPolarHBondContact O-CA 3.39Å; E255-Y263 HydrophobicContact CB-CD1 4.45Å; E255-Y263 HydrophobicContact CG-CD1 3.44Å; E255-Y263 VanDerWaalsContact CG-CD1 3.44Å; E255-Y263 HydrophobicContact CG-CE1 3.47Å; E255-Y263 VanDerWaalsContact CG-CE1 3.47Å; E255-K267 IonicContact OE1-NZ 3.19Å; E255-K267 PolarHBondContact OE1-NZ 3.08Å; E255-C281 PolarHBondContact OE1-SG 2.93Å; E255-C281 VanDerWaalsContact OE1-SG 3.4Å
256	E	78.3	Confident	77.8	Confident	139 Å²	139	42.9 Å²	42.9	65%	0.65	21%	0.214	S	C	*	.	I	π-helix	trans	-117.7	-10.3	-162.6	-58.9	-168.4	163.4	0	0	115.2	L252 L260	L252-E256 WeakPolarHBondContact O-CB 3.3Å; L252-E256 PolarHBondContact O-N 2.78Å; E256-L260 WeakPolarHBondContact O-CD2 3.11Å
257	D	74.5	Confident	77.1	Confident	23 Å²	23	45.4 Å²	45.4	12%	0.123	23%	0.225	C	C	.	.	I	π-helix	trans	-135.6	-57	-178.3	-167.6	13.3	0	0	0	113	L253 A334 S345 G353	L253-D257 HydrophobicContact CD2-CB 4.26Å; L253-D257 PolarHBondContact O-N 2.88Å; D257-A334 WeakPolarHBondContact OD1-CB 3.28Å; D257-S345 PolarHBondContact OD2-OG 3.07Å; D257-G353 PolarHBondContact OD2-N 3.49Å; D257-G353 VanDerWaalsContact OD2-N 3.08Å
258	I	77.3	Confident	76	Confident	5 Å²	5	49.7 Å²	49.7	3%	0.026	26%	0.255	C	S	.	.	I	π-helix	trans	-85.4	-57.9	-165.5	-52.5	174.6	0	0	0	112.2	A212 C213 Y216 L253 T352	A212-I258 HydrophobicContact CB-CG2 4.03Å; C213-I258 HydrophobicContact CB-CG2 4.24Å; Y216-I258 HydrophobicContact CD1-CD1 3.19Å; Y216-I258 HydrophobicContact CD2-CD1 3.81Å; Y216-I258 HydrophobicContact CE1-CD1 3.57Å; Y216-I258 HydrophobicContact CE2-CD1 4.16Å; Y216-I258 HydrophobicContact CG-CD1 3.3Å; L253-I258 HydrophobicContact CB-CD1 4.12Å; L253-I258 HydrophobicContact CB-CG1 4.45Å; L253-I258 WeakPolarHBondContact O-CG1 3.46Å; L253-I258 PolarHBondContact O-N 3.45Å; I258-T352 HydrophobicContact CD1-CG2 3.35Å; I258-T352 HydrophobicContact CG1-CG2 3.63Å
259	C	78	Confident	74.6	Confident	3 Å²	3	51.2 Å²	51.2	2%	0.02	26%	0.263	C	S	.	.	S	Bend	trans	-97.2	-30.5	-174.5	-65.3	0	0	0	0	112	C213 L254 E261 E262	C213-C259 WeakPolarHBondContact CA-SG 3.05Å; C213-C259 HydrophobicContact CB-CB 3.9Å; C213-C259 WeakPolarHBondContact CB-SG 3.21Å; C213-C259 WeakPolarHBondContact SG-CB 3.27Å; C213-C259 CovalentContact SG-SG 2.02Å; C213-C259 PolarHBondContact SG-SG 2.89Å; L254-C259 HydrophobicContact CD2-CB 4.46Å; L254-C259 WeakPolarHBondContact CD2-SG 3.43Å; L254-C259 CarbonylContact O-C 3.55Å; L254-C259 VanDerWaalsContact O-CB 3.29Å; L254-C259 WeakPolarHBondContact O-CB 3.49Å; L254-C259 PolarHBondContact O-N 3.33Å; L254-C259 VanDerWaalsContact O-N 3.16Å; C259-E261 PolarHBondContact O-N 2.79Å; C259-E262 HydrophobicContact CB-CB 4.34Å; C259-E262 VanDerWaalsContact O-CB 3.27Å; C259-E262 WeakPolarHBondContact O-CB 3.34Å; C259-E262 WeakPolarHBondContact O-CG 3.4Å; C259-E262 PolarHBondContact O-N 2.87Å
260	L	79.1	Confident	73.1	Confident	85 Å²	85	47.7 Å²	47.7	45%	0.445	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	-107.3	177	-61.2	171	0	0	0	111.9	L254 E255 E256	L254-L260 PolarHBondContact O-N 2.96Å; E255-L260 WeakPolarHBondContact O-CA 3.39Å; E256-L260 WeakPolarHBondContact O-CD2 3.11Å
261	E	67.2	Low	71.4	Confident	128 Å²	128	53.4 Å²	53.4	60%	0.598	29%	0.293	S	S	*	.	H	α-helix	trans	-77.2	-27.2	-177.1	-51.7	-160.2	134.4	0	0	112.9	R41 C259 Y263 E264 S265	R41-E261 IonicContact CZ-OE1 3.61Å; R41-E261 IonicContact NH1-OE1 3.15Å; R41-E261 PolarHBondContact NH1-OE1 3.34Å; C259-E261 PolarHBondContact O-N 2.79Å; E261-Y263 VanDerWaalsContact C-N 3.27Å; E261-Y263 PolarHBondContact O-N 3.38Å; E261-E264 PolarHBondContact O-N 3.15Å; E261-S265 PolarHBondContact O-N 2.9Å
262	E	70.3	Confident	69.6	Low	52 Å²	52	53.5 Å²	53.5	24%	0.243	29%	0.294	C	S	.	.	H	α-helix	trans	-61	-40.8	176.9	-60.3	166.1	-171.2	0	0	110.1	V209 S210 C213 C259 S265 A266	V209-E262 VanDerWaalsContact CA-CD 3.47Å; V209-E262 WeakPolarHBondContact CA-OE2 3.38Å; V209-E262 VanDerWaalsContact CG1-OE2 3.25Å; V209-E262 WeakPolarHBondContact CG1-OE2 3.16Å; V209-E262 HydrophobicContact CG2-CB 4.24Å; V209-E262 HydrophobicContact CG2-CG 4.24Å; S210-E262 PolarHBondContact N-OE1 3.04Å; S210-E262 PolarHBondContact N-OE2 3.5Å; S210-E262 VanDerWaalsContact N-OE2 3.16Å; C213-E262 WeakPolarHBondContact CB-OE2 3.39Å; C213-E262 PolarHBondContact SG-OE2 3.37Å; C259-E262 HydrophobicContact CB-CB 4.34Å; C259-E262 VanDerWaalsContact O-CB 3.27Å; C259-E262 WeakPolarHBondContact O-CB 3.34Å; C259-E262 WeakPolarHBondContact O-CG 3.4Å; C259-E262 PolarHBondContact O-N 2.87Å; E262-S265 PolarHBondContact O-N 3.19Å; E262-A266 PolarHBondContact O-N 3.33Å
263	Y	70.6	Confident	67.8	Low	5 Å²	5	53.4 Å²	53.4	2%	0.02	30%	0.302	C	S	.	.	H	α-helix	trans	-70.3	-39.6	179.2	-170.3	-110	0	0	0	113	L254 E255 E261 S265 A266 K267 L278 P279	L254-Y263 HydrophobicContact CB-CD1 4.11Å; L254-Y263 HydrophobicContact CB-CD2 3.83Å; L254-Y263 HydrophobicContact CB-CE1 4.09Å; L254-Y263 HydrophobicContact CB-CE2 3.89Å; L254-Y263 HydrophobicContact CB-CG 3.94Å; L254-Y263 HydrophobicContact CD1-CD2 4.14Å; L254-Y263 HydrophobicContact CD1-CE2 3.51Å; L254-Y263 HydrophobicContact CD2-CD2 4.34Å; L254-Y263 HydrophobicContact CD2-CE2 4.49Å; L254-Y263 HydrophobicContact CG-CD2 4.34Å; L254-Y263 HydrophobicContact CG-CE2 4.18Å; E255-Y263 HydrophobicContact CB-CD1 4.45Å; E255-Y263 HydrophobicContact CG-CD1 3.44Å; E255-Y263 VanDerWaalsContact CG-CD1 3.44Å; E255-Y263 HydrophobicContact CG-CE1 3.47Å; E255-Y263 VanDerWaalsContact CG-CE1 3.47Å; E261-Y263 VanDerWaalsContact C-N 3.27Å; E261-Y263 PolarHBondContact O-N 3.38Å; Y263-S265 VanDerWaalsContact C-N 3.31Å; Y263-S265 PolarHBondContact O-N 3.31Å; Y263-A266 PolarHBondContact O-N 3.46Å; Y263-K267 HydrophobicContact CD1-CD 4.09Å; Y263-K267 HydrophobicContact CD1-CG 4.42Å; Y263-K267 HydrophobicContact CE1-CD 3.73Å; Y263-K267 HydrophobicContact CE1-CG 4.22Å; Y263-K267 PolarHBondContact O-N 2.59Å; Y263-K267 WeakPolarHBondContact OH-CE 3.11Å; Y263-L278 HydrophobicContact CD2-CD1 4.26Å; Y263-L278 HydrophobicContact CE2-CB 4.39Å; Y263-L278 HydrophobicContact CE2-CD1 3.78Å; Y263-L278 HydrophobicContact CE2-CD2 3.82Å; Y263-L278 HydrophobicContact CE2-CG 4.21Å; Y263-P279 PolarHBondContact OH-O 2.9Å
264	E	66.9	Low	66.2	Low	84 Å²	84	56.1 Å²	56.1	39%	0.393	33%	0.327	S	S	.	.	H	α-helix	trans	-63.3	-39.7	174.1	-70.2	-73.4	-178.2	0	0	111.3	E261 A266 K267 S268	E261-E264 PolarHBondContact O-N 3.15Å; E264-A266 VanDerWaalsContact C-N 3.32Å; E264-K267 PolarHBondContact O-N 3.31Å; E264-S268 PolarHBondContact O-N 3.39Å; E264-S268 VanDerWaalsContact O-N 3.17Å; E264-S268 PolarHBondContact O-OG 3.39Å
265	S	65.9	Low	64.7	Low	77 Å²	77	57 Å²	57	54%	0.538	34%	0.337	S	S	.	.	H	α-helix	trans	-65.7	-34.8	173.6	-167.3	0	0	0	0	112.3	E261 E262 Y263 S268 H269	E261-S265 PolarHBondContact O-N 2.9Å; E262-S265 PolarHBondContact O-N 3.19Å; Y263-S265 VanDerWaalsContact C-N 3.31Å; Y263-S265 PolarHBondContact O-N 3.31Å; S265-S268 PolarHBondContact O-OG 2.99Å; S265-H269 PolarHBondContact O-N 3.49Å
266	A	65.2	Low	63.4	Low	12 Å²	12	59.4 Å²	59.4	10%	0.099	36%	0.363	C	S	.	.	H	α-helix	trans	-69.7	-40.1	174.8	0	0	0	0	0	111.5	E262 Y263 E264 S268 H269 I272 G273 L278	E262-A266 PolarHBondContact O-N 3.33Å; Y263-A266 PolarHBondContact O-N 3.46Å; E264-A266 VanDerWaalsContact C-N 3.32Å; A266-S268 VanDerWaalsContact C-N 3.26Å; A266-S268 PolarHBondContact O-N 3.46Å; A266-H269 VanDerWaalsContact O-CB 3.32Å; A266-H269 WeakPolarHBondContact O-CB 3.35Å; A266-H269 PolarHBondContact O-N 3.4Å; A266-H269 VanDerWaalsContact O-N 3.1Å; A266-I272 HydrophobicContact CB-CD1 4.29Å; A266-I272 HydrophobicContact CB-CG2 4.23Å; A266-I272 WeakPolarHBondContact O-CB 3.28Å; A266-G273 PolarHBondContact O-N 2.73Å; A266-L278 HydrophobicContact CB-CD1 3.98Å
267	K	66.2	Low	62.6	Low	54 Å²	54	52.9 Å²	52.9	24%	0.235	33%	0.333	C	S	.	.	H	α-helix	trans	-64.6	-25.5	175.9	-82.3	-172.6	162.5	-178.7	0	114	E255 Y263 E264 G273 L278 P279	E255-K267 IonicContact OE1-NZ 3.19Å; E255-K267 PolarHBondContact OE1-NZ 3.08Å; Y263-K267 HydrophobicContact CD1-CD 4.09Å; Y263-K267 HydrophobicContact CD1-CG 4.42Å; Y263-K267 HydrophobicContact CE1-CD 3.73Å; Y263-K267 HydrophobicContact CE1-CG 4.22Å; Y263-K267 PolarHBondContact O-N 2.59Å; Y263-K267 WeakPolarHBondContact OH-CE 3.11Å; E264-K267 PolarHBondContact O-N 3.31Å; K267-G273 VanDerWaalsContact O-CA 3.27Å; K267-G273 WeakPolarHBondContact O-CA 3.32Å; K267-L278 HydrophobicContact CG-CB 4.49Å; K267-L278 HydrophobicContact CG-CD1 3.85Å; K267-P279 WeakPolarHBondContact CE-O 3.43Å; K267-P279 PolarHBondContact NZ-O 3.04Å; K267-P279 VanDerWaalsContact NZ-O 3.12Å
268	S	61.7	Low	62.3	Low	97 Å²	97	52.7 Å²	52.7	68%	0.678	33%	0.332	S	S	*	.	H	α-helix	trans	-89.7	-10.9	174	61.9	0	0	0	0	113.4	E264 S265 A266 G270	E264-S268 PolarHBondContact O-N 3.39Å; E264-S268 VanDerWaalsContact O-N 3.17Å; E264-S268 PolarHBondContact O-OG 3.39Å; S265-S268 PolarHBondContact O-OG 2.99Å; A266-S268 VanDerWaalsContact C-N 3.26Å; A266-S268 PolarHBondContact O-N 3.46Å; S268-G270 PolarHBondContact O-N 2.91Å
269	H	57.4	Low	62	Low	76 Å²	76	52.5 Å²	52.5	35%	0.352	33%	0.33	S	S	.	.	S	Bend	trans	-73.8	124.8	-176.2	-169.1	-94.1	0	0	0	110.9	S265 A266 L271 I272 G273	S265-H269 PolarHBondContact O-N 3.49Å; A266-H269 VanDerWaalsContact O-CB 3.32Å; A266-H269 WeakPolarHBondContact O-CB 3.35Å; A266-H269 PolarHBondContact O-N 3.4Å; A266-H269 VanDerWaalsContact O-N 3.1Å; H269-L271 PolarHBondContact ND1-N 3.48Å; H269-L271 PolarHBondContact O-N 3.43Å; H269-I272 HydrophobicContact CB-CB 4.25Å; H269-I272 HydrophobicContact CB-CD1 4.27Å; H269-I272 HydrophobicContact CB-CG1 4.4Å; H269-I272 PolarHBondContact O-N 2.91Å; H269-G273 PolarHBondContact O-N 3.01Å
270	G	53.4	Low	61.9	Low	57 Å²	57	55.6 Å²	55.6	59%	0.588	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.2	-28.5	-174.3	0	0	0	0	0	115.2	S268 A274	S268-G270 PolarHBondContact O-N 2.91Å; G270-A274 WeakPolarHBondContact O-CB 3.31Å
271	L	49.7	Very low	62	Low	125 Å²	125	51.6 Å²	51.6	65%	0.654	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-23.1	176.7	-63.7	175	0	0	0	114.5	H269	H269-L271 PolarHBondContact ND1-N 3.48Å; H269-L271 PolarHBondContact O-N 3.43Å
272	I	50.9	Low	62.4	Low	3 Å²	3	47.8 Å²	47.8	2%	0.015	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-42.5	-172.4	-56.6	170.3	0	0	0	111.1	A199 V202 I203 A266 H269 L278	A199-I272 HydrophobicContact CB-CB 4.4Å; A199-I272 HydrophobicContact CB-CG1 3.91Å; A199-I272 HydrophobicContact CB-CG2 4.06Å; V202-I272 HydrophobicContact CB-CD1 3.91Å; V202-I272 HydrophobicContact CG1-CD1 3.7Å; I203-I272 HydrophobicContact CG1-CD1 4.45Å; A266-I272 HydrophobicContact CB-CD1 4.29Å; A266-I272 HydrophobicContact CB-CG2 4.23Å; A266-I272 WeakPolarHBondContact O-CB 3.28Å; H269-I272 HydrophobicContact CB-CB 4.25Å; H269-I272 HydrophobicContact CB-CD1 4.27Å; H269-I272 HydrophobicContact CB-CG1 4.4Å; H269-I272 PolarHBondContact O-N 2.91Å; I272-L278 HydrophobicContact CG2-CD1 3.55Å; I272-L278 HydrophobicContact CG2-CD2 4.47Å; I272-L278 HydrophobicContact CG2-CG 3.78Å
273	G	47.4	Very low	62.8	Low	34 Å²	34	52.8 Å²	52.8	35%	0.351	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-24.1	-176.8	0	0	0	0	0	115.3	A266 K267 H269	A266-G273 PolarHBondContact O-N 2.73Å; K267-G273 VanDerWaalsContact O-CA 3.27Å; K267-G273 WeakPolarHBondContact O-CA 3.32Å; H269-G273 PolarHBondContact O-N 3.01Å
274	A	48.9	Very low	63.3	Low	80 Å²	80	53.6 Å²	53.6	66%	0.661	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-26.4	179.6	0	0	0	0	0	112.9	G270	G270-A274 WeakPolarHBondContact O-CB 3.31Å
275	G	48.3	Very low	63.8	Low	19 Å²	19	51.5 Å²	51.5	20%	0.196	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	143.4	171.5	0	0	0	0	0	110	L277	G275-L277 PolarHBondContact O-N 3.25Å
276	A	54.4	Low	64	Low	89 Å²	89	51.4 Å²	51.4	74%	0.736	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	40.7	-177.2	0	0	0	0	0	115.7
277	L	62.1	Low	64.2	Low	3 Å²	3	56.8 Å²	56.8	2%	0.016	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-39.2	-165.7	-163.8	80	0	0	0	113.1	Q195 L196 A199 N225 G275	Q195-L277 HydrophobicContact CB-CD1 4.17Å; L196-L277 HydrophobicContact CB-CD1 3.86Å; L196-L277 HydrophobicContact CD1-CD1 3.73Å; L196-L277 HydrophobicContact CD1-CD2 3.99Å; L196-L277 HydrophobicContact CD1-CG 3.93Å; L196-L277 HydrophobicContact CG-CD1 4.29Å; A199-L277 HydrophobicContact CB-CD2 3.05Å; N225-L277 PolarHBondContact ND2-O 3.27Å; N225-L277 VanDerWaalsContact ND2-O 3.11Å; G275-L277 PolarHBondContact O-N 3.25Å
278	L	66.8	Low	64	Low	19 Å²	19	58.4 Å²	58.4	10%	0.099	36%	0.36	C	S	.	.	S	Bend	trans	-89.9	129.5	173.7	-68	-175.7	0	0	0	110	Y263 A266 K267 I272 D280	Y263-L278 HydrophobicContact CD2-CD1 4.26Å; Y263-L278 HydrophobicContact CE2-CB 4.39Å; Y263-L278 HydrophobicContact CE2-CD1 3.78Å; Y263-L278 HydrophobicContact CE2-CD2 3.82Å; Y263-L278 HydrophobicContact CE2-CG 4.21Å; A266-L278 HydrophobicContact CB-CD1 3.98Å; K267-L278 HydrophobicContact CG-CB 4.49Å; K267-L278 HydrophobicContact CG-CD1 3.85Å; I272-L278 HydrophobicContact CG2-CD1 3.55Å; I272-L278 HydrophobicContact CG2-CD2 4.47Å; I272-L278 HydrophobicContact CG2-CG 3.78Å; L278-D280 PolarHBondContact O-N 3.3Å
279	P	71.8	Confident	64.2	Low	0 Å²	0	61 Å²	61	0%	0	37%	0.367	C	S	.	.			trans	-63.1	136.8	-178.8	21.3	-29.8	0	0	0	112.3	V220 H224 L246 C251 Y263 K267 C281 L284	V220-P279 HydrophobicContact CG1-CG 3.66Å; H224-P279 HydrophobicContact CB-CG 4.38Å; L246-P279 HydrophobicContact CD2-CB 4.23Å; L246-P279 HydrophobicContact CD2-CG 3.85Å; C251-P279 VanDerWaalsContact SG-CB 3.58Å; C251-P279 WeakPolarHBondContact SG-CG 2.89Å; Y263-P279 PolarHBondContact OH-O 2.9Å; K267-P279 WeakPolarHBondContact CE-O 3.43Å; K267-P279 PolarHBondContact NZ-O 3.04Å; K267-P279 VanDerWaalsContact NZ-O 3.12Å; P279-C281 PolarHBondContact O-N 3.39Å; P279-L284 HydrophobicContact CB-CD1 4.09Å
280	D	75.4	Confident	64.8	Low	69 Å²	69	61.8 Å²	61.8	37%	0.369	37%	0.369	S	S	.	.			trans	-80.4	97	162.8	-175.1	-3.8	0	0	0	108.6	L278 D282 K283	L278-D280 PolarHBondContact O-N 3.3Å; D280-D282 PolarHBondContact O-N 3.46Å; D280-D282 PolarHBondContact OD1-N 3.26Å; D280-K283 HydrophobicContact CB-CD 4.13Å; D280-K283 HydrophobicContact CB-CG 4.21Å; D280-K283 PolarHBondContact O-N 2.96Å; D280-K283 VanDerWaalsContact OD2-CE 3.26Å; D280-K283 WeakPolarHBondContact OD2-CE 3.25Å
281	C	81.3	Confident	66.1	Low	0 Å²	0	59.5 Å²	59.5	0%	0	34%	0.344	C	S	.	.	G	3₁₀ helix	trans	-57.9	-23.8	-172.7	-53.1	0	0	0	0	113.4	K248 C251 L252 E255 P279 K283 L284	K248-C281 WeakPolarHBondContact CD-O 3.35Å; K248-C281 VanDerWaalsContact CG-O 3.27Å; K248-C281 WeakPolarHBondContact CG-O 3.44Å; C251-C281 HydrophobicContact CB-CB 3.7Å; C251-C281 WeakPolarHBondContact CB-SG 3.39Å; C251-C281 PolarHBondContact O-SG 3.42Å; C251-C281 VanDerWaalsContact O-SG 3.41Å; C251-C281 WeakPolarHBondContact SG-CA 3.03Å; C251-C281 WeakPolarHBondContact SG-CB 3.44Å; C251-C281 CovalentContact SG-SG 2.03Å; C251-C281 PolarHBondContact SG-SG 3.34Å; L252-C281 HydrophobicContact CD2-CB 3.77Å; L252-C281 HydrophobicContact CG-CB 4.05Å; E255-C281 PolarHBondContact OE1-SG 2.93Å; E255-C281 VanDerWaalsContact OE1-SG 3.4Å; P279-C281 PolarHBondContact O-N 3.39Å; C281-K283 VanDerWaalsContact C-N 3.33Å; C281-L284 PolarHBondContact O-N 2.87Å
282	D	76.5	Confident	67.4	Low	48 Å²	48	54.5 Å²	54.5	26%	0.257	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-74	-24.7	178.2	-70.7	-59.5	0	0	0	113.9	R37 K248 D280 L284	R37-D282 IonicContact CZ-OD2 3.8Å; R37-D282 IonicContact NH1-OD2 3.34Å; R37-D282 PolarHBondContact NH1-OD2 3.24Å; R37-D282 IonicContact NH2-OD1 3.36Å; R37-D282 PolarHBondContact NH2-OD1 3.08Å; R37-D282 IonicContact NH2-OD2 3.58Å; R37-D282 PolarHBondContact NH2-OD2 2.79Å; K248-D282 IonicContact NZ-OD1 2.67Å; D280-D282 PolarHBondContact O-N 3.46Å; D280-D282 PolarHBondContact OD1-N 3.26Å; D282-L284 VanDerWaalsContact C-N 3.26Å
283	K	78.5	Confident	68.7	Low	158 Å²	158	56.5 Å²	56.5	69%	0.687	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-81	-10.2	177.2	-64.5	-175.8	-179.4	179.1	0	112.4	D280 C281	D280-K283 HydrophobicContact CB-CD 4.13Å; D280-K283 HydrophobicContact CB-CG 4.21Å; D280-K283 PolarHBondContact O-N 2.96Å; D280-K283 VanDerWaalsContact OD2-CE 3.26Å; D280-K283 WeakPolarHBondContact OD2-CE 3.25Å; C281-K283 VanDerWaalsContact C-N 3.33Å
284	L	80	Confident	70.1	Confident	21 Å²	21	54.9 Å²	54.9	11%	0.11	31%	0.313	C	S	.	.	S	Bend	trans	-87	156.6	-179.7	-60	179.4	0	0	0	111.6	P245 L246 K248 C251 P279 C281 D282	P245-L284 HydrophobicContact CB-CD2 4.07Å; L246-L284 HydrophobicContact CB-CD1 3.92Å; L246-L284 HydrophobicContact CB-CD2 4.43Å; L246-L284 HydrophobicContact CD2-CD1 3.97Å; L246-L284 HydrophobicContact CG-CD1 4.11Å; L246-L284 WeakPolarHBondContact O-CB 3.28Å; L246-L284 WeakPolarHBondContact O-CD1 3.4Å; L246-L284 WeakPolarHBondContact O-CD2 3.34Å; K248-L284 HydrophobicContact CB-CB 3.82Å; C251-L284 HydrophobicContact CB-CD1 3.55Å; P279-L284 HydrophobicContact CB-CD1 4.09Å; C281-L284 PolarHBondContact O-N 2.87Å; D282-L284 VanDerWaalsContact C-N 3.26Å
285	S	77.3	Confident	71.2	Confident	40 Å²	40	52.4 Å²	52.4	28%	0.28	29%	0.289	S	S	.	.			trans	-93	151.6	178.7	-165.9	0	0	0	0	112.1	K248 H287	K248-S285 WeakPolarHBondContact CB-O 3.5Å; K248-S285 PolarHBondContact N-O 3.46Å; S285-H287 PolarHBondContact OG-CD2 3.29Å; S285-H287 PolarHBondContact OG-N 3Å
286	D	71.6	Confident	72.2	Confident	75 Å²	75	57.6 Å²	57.6	40%	0.401	31%	0.306	S	S	.	.			trans	-92	-0.5	173	-80.1	-49.2	0	0	0	113.2	K248 K249 V288	K248-D286 WeakPolarHBondContact CB-OD1 3.32Å; K249-D286 VanDerWaalsContact CG-OD1 3.3Å; K249-D286 WeakPolarHBondContact CG-OD1 3.33Å; D286-V288 PolarHBondContact O-N 2.89Å
287	H	69	Low	72.7	Confident	125 Å²	125	55.9 Å²	55.9	58%	0.579	29%	0.285	S	S	*	.			trans	-79.2	110.1	-175.5	-67.5	-62.3	0	0	0	112.1	S285 D289 K290 C291	S285-H287 PolarHBondContact OG-CD2 3.29Å; S285-H287 PolarHBondContact OG-N 3Å; H287-D289 VanDerWaalsContact C-N 3.26Å; H287-D289 PolarHBondContact O-N 3.02Å; H287-D289 VanDerWaalsContact O-N 3.16Å; H287-K290 HydrophobicContact CB-CB 4.12Å; H287-K290 HydrophobicContact CB-CD 4.43Å; H287-K290 HydrophobicContact CB-CG 4.41Å; H287-K290 PolarHBondContact O-N 2.85Å; H287-C291 PolarHBondContact O-N 2.95Å; H287-C291 PolarHBondContact O-SG 2.94Å
288	V	62.1	Low	72.8	Confident	89 Å²	89	58.4 Å²	58.4	54%	0.539	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-54.5	-36.7	-174.2	-177.5	0	0	0	0	113.4	D286 K290	D286-V288 PolarHBondContact O-N 2.89Å; V288-K290 VanDerWaalsContact C-N 3.28Å; V288-K290 PolarHBondContact O-N 3.36Å
289	D	65	Low	72.1	Confident	151 Å²	151	58.7 Å²	58.7	81%	0.807	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-85	-1	-177.4	-51.1	-40.9	0	0	0	113.6	H287	H287-D289 VanDerWaalsContact C-N 3.26Å; H287-D289 PolarHBondContact O-N 3.02Å; H287-D289 VanDerWaalsContact O-N 3.16Å
290	K	71.5	Confident	71.1	Confident	93 Å²	93	61.9 Å²	61.9	40%	0.404	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-125.8	16.5	-175.3	-60.6	-175.8	179.7	-178.4	0	112.5	P245 H287 V288	P245-K290 WeakPolarHBondContact CD-O 3.33Å; H287-K290 HydrophobicContact CB-CB 4.12Å; H287-K290 HydrophobicContact CB-CD 4.43Å; H287-K290 HydrophobicContact CB-CG 4.41Å; H287-K290 PolarHBondContact O-N 2.85Å; V288-K290 VanDerWaalsContact C-N 3.28Å; V288-K290 PolarHBondContact O-N 3.36Å
291	C	78.8	Confident	69.6	Low	9 Å²	9	65.3 Å²	65.3	6%	0.061	34%	0.338	C	S	.	.	S	Bend	trans	-151.8	159.6	179.3	62.9	0	0	0	0	113.1	P245 C247 H287	P245-C291 CarbonylContact O-C 3.57Å; P245-C291 WeakPolarHBondContact O-CA 3.15Å; P245-C291 WeakPolarHBondContact O-CB 3.32Å; C247-C291 WeakPolarHBondContact CA-SG 3.47Å; C247-C291 HydrophobicContact CB-CB 3.89Å; C247-C291 WeakPolarHBondContact CB-SG 3.5Å; C247-C291 WeakPolarHBondContact SG-CB 3.13Å; C247-C291 CovalentContact SG-SG 2.03Å; C247-C291 PolarHBondContact SG-SG 3.13Å; H287-C291 PolarHBondContact O-N 2.95Å; H287-C291 PolarHBondContact O-SG 2.94Å
292	V	77.4	Confident	67.8	Low	20 Å²	20	70.7 Å²	70.7	12%	0.121	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-81.9	114.5	175.1	179.1	0	0	0	0	109.6	Y223 L244 P245 C247 L297	Y223-V292 HydrophobicContact CD1-CG1 4.41Å; Y223-V292 HydrophobicContact CG-CG1 4.36Å; L244-V292 HydrophobicContact CB-CG2 3.9Å; L244-V292 WeakPolarHBondContact O-CG2 3.38Å; P245-V292 PolarHBondContact O-N 2.88Å; C247-V292 PolarHBondContact N-O 2.04Å; C247-V292 PolarHBondContact SG-O 2.85Å; C247-V292 VanDerWaalsContact SG-O 3.37Å; V292-L297 HydrophobicContact CG1-CD1 3.5Å
293	N	77.9	Confident	66.3	Low	45 Å²	45	70.5 Å²	70.5	24%	0.241	36%	0.364	C	S	.	.			trans	-90	107.2	175.5	-174.5	-47.9	0	0	0	109.7	D250 V295 K296 L297	D250-N293 PolarHBondContact OD1-OD1 3Å; N293-V295 PolarHBondContact OD1-N 2.78Å; N293-K296 HydrophobicContact CB-CB 3.92Å; N293-K296 VanDerWaalsContact OD1-CB 3.24Å; N293-K296 WeakPolarHBondContact OD1-CB 3.13Å; N293-K296 PolarHBondContact OD1-N 3.21Å; N293-L297 WeakPolarHBondContact O-CG 3.41Å; N293-L297 PolarHBondContact O-N 3.1Å; N293-L297 VanDerWaalsContact O-N 3.14Å
294	V	77.7	Confident	64.9	Low	0 Å²	0	71.9 Å²	71.9	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-71	-45.3	-175.2	175.8	0	0	0	0	110.1	Y216 Q219 V220 Y223 L246 D250 K296 L297 L298	Y216-V294 HydrophobicContact CE2-CG1 4.02Å; Q219-V294 HydrophobicContact CB-CG1 4.08Å; V220-V294 HydrophobicContact CG2-CG2 4.5Å; Y223-V294 HydrophobicContact CD2-CB 4.47Å; Y223-V294 HydrophobicContact CD2-CG1 4.12Å; Y223-V294 HydrophobicContact CD2-CG2 3.72Å; Y223-V294 HydrophobicContact CE2-CG1 4.37Å; Y223-V294 HydrophobicContact CG-CG2 4.27Å; L246-V294 HydrophobicContact CD1-CB 4.49Å; L246-V294 HydrophobicContact CD1-CG2 3.25Å; D250-V294 HydrophobicContact CB-CB 4.26Å; D250-V294 HydrophobicContact CB-CG2 4.45Å; D250-V294 PolarHBondContact OD1-N 3.25Å; V294-K296 PolarHBondContact O-N 3.09Å; V294-L297 WeakPolarHBondContact O-CA 3.3Å; V294-L297 WeakPolarHBondContact O-CB 3.45Å; V294-L297 PolarHBondContact O-N 2.96Å; V294-L298 HydrophobicContact CG1-CD1 3.95Å; V294-L298 HydrophobicContact CG1-CG 4.12Å; V294-L298 VanDerWaalsContact O-CG 3.26Å; V294-L298 WeakPolarHBondContact O-CG 3.25Å; V294-L298 PolarHBondContact O-N 3.37Å
295	V	72	Confident	63.2	Low	28 Å²	28	72.9 Å²	72.9	17%	0.17	37%	0.372	C	S	.	.	H	α-helix	trans	-55.2	-43.9	178.4	175.6	0	0	0	0	110.8	Y216 D250 L253 N293 L297 L298 E299	Y216-V295 HydrophobicContact CE2-CG2 4.26Å; D250-V295 WeakPolarHBondContact OD1-CG2 3.32Å; D250-V295 PolarHBondContact OD1-N 2.86Å; L253-V295 HydrophobicContact CD1-CG2 3.63Å; N293-V295 PolarHBondContact OD1-N 2.78Å; V295-L297 PolarHBondContact O-N 3.27Å; V295-L298 PolarHBondContact O-N 2.79Å; V295-E299 HydrophobicContact CG1-CG 4.45Å; V295-E299 WeakPolarHBondContact O-CB 3.28Å; V295-E299 VanDerWaalsContact O-CG 3.27Å; V295-E299 WeakPolarHBondContact O-CG 3.46Å; V295-E299 PolarHBondContact O-N 3.42Å
296	K	69.3	Low	61.8	Low	127 Å²	127	75.3 Å²	75.3	55%	0.552	39%	0.39	S	S	*	.	H	α-helix	trans	-63.2	-39.5	175.5	-174.3	-177	177.1	-172.7	0	112.2	N293 V294 E299 A300	N293-K296 HydrophobicContact CB-CB 3.92Å; N293-K296 VanDerWaalsContact OD1-CB 3.24Å; N293-K296 WeakPolarHBondContact OD1-CB 3.13Å; N293-K296 PolarHBondContact OD1-N 3.21Å; V294-K296 PolarHBondContact O-N 3.09Å; K296-E299 PolarHBondContact O-N 3.49Å; K296-A300 VanDerWaalsContact O-CB 3.28Å; K296-A300 WeakPolarHBondContact O-CB 3.32Å; K296-A300 PolarHBondContact O-N 2.96Å
297	L	65.9	Low	61	Low	54 Å²	54	72.7 Å²	72.7	28%	0.283	38%	0.376	S	S	.	.	H	α-helix	trans	-67.1	-37	177	-73.1	173	0	0	0	112.4	Y223 V292 N293 V294 V295 A300 H301	Y223-L297 HydrophobicContact CD1-CD1 4.14Å; Y223-L297 HydrophobicContact CD2-CD1 4.36Å; Y223-L297 HydrophobicContact CE1-CD1 3.8Å; Y223-L297 HydrophobicContact CE2-CD1 4.01Å; Y223-L297 HydrophobicContact CG-CD1 4.42Å; V292-L297 HydrophobicContact CG1-CD1 3.5Å; N293-L297 WeakPolarHBondContact O-CG 3.41Å; N293-L297 PolarHBondContact O-N 3.1Å; N293-L297 VanDerWaalsContact O-N 3.14Å; V294-L297 WeakPolarHBondContact O-CA 3.3Å; V294-L297 WeakPolarHBondContact O-CB 3.45Å; V294-L297 PolarHBondContact O-N 2.96Å; V295-L297 PolarHBondContact O-N 3.27Å; L297-A300 PolarHBondContact O-N 2.92Å; L297-H301 PolarHBondContact O-ND1 3.26Å
298	L	62.8	Low	60.9	Low	56 Å²	56	71 Å²	71	29%	0.293	38%	0.376	S	S	.	.	H	α-helix	trans	-67.9	-40	174.4	-61.3	175.2	0	0	0	111.7	Y216 Q219 V294 V295	Y216-L298 HydrophobicContact CD2-CD1 3.97Å; Y216-L298 HydrophobicContact CE2-CD1 4.02Å; Q219-L298 HydrophobicContact CG-CD2 4.07Å; V294-L298 HydrophobicContact CG1-CD1 3.95Å; V294-L298 HydrophobicContact CG1-CG 4.12Å; V294-L298 VanDerWaalsContact O-CG 3.26Å; V294-L298 WeakPolarHBondContact O-CG 3.25Å; V294-L298 PolarHBondContact O-N 3.37Å; V295-L298 PolarHBondContact O-N 2.79Å
299	E	53.4	Low	61.7	Low	25 Å²	25	67.2 Å²	67.2	12%	0.117	35%	0.353	C	S	.	.	H	α-helix	trans	-68.6	-37.9	174.8	-72.1	176.9	163.8	0	0	111.6	V295 K296 H301 Q302 R358	V295-E299 HydrophobicContact CG1-CG 4.45Å; V295-E299 WeakPolarHBondContact O-CB 3.28Å; V295-E299 VanDerWaalsContact O-CG 3.27Å; V295-E299 WeakPolarHBondContact O-CG 3.46Å; V295-E299 PolarHBondContact O-N 3.42Å; K296-E299 PolarHBondContact O-N 3.49Å; E299-H301 PolarHBondContact O-N 3.42Å; E299-H301 VanDerWaalsContact O-N 3.12Å; E299-Q302 CarbonylContact O-C 3.45Å; E299-Q302 PolarHBondContact O-N 3.37Å; E299-R358 IonicContact OE1-NH2 3.26Å; E299-R358 PolarHBondContact OE1-NH2 3Å
300	A	49.3	Very low	62.8	Low	66 Å²	66	60.8 Å²	60.8	55%	0.545	32%	0.318	S	S	.	.	H	α-helix	trans	-61.7	-23.9	-178.1	0	0	0	0	0	113.9	K296 L297 Q302	K296-A300 VanDerWaalsContact O-CB 3.28Å; K296-A300 WeakPolarHBondContact O-CB 3.32Å; K296-A300 PolarHBondContact O-N 2.96Å; L297-A300 PolarHBondContact O-N 2.92Å; A300-Q302 VanDerWaalsContact C-N 3.26Å; A300-Q302 PolarHBondContact O-N 3.43Å
301	H	45.2	Very low	63.1	Low	142 Å²	142	57.4 Å²	57.4	66%	0.657	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	-4.6	176.3	-80.4	64.2	0	0	0	113.6	L297 E299	L297-H301 PolarHBondContact O-ND1 3.26Å; E299-H301 PolarHBondContact O-N 3.42Å; E299-H301 VanDerWaalsContact O-N 3.12Å
302	Q	43.9	Very low	63.4	Low	112 Å²	112	57.8 Å²	57.8	52%	0.523	31%	0.311	S	S	.	.	S	Bend	trans	-150.5	87.1	-172.9	-60.4	-177.1	6.5	0	0	110.9	E299 A300 R318	E299-Q302 CarbonylContact O-C 3.45Å; E299-Q302 PolarHBondContact O-N 3.37Å; A300-Q302 VanDerWaalsContact C-N 3.26Å; A300-Q302 PolarHBondContact O-N 3.43Å; Q302-R318 WeakPolarHBondContact O-CG 3.4Å
303	V	44.9	Very low	63.9	Low	45 Å²	45	58.2 Å²	58.2	27%	0.273	31%	0.314	S	S	.	.	S	Bend	trans	72.2	143.5	171.2	-174.5	0	0	0	0	113	D307 L392	V303-D307 WeakPolarHBondContact CG1-OD2 3.35Å; V303-L392 HydrophobicContact CG2-CD2 4.21Å
304	R	48.2	Very low	64.4	Low	186 Å²	186	56.1 Å²	56.1	70%	0.702	30%	0.303	S	S	*	.			trans	-78	136.2	-163.6	-63.6	177.4	-174.8	-179.3	2.5	110.9	S306 D307	R304-S306 PolarHBondContact O-N 3.04Å; R304-D307 PolarHBondContact N-OD2 3.32Å; R304-D307 WeakPolarHBondContact O-CB 3.19Å; R304-D307 PolarHBondContact O-N 2.95Å
305	P	44	Very low	64.7	Low	42 Å²	42	61 Å²	61	27%	0.273	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-21.8	177.6	-25.8	33.2	0	0	0	114.8	G319 T320	P305-G319 WeakPolarHBondContact O-CA 3.42Å; P305-T320 HydrophobicContact CB-CG2 4.23Å; P305-T320 WeakPolarHBondContact O-CG2 3.39Å; P305-T320 PolarHBondContact O-N 2.86Å; P305-T320 VanDerWaalsContact O-N 3.15Å; P305-T320 PolarHBondContact O-OG1 2.75Å
306	S	48.3	Very low	64.8	Low	92 Å²	92	63 Å²	63	64%	0.643	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	4.5	179.1	60.5	0	0	0	0	114.2	R304 P308	R304-S306 PolarHBondContact O-N 3.04Å; S306-P308 VanDerWaalsContact O-CD 3.28Å; S306-P308 WeakPolarHBondContact O-CD 3.1Å; S306-P308 VanDerWaalsContact O-N 3.16Å
307	D	53.8	Low	65.3	Low	19 Å²	19	57.3 Å²	57.3	10%	0.102	31%	0.311	C	S	.	.			trans	-65.1	118.8	-176.6	-74	-24.9	0	0	0	110.4	V303 R304 C309 Y317	V303-D307 WeakPolarHBondContact CG1-OD2 3.35Å; R304-D307 PolarHBondContact N-OD2 3.32Å; R304-D307 WeakPolarHBondContact O-CB 3.19Å; R304-D307 PolarHBondContact O-N 2.95Å; D307-C309 PolarHBondContact O-N 3.45Å; D307-Y317 PolarHBondContact O-OH 3.43Å
308	P	67.5	Low	65.6	Low	91 Å²	91	56.5 Å²	56.5	59%	0.591	31%	0.305	S	S	*	.			trans	-78.1	-0.1	-173.9	32.8	-36.1	0	0	0	112.6	S306 L381	S306-P308 VanDerWaalsContact O-CD 3.28Å; S306-P308 WeakPolarHBondContact O-CD 3.1Å; S306-P308 VanDerWaalsContact O-N 3.16Å; P308-L381 VanDerWaalsContact O-CD1 3.27Å; P308-L381 WeakPolarHBondContact O-CD1 3.47Å
309	C	79.6	Confident	66.2	Low	8 Å²	8	53.9 Å²	53.9	5%	0.054	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	166.2	-168	60.9	0	0	0	0	111.7	D307 Y317 D382 C384	D307-C309 PolarHBondContact O-N 3.45Å; C309-Y317 WeakPolarHBondContact O-CD2 3.42Å; C309-Y317 WeakPolarHBondContact O-CE2 3.33Å; C309-D382 CarbonylContact C-O 3.49Å; C309-D382 WeakPolarHBondContact CA-O 3.42Å; C309-D382 WeakPolarHBondContact CB-O 3.11Å; C309-C384 HydrophobicContact CB-CB 3.91Å; C309-C384 WeakPolarHBondContact CB-SG 3.44Å; C309-C384 PolarHBondContact O-SG 2.97Å; C309-C384 WeakPolarHBondContact SG-CA 3.35Å; C309-C384 WeakPolarHBondContact SG-CB 3.38Å; C309-C384 CovalentContact SG-SG 2.04Å; C309-C384 PolarHBondContact SG-SG 3.28Å
310	Y	86.7	Confident	67.4	Low	16 Å²	16	55.6 Å²	55.6	6%	0.063	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	153.3	175.9	72	-80	0	0	0	112.5	G312 R366 P367 L381 D382 R383 C384	Y310-G312 WeakPolarHBondContact CE2-O 3.42Å; Y310-R366 HydrophobicContact CE1-CB 4.31Å; Y310-R366 HydrophobicContact CE2-CB 3.65Å; Y310-R366 VanDerWaalsContact CZ-CB 3.48Å; Y310-R366 VanDerWaalsContact OH-CB 3.26Å; Y310-R366 WeakPolarHBondContact OH-CB 3.5Å; Y310-P367 HydrophobicContact CD1-CG 4.19Å; Y310-P367 HydrophobicContact CD2-CG 4.14Å; Y310-P367 HydrophobicContact CG-CG 3.82Å; Y310-L381 HydrophobicContact CD1-CB 4.31Å; Y310-L381 HydrophobicContact CD1-CD2 3.71Å; Y310-L381 HydrophobicContact CD1-CG 3.88Å; Y310-L381 VanDerWaalsContact CE1-O 3.29Å; Y310-L381 WeakPolarHBondContact CE1-O 3.47Å; Y310-L381 HydrophobicContact CG-CD2 4.2Å; Y310-D382 WeakPolarHBondContact CD1-O 3.38Å; Y310-D382 PolarHBondContact N-O 3.3Å; Y310-R383 HydrophobicContact CD2-CG 4.39Å; Y310-R383 HydrophobicContact CE1-CG 3.86Å; Y310-R383 HydrophobicContact CE2-CG 3.73Å; Y310-R383 VanDerWaalsContact CZ-CG 3.41Å; Y310-R383 CarbonylContact O-C 3.53Å; Y310-R383 VanDerWaalsContact O-CA 3.24Å; Y310-R383 WeakPolarHBondContact O-CA 3.17Å; Y310-R383 WeakPolarHBondContact OH-CG 3.35Å; Y310-R383 PolarHBondContact OH-NE 3.12Å; Y310-C384 PolarHBondContact O-N 3.45Å
311	V	79.1	Confident	69.1	Low	22 Å²	22	53.6 Å²	53.6	13%	0.133	29%	0.287	C	S	.	.			trans	-105.4	149.9	173	-179.1	0	0	0	0	109.5	S313 G314 C384 L392	V311-S313 PolarHBondContact O-N 2.58Å; V311-G314 WeakPolarHBondContact O-CA 3.27Å; V311-G314 PolarHBondContact O-N 2.84Å; V311-C384 HydrophobicContact CG2-CB 3.88Å; V311-L392 HydrophobicContact CG2-CB 3.96Å; V311-L392 HydrophobicContact CG2-CD1 4.05Å
312	G	83.9	Confident	71.2	Confident	18 Å²	18	48.4 Å²	48.4	19%	0.186	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	-128.1	174.2	0	0	0	0	0	112.9	Y310 G314 R383 E396	Y310-G312 WeakPolarHBondContact CE2-O 3.42Å; G312-G314 VanDerWaalsContact C-N 3.28Å; G312-R383 PolarHBondContact O-NH1 3.03Å; G312-R383 VanDerWaalsContact O-NH1 3.15Å; G312-R383 PolarHBondContact O-NH2 3Å; G312-E396 VanDerWaalsContact CA-OE2 3.25Å; G312-E396 WeakPolarHBondContact CA-OE2 3.38Å
313	S	88.2	Confident	73.3	Confident	29 Å²	29	46 Å²	46	20%	0.203	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	-6.3	170.7	64.4	0	0	0	0	113	V311 K315 N359 P365 R366	V311-S313 PolarHBondContact O-N 2.58Å; S313-K315 PolarHBondContact O-N 3.33Å; S313-K315 WeakPolarHBondContact OG-CB 3.39Å; S313-K315 PolarHBondContact OG-N 3.44Å; S313-N359 PolarHBondContact O-ND2 2.91Å; S313-P365 WeakPolarHBondContact CA-O 3.32Å; S313-R366 CarbonylContact O-C 3.52Å; S313-R366 WeakPolarHBondContact O-CA 2.96Å
314	G	88.4	Confident	75.7	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	25%	0.247	C	C	.	.	S	Bend	trans	70.1	17.8	-171	0	0	0	0	0	113.3	V311 G312 T316 Y317	V311-G314 WeakPolarHBondContact O-CA 3.27Å; V311-G314 PolarHBondContact O-N 2.84Å; G312-G314 VanDerWaalsContact C-N 3.28Å; G314-T316 PolarHBondContact O-N 3.2Å; G314-Y317 WeakPolarHBondContact O-CB 3.28Å; G314-Y317 PolarHBondContact O-N 3.41Å
315	K	84.4	Confident	77.8	Confident	104 Å²	104	40.2 Å²	40.2	45%	0.452	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-39.4	169.4	178	179.3	176.7	178.6	0	111.7	S313 R318	S313-K315 PolarHBondContact O-N 3.33Å; S313-K315 WeakPolarHBondContact OG-CB 3.39Å; S313-K315 PolarHBondContact OG-N 3.44Å; K315-R318 PolarHBondContact O-NH1 2.84Å
316	T	74.1	Confident	80.2	Confident	68 Å²	68	42.2 Å²	42.2	42%	0.417	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	3.4	179.3	54.5	0	0	0	0	113.2	G314 R318	G314-T316 PolarHBondContact O-N 3.2Å; T316-R318 PolarHBondContact O-N 2.88Å
317	Y	79.9	Confident	82.3	Confident	8 Å²	8	40.3 Å²	40.3	3%	0.031	25%	0.247	C	C	.	.			trans	-64	125	176.3	179	-105.4	0	0	0	110	D307 C309 G314 G319 A321 C357 P367 L381	D307-Y317 PolarHBondContact O-OH 3.43Å; C309-Y317 WeakPolarHBondContact O-CD2 3.42Å; C309-Y317 WeakPolarHBondContact O-CE2 3.33Å; G314-Y317 WeakPolarHBondContact O-CB 3.28Å; G314-Y317 PolarHBondContact O-N 3.41Å; Y317-G319 WeakPolarHBondContact OH-CA 3.49Å; Y317-A321 HydrophobicContact CE1-CB 4.41Å; Y317-A321 VanDerWaalsContact OH-CB 3.22Å; Y317-A321 WeakPolarHBondContact OH-CB 3.2Å; Y317-A321 PolarHBondContact OH-N 2.93Å; Y317-C357 WeakPolarHBondContact CD1-O 3.42Å; Y317-C357 HydrophobicContact CE1-CB 4.28Å; Y317-P367 HydrophobicContact CD1-CB 4.45Å; Y317-P367 HydrophobicContact CD1-CG 4.32Å; Y317-P367 HydrophobicContact CG-CG 4.29Å; Y317-L381 HydrophobicContact CD1-CD2 4Å; Y317-L381 HydrophobicContact CD2-CD2 3.86Å; Y317-L381 HydrophobicContact CE1-CD2 3.71Å; Y317-L381 HydrophobicContact CE2-CD1 4.14Å; Y317-L381 HydrophobicContact CE2-CD2 3.57Å; Y317-L381 HydrophobicContact CE2-CG 4.44Å; Y317-L381 HydrophobicContact CG-CD2 4.06Å; Y317-L381 VanDerWaalsContact CZ-CD2 3.47Å
318	R	72.5	Confident	84.2	Confident	38 Å²	38	40.5 Å²	40.5	14%	0.143	25%	0.254	C	S	.	.			trans	-126.3	13	178.5	-63.5	-62.6	177.4	-90.6	1.2	112.8	Q302 K315 T316	Q302-R318 WeakPolarHBondContact O-CG 3.4Å; K315-R318 PolarHBondContact O-NH1 2.84Å; T316-R318 PolarHBondContact O-N 2.88Å
319	G	75.5	Confident	85.4	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.255	C	S	.	.			trans	-69.8	177.2	175	0	0	0	0	0	113	P305 Y317 R358	P305-G319 WeakPolarHBondContact O-CA 3.42Å; Y317-G319 WeakPolarHBondContact OH-CA 3.49Å; G319-R358 PolarHBondContact O-NH1 2.77Å
320	T	78.6	Confident	86.1	Confident	61 Å²	61	43.5 Å²	43.5	37%	0.374	25%	0.252	S	S	.	.			trans	-103.4	14.2	-170	48.8	0	0	0	0	114.2	P305 S322 Y356	P305-T320 HydrophobicContact CB-CG2 4.23Å; P305-T320 WeakPolarHBondContact O-CG2 3.39Å; P305-T320 PolarHBondContact O-N 2.86Å; P305-T320 VanDerWaalsContact O-N 3.15Å; P305-T320 PolarHBondContact O-OG1 2.75Å; T320-S322 PolarHBondContact O-N 2.98Å; T320-Y356 VanDerWaalsContact C-CD1 3.49Å; T320-Y356 HydrophobicContact CG2-CD2 4.42Å; T320-Y356 HydrophobicContact CG2-CE1 4.17Å; T320-Y356 HydrophobicContact CG2-CE2 3.98Å; T320-Y356 WeakPolarHBondContact O-CD1 3.49Å; T320-Y356 WeakPolarHBondContact O-CE1 3.3Å
321	A	84.5	Confident	86.2	Confident	25 Å²	25	42.9 Å²	42.9	21%	0.207	25%	0.251	C	S	.	.			trans	-60.4	134.3	176	0	0	0	0	0	111.1	Y317 Y356 C357 L381	Y317-A321 HydrophobicContact CE1-CB 4.41Å; Y317-A321 VanDerWaalsContact OH-CB 3.22Å; Y317-A321 WeakPolarHBondContact OH-CB 3.2Å; Y317-A321 PolarHBondContact OH-N 2.93Å; A321-Y356 CarbonylContact O-C 3.51Å; A321-Y356 VanDerWaalsContact O-CA 3.28Å; A321-Y356 WeakPolarHBondContact O-CA 3.21Å; A321-C357 WeakPolarHBondContact O-CB 3.12Å; A321-C357 PolarHBondContact O-N 2.89Å; A321-C357 PolarHBondContact O-SG 2.82Å; A321-L381 HydrophobicContact CB-CD1 3.82Å
322	S	89	Confident	86.5	Confident	32 Å²	32	48.7 Å²	48.7	22%	0.224	27%	0.27	C	S	.	.			trans	-141	30.5	-174.8	70.8	0	0	0	0	113.2	T320 C330	T320-S322 PolarHBondContact O-N 2.98Å; S322-C330 WeakPolarHBondContact O-CB 3.37Å; S322-C330 PolarHBondContact O-N 2.89Å; S322-C330 PolarHBondContact O-SG 3.39Å
323	V	88.6	Confident	86.5	Confident	63 Å²	63	47.9 Å²	47.9	38%	0.382	26%	0.262	S	S	.	.	B	Isolated β-bridge	trans	-130	131.1	-177.5	-175	0	0	0	0	109.7	K380	V323-K380 PolarHBondContact O-N 2.94Å
324	S	94.4	Very high	85.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.268	C	S	.	.	B	Isolated β-bridge	trans	-74.6	164.4	175.2	60.9	0	0	0	0	112.4	S326 G327 G328 E377 Y378	S324-S326 VanDerWaalsContact C-N 3.28Å; S324-S326 PolarHBondContact O-N 2.88Å; S324-S326 PolarHBondContact OG-OG 2.76Å; S324-G327 WeakPolarHBondContact O-CA 3.43Å; S324-G327 PolarHBondContact O-N 2.87Å; S324-G328 PolarHBondContact N-O 2.86Å; S324-G328 VanDerWaalsContact OG-CA 3.25Å; S324-G328 WeakPolarHBondContact OG-CA 3.25Å; S324-G328 PolarHBondContact OG-N 3.18Å; S324-G328 PolarHBondContact OG-O 2.93Å; S324-E377 PolarHBondContact OG-OE2 3.11Å; S324-Y378 CarbonylContact C-O 3.55Å; S324-Y378 WeakPolarHBondContact CA-O 3.22Å
325	E	93.8	Very high	85.6	Confident	108 Å²	108	54.3 Å²	54.3	51%	0.505	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-34	177	-79.1	-173	150.2	0	0	114	G327 R366 Y378	E325-G327 PolarHBondContact O-N 2.81Å; E325-R366 IonicContact OE1-CZ 2.84Å; E325-R366 IonicContact OE1-NH1 3.3Å; E325-R366 PolarHBondContact OE1-NH1 3.35Å; E325-R366 IonicContact OE1-NH2 3.54Å; E325-R366 PolarHBondContact OE1-NH2 2.9Å; E325-R366 IonicContact OE2-CZ 3.45Å; E325-R366 IonicContact OE2-NH1 3.6Å; E325-R366 IonicContact OE2-NH2 3.41Å; E325-R366 PolarHBondContact OE2-NH2 3.42Å; E325-Y378 PolarHBondContact N-O 2.99Å
326	S	93.6	Very high	85.6	Confident	85 Å²	85	49.9 Å²	49.9	59%	0.594	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-6.8	174.5	68.4	0	0	0	0	113.3	S324 E377	S324-S326 VanDerWaalsContact C-N 3.28Å; S324-S326 PolarHBondContact O-N 2.88Å; S324-S326 PolarHBondContact OG-OG 2.76Å; S326-E377 WeakPolarHBondContact CB-OE2 3.35Å; S326-E377 PolarHBondContact OG-OE1 3.33Å; S326-E377 PolarHBondContact OG-OE2 3.23Å
327	G	92.1	Very high	85.8	Confident	51 Å²	51	47.4 Å²	47.4	53%	0.526	26%	0.262	S	S	.	.	S	Bend	trans	89.6	-1	-174.9	0	0	0	0	0	114.2	S324 E325	S324-G327 WeakPolarHBondContact O-CA 3.43Å; S324-G327 PolarHBondContact O-N 2.87Å; E325-G327 PolarHBondContact O-N 2.81Å
328	G	93.8	Very high	85.6	Confident	24 Å²	24	58 Å²	58	25%	0.247	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-66.9	141.8	174.9	0	0	0	0	0	112.7	S324	S324-G328 PolarHBondContact N-O 2.86Å; S324-G328 VanDerWaalsContact OG-CA 3.25Å; S324-G328 WeakPolarHBondContact OG-CA 3.25Å; S324-G328 PolarHBondContact OG-N 3.18Å; S324-G328 PolarHBondContact OG-O 2.93Å
329	R	93.1	Very high	86.1	Confident	162 Å²	162	62.6 Å²	62.6	61%	0.611	33%	0.328	S	S	*	.	B	Isolated β-bridge	trans	-71.6	134.2	174.4	-179.9	177.1	-75.7	-144.9	0.4	110.4	T371 E372	R329-T371 CarbonylContact O-C 3.39Å; R329-T371 VanDerWaalsContact O-CA 3.28Å; R329-T371 WeakPolarHBondContact O-CA 3.43Å; R329-E372 HydrophobicContact CB-CG 4.46Å; R329-E372 WeakPolarHBondContact CD-OE1 3.33Å; R329-E372 HydrophobicContact CG-CG 4.4Å; R329-E372 PolarHBondContact O-N 2.83Å
330	C	93.3	Very high	86.5	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-68.1	133.1	172.7	-62.8	0	0	0	0	110.6	S322 N355 C369 F370	S322-C330 WeakPolarHBondContact O-CB 3.37Å; S322-C330 PolarHBondContact O-N 2.89Å; S322-C330 PolarHBondContact O-SG 3.39Å; C330-N355 HydrophobicContact CB-CB 4.49Å; C330-N355 WeakPolarHBondContact CB-O 3.3Å; C330-N355 WeakPolarHBondContact O-CB 3.43Å; C330-N355 PolarHBondContact O-ND2 3.01Å; C330-C369 VanDerWaalsContact CA-SG 3.58Å; C330-C369 HydrophobicContact CB-CB 3.58Å; C330-C369 WeakPolarHBondContact CB-SG 3.27Å; C330-C369 WeakPolarHBondContact SG-CB 3.43Å; C330-C369 CovalentContact SG-SG 2.03Å; C330-C369 PolarHBondContact SG-SG 3.16Å; C330-F370 CarbonylContact C-O 3.44Å; C330-F370 WeakPolarHBondContact CA-O 3.27Å
331	G	89	Confident	86.4	Confident	3 Å²	3	65.8 Å²	65.8	3%	0.031	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-82.2	166.6	169.3	0	0	0	0	0	112	N355 F370	G331-N355 VanDerWaalsContact O-CB 3.3Å; G331-N355 WeakPolarHBondContact O-CB 3.17Å; G331-F370 PolarHBondContact N-O 3.27Å
332	R	86.4	Confident	86.2	Confident	143 Å²	143	71.3 Å²	71.3	54%	0.54	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-70.1	132.5	179.6	-73.8	176.5	168.7	-92.3	-8.2	110.6	A334 Q335 F336 G353 N355	R332-A334 VanDerWaalsContact C-N 3.28Å; R332-A334 PolarHBondContact O-N 2.85Å; R332-Q335 WeakPolarHBondContact O-CB 3.49Å; R332-Q335 PolarHBondContact O-N 3.09Å; R332-F336 WeakPolarHBondContact O-CD2 3.19Å; R332-F336 WeakPolarHBondContact O-CE2 3.27Å; R332-G353 PolarHBondContact NH1-O 2.81Å; R332-N355 HydrophobicContact CG-CB 4.17Å
333	W	83.8	Confident	85.8	Confident	2 Å²	2	71.1 Å²	71.1	1%	0.008	36%	0.359	C	S	.	.	H	α-helix	trans	-54.2	-43.7	-178.6	-68.1	102	0	0	0	113.1	Q335 F336 S337 L351 H354 Y356 R358 W368 C369 F370	W333-Q335 PolarHBondContact O-N 2.84Å; W333-Q335 VanDerWaalsContact O-N 3.12Å; W333-F336 PolarHBondContact O-N 3.29Å; W333-S337 PolarHBondContact O-N 3.34Å; W333-S337 PolarHBondContact O-OG 3.13Å; W333-L351 HydrophobicContact CB-CB 3.87Å; W333-L351 HydrophobicContact CB-CD1 4.47Å; W333-L351 HydrophobicContact CD2-CB 4.43Å; W333-L351 HydrophobicContact CD2-CD1 4.24Å; W333-L351 HydrophobicContact CD2-CD2 3.45Å; W333-L351 VanDerWaalsContact CD2-CD2 3.45Å; W333-L351 HydrophobicContact CD2-CG 4.24Å; W333-L351 VanDerWaalsContact CE2-CD2 3.46Å; W333-L351 HydrophobicContact CE3-CD1 4.09Å; W333-L351 HydrophobicContact CE3-CD2 3.9Å; W333-L351 HydrophobicContact CG-CB 3.88Å; W333-L351 HydrophobicContact CG-CD1 4.42Å; W333-L351 HydrophobicContact CG-CD2 3.72Å; W333-L351 HydrophobicContact CG-CG 4.21Å; W333-L351 HydrophobicContact CH2-CD2 4.33Å; W333-L351 HydrophobicContact CZ2-CD2 3.94Å; W333-L351 HydrophobicContact CZ3-CD2 4.32Å; W333-H354 AromaticContact CD1-CE1 3.99Å; W333-H354 AromaticContact CD1-ND1 3.78Å; W333-H354 PolarHBondContact N-O 3.38Å; W333-Y356 PolarHBondContact NE1-O 3.29Å; W333-R358 HydrophobicContact CZ2-CB 3.88Å; W333-R358 HydrophobicContact CZ2-CG 4.45Å; W333-W368 HydrophobicContact CH2-CD2 4.02Å; W333-W368 AromaticContact CH2-CE2 3.98Å; W333-W368 HydrophobicContact CH2-CE3 4.03Å; W333-W368 HydrophobicContact CH2-CH2 4.09Å; W333-W368 HydrophobicContact CH2-CZ2 4.03Å; W333-W368 HydrophobicContact CH2-CZ3 4.06Å; W333-W368 WeakPolarHBondContact CH2-O 3.16Å; W333-W368 VanDerWaalsContact CZ2-O 3.28Å; W333-W368 WeakPolarHBondContact CZ2-O 3.27Å; W333-W368 HydrophobicContact CZ3-CE3 4.35Å; W333-W368 AromaticContact CZ3-CH2 3.69Å; W333-W368 HydrophobicContact CZ3-CH2 3.69Å; W333-W368 AromaticContact CZ3-CZ2 3.92Å; W333-W368 HydrophobicContact CZ3-CZ2 3.92Å; W333-W368 AromaticContact CZ3-CZ3 3.91Å; W333-W368 HydrophobicContact CZ3-CZ3 3.91Å; W333-C369 HydrophobicContact CZ2-CB 4.21Å; W333-F370 AromaticContact CE3-CD2 3.94Å; W333-F370 HydrophobicContact CE3-CD2 3.94Å; W333-F370 HydrophobicContact CE3-CE2 4.02Å; W333-F370 AromaticContact CZ3-CD2 3.83Å; W333-F370 HydrophobicContact CZ3-CD2 3.83Å; W333-F370 AromaticContact CZ3-CE2 3.78Å; W333-F370 HydrophobicContact CZ3-CE2 3.78Å
334	A	75.9	Confident	85.1	Confident	41 Å²	41	73.1 Å²	73.1	34%	0.339	36%	0.36	S	S	.	.	H	α-helix	trans	-55	-30.8	177.3	0	0	0	0	0	114.1	D257 R332 F336 S337	D257-A334 WeakPolarHBondContact OD1-CB 3.28Å; R332-A334 VanDerWaalsContact C-N 3.28Å; R332-A334 PolarHBondContact O-N 2.85Å; A334-F336 PolarHBondContact O-N 3.43Å; A334-S337 WeakPolarHBondContact CA-OG 3.49Å; A334-S337 WeakPolarHBondContact O-CB 3.2Å; A334-S337 PolarHBondContact O-N 2.8Å
335	Q	81	Confident	83.9	Confident	122 Å²	122	73.2 Å²	73.2	57%	0.57	36%	0.36	S	S	*	.	H	α-helix	trans	-63.8	-31.8	177.6	-175.9	-179.5	-24.7	0	0	111.9	R332 W333	R332-Q335 WeakPolarHBondContact O-CB 3.49Å; R332-Q335 PolarHBondContact O-N 3.09Å; W333-Q335 PolarHBondContact O-N 2.84Å; W333-Q335 VanDerWaalsContact O-N 3.12Å
336	F	84.6	Confident	82.5	Confident	11 Å²	11	70.6 Å²	70.6	5%	0.048	35%	0.352	C	S	.	.	H	α-helix	trans	-98.2	-10	-174.8	-54.9	-73.8	0	0	0	113.2	R332 W333 A334 R338 L339 F340 F370 T371	R332-F336 WeakPolarHBondContact O-CD2 3.19Å; R332-F336 WeakPolarHBondContact O-CE2 3.27Å; W333-F336 PolarHBondContact O-N 3.29Å; A334-F336 PolarHBondContact O-N 3.43Å; F336-R338 PolarHBondContact O-N 2.85Å; F336-L339 PolarHBondContact O-N 3.09Å; F336-F340 HydrophobicContact CB-CD2 4.08Å; F336-F340 PolarHBondContact O-N 2.92Å; F336-F370 HydrophobicContact CB-CD2 3.71Å; F336-F370 HydrophobicContact CB-CE2 3.99Å; F336-F370 HydrophobicContact CB-CG 4.15Å; F336-F370 HydrophobicContact CD1-CB 4.04Å; F336-F370 HydrophobicContact CD1-CG 4.19Å; F336-F370 HydrophobicContact CD2-CB 3.46Å; F336-F370 VanDerWaalsContact CD2-CB 3.46Å; F336-F370 AromaticContact CD2-CD2 3.71Å; F336-F370 HydrophobicContact CD2-CD2 3.71Å; F336-F370 AromaticContact CD2-CG 3.83Å; F336-F370 HydrophobicContact CD2-CG 3.83Å; F336-F370 HydrophobicContact CE1-CB 4Å; F336-F370 HydrophobicContact CE2-CB 3.39Å; F336-F370 HydrophobicContact CE2-CD2 4.5Å; F336-F370 HydrophobicContact CE2-CG 4.27Å; F336-F370 HydrophobicContact CG-CB 3.79Å; F336-F370 AromaticContact CG-CD2 3.74Å; F336-F370 HydrophobicContact CG-CD2 3.74Å; F336-F370 HydrophobicContact CG-CE2 4.49Å; F336-F370 AromaticContact CG-CG 3.78Å; F336-F370 HydrophobicContact CG-CG 3.78Å; F336-F370 HydrophobicContact CZ-CB 3.68Å; F336-T371 VanDerWaalsContact CZ-O 3.31Å; F336-T371 WeakPolarHBondContact CZ-O 3.45Å
337	S	77.7	Confident	81.4	Confident	17 Å²	17	71.3 Å²	71.3	12%	0.119	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-23.9	178.5	-70.5	0	0	0	0	115.7	W333 A334 R344	W333-S337 PolarHBondContact O-N 3.34Å; W333-S337 PolarHBondContact O-OG 3.13Å; A334-S337 WeakPolarHBondContact CA-OG 3.49Å; A334-S337 WeakPolarHBondContact O-CB 3.2Å; A334-S337 PolarHBondContact O-N 2.8Å; S337-R344 PolarHBondContact O-NE 2.95Å; S337-R344 PolarHBondContact O-NH2 3.12Å
338	R	76.6	Confident	80.7	Confident	231 Å²	231	69.9 Å²	69.9	87%	0.872	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-41.2	174.8	-71.1	-168.4	-168	-176.5	3.3	112.9	F336	F336-R338 PolarHBondContact O-N 2.85Å
339	L	83	Confident	79.5	Confident	134 Å²	134	72.4 Å²	72.4	70%	0.702	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-34.3	-178.7	-66.1	173.6	0	0	0	111.2	F336 P341	F336-L339 PolarHBondContact O-N 3.09Å; L339-P341 WeakPolarHBondContact O-CD 3.5Å
340	F	83.1	Confident	78.6	Confident	69 Å²	69	66.1 Å²	66.1	30%	0.303	32%	0.318	S	S	.	.			trans	-121.9	77.8	-177.6	-53.6	-82.6	0	0	0	110.4	F336 H342 Y343 F370	F336-F340 HydrophobicContact CB-CD2 4.08Å; F336-F340 PolarHBondContact O-N 2.92Å; F340-H342 PolarHBondContact O-N 2.83Å; F340-H342 VanDerWaalsContact O-N 3.11Å; F340-Y343 HydrophobicContact CB-CD2 3.92Å; F340-Y343 PolarHBondContact O-N 3.47Å; F340-F370 HydrophobicContact CB-CZ 4.05Å; F340-F370 HydrophobicContact CD1-CE1 4.27Å; F340-F370 HydrophobicContact CD1-CZ 4.06Å; F340-F370 HydrophobicContact CD2-CD1 4.36Å; F340-F370 AromaticContact CD2-CE1 3.56Å; F340-F370 HydrophobicContact CD2-CE1 3.56Å; F340-F370 HydrophobicContact CD2-CE2 4.04Å; F340-F370 AromaticContact CD2-CZ 3.36Å; F340-F370 HydrophobicContact CD2-CZ 3.36Å; F340-F370 HydrophobicContact CE1-CE1 4.1Å; F340-F370 HydrophobicContact CE1-CZ 4.36Å; F340-F370 AromaticContact CE2-CD1 3.97Å; F340-F370 HydrophobicContact CE2-CD1 3.97Å; F340-F370 AromaticContact CE2-CE1 3.35Å; F340-F370 HydrophobicContact CE2-CE1 3.35Å; F340-F370 AromaticContact CE2-CZ 3.71Å; F340-F370 HydrophobicContact CE2-CZ 3.71Å; F340-F370 HydrophobicContact CG-CE1 4.02Å; F340-F370 HydrophobicContact CG-CE2 4.38Å; F340-F370 AromaticContact CG-CZ 3.55Å; F340-F370 HydrophobicContact CG-CZ 3.55Å; F340-F370 HydrophobicContact CZ-CD1 4.44Å; F340-F370 AromaticContact CZ-CE1 3.64Å; F340-F370 HydrophobicContact CZ-CE1 3.64Å; F340-F370 HydrophobicContact CZ-CZ 4.19Å
341	P	76.4	Confident	77.9	Confident	59 Å²	59	66.1 Å²	66.1	38%	0.383	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-19.2	-173.4	25	-34.5	0	0	0	114.2	L339 Y343 R344	L339-P341 WeakPolarHBondContact O-CD 3.5Å; P341-Y343 VanDerWaalsContact C-N 3.34Å; P341-R344 WeakPolarHBondContact O-CD 3.34Å; P341-R344 WeakPolarHBondContact O-CG 3.48Å
342	H	80.5	Confident	76.9	Confident	140 Å²	140	66.5 Å²	66.5	65%	0.648	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-26.4	174.9	-61.3	-64.2	0	0	0	113	F340 R344 H348	F340-H342 PolarHBondContact O-N 2.83Å; F340-H342 VanDerWaalsContact O-N 3.11Å; H342-R344 PolarHBondContact O-N 3.01Å; H342-H348 PolarHBondContact O-CD2 2.94Å; H342-H348 VanDerWaalsContact O-CD2 3.25Å; H342-H348 PolarHBondContact O-NE2 2.72Å
343	Y	81.7	Confident	75.8	Confident	29 Å²	29	60.6 Å²	60.6	11%	0.114	30%	0.303	C	S	.	.	S	Bend	trans	-103.5	60.5	-178	-58	-60.4	0	0	0	111.8	F340 P341 P360 W368 F370	F340-Y343 HydrophobicContact CB-CD2 3.92Å; F340-Y343 PolarHBondContact O-N 3.47Å; P341-Y343 VanDerWaalsContact C-N 3.34Å; Y343-P360 HydrophobicContact CD1-CB 4.01Å; Y343-P360 HydrophobicContact CD1-CG 4.07Å; Y343-P360 HydrophobicContact CE1-CB 4.41Å; Y343-W368 HydrophobicContact CD1-CH2 4.49Å; Y343-W368 AromaticContact CD1-CZ2 4Å; Y343-W368 HydrophobicContact CD1-CZ2 4Å; Y343-W368 AromaticContact CD2-CH2 3.78Å; Y343-W368 HydrophobicContact CD2-CH2 3.78Å; Y343-W368 HydrophobicContact CD2-CZ2 4.06Å; Y343-W368 HydrophobicContact CE1-CH2 4.38Å; Y343-W368 AromaticContact CE1-CZ2 3.69Å; Y343-W368 HydrophobicContact CE1-CZ2 3.69Å; Y343-W368 AromaticContact CE2-CH2 3.65Å; Y343-W368 HydrophobicContact CE2-CH2 3.65Å; Y343-W368 AromaticContact CE2-CZ2 3.76Å; Y343-W368 HydrophobicContact CE2-CZ2 3.76Å; Y343-W368 HydrophobicContact CG-CH2 4.21Å; Y343-W368 HydrophobicContact CG-CZ2 4.17Å; Y343-W368 AromaticContact CZ-CH2 3.96Å; Y343-W368 AromaticContact CZ-CZ2 3.55Å; Y343-F370 HydrophobicContact CD2-CE2 4.39Å; Y343-F370 HydrophobicContact CD2-CZ 4.14Å
344	R	73.2	Confident	75.4	Confident	104 Å²	104	61.2 Å²	61.2	39%	0.392	31%	0.306	S	S	.	.			trans	-105.9	146.2	177.3	-69.7	-179.7	177.9	178.5	4.6	111.1	S337 P341 H342 V346 N347 H348	S337-R344 PolarHBondContact O-NE 2.95Å; S337-R344 PolarHBondContact O-NH2 3.12Å; P341-R344 WeakPolarHBondContact O-CD 3.34Å; P341-R344 WeakPolarHBondContact O-CG 3.48Å; H342-R344 PolarHBondContact O-N 3.01Å; R344-V346 HydrophobicContact CB-CB 4.39Å; R344-V346 PolarHBondContact O-N 2.88Å; R344-N347 PolarHBondContact O-N 2.92Å; R344-H348 PolarHBondContact O-N 3.32Å
345	S	68.5	Low	75.9	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.014	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-29.4	172.1	-48.6	0	0	0	0	112.5	D257 N347 H348 P349	D257-S345 PolarHBondContact OD2-OG 3.07Å; S345-N347 PolarHBondContact O-N 3.37Å; S345-H348 WeakPolarHBondContact CA-O 3.35Å; S345-H348 CarbonylContact O-C 3.52Å; S345-H348 VanDerWaalsContact O-C 3.29Å; S345-H348 PolarHBondContact O-N 3.19Å; S345-P349 WeakPolarHBondContact O-CA 3.35Å
346	V	65.2	Low	76.3	Confident	53 Å²	53	58.3 Å²	58.3	32%	0.321	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-44.1	174.2	170.7	0	0	0	0	113.6	R344	R344-V346 HydrophobicContact CB-CB 4.39Å; R344-V346 PolarHBondContact O-N 2.88Å
347	N	70.9	Confident	76.7	Confident	101 Å²	101	57.8 Å²	57.8	54%	0.54	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-20.3	-179.6	-61.5	-26.1	0	0	0	112	R344 S345	R344-N347 PolarHBondContact O-N 2.92Å; S345-N347 PolarHBondContact O-N 3.37Å
348	H	77.6	Confident	77.4	Confident	21 Å²	21	57 Å²	57	10%	0.097	28%	0.276	C	S	.	.			trans	-136.6	78.4	-173.3	-61.6	-64.7	0	0	0	109.4	H342 R344 S345 E350 L351 P360	H342-H348 PolarHBondContact O-CD2 2.94Å; H342-H348 VanDerWaalsContact O-CD2 3.25Å; H342-H348 PolarHBondContact O-NE2 2.72Å; R344-H348 PolarHBondContact O-N 3.32Å; S345-H348 WeakPolarHBondContact CA-O 3.35Å; S345-H348 CarbonylContact O-C 3.52Å; S345-H348 VanDerWaalsContact O-C 3.29Å; S345-H348 PolarHBondContact O-N 3.19Å; H348-E350 WeakPolarHBondContact CA-OE2 3.41Å; H348-E350 IonicContact ND1-OE1 3.86Å; H348-E350 PolarHBondContact O-N 3.05Å; H348-L351 HydrophobicContact CB-CD1 3.74Å; H348-L351 HydrophobicContact CB-CG 3.81Å; H348-L351 WeakPolarHBondContact O-CB 3.36Å; H348-L351 WeakPolarHBondContact O-CG 3.33Å; H348-L351 PolarHBondContact O-N 2.97Å; H348-P360 HydrophobicContact CB-CB 3.94Å; H348-P360 VanDerWaalsContact CG-CB 3.46Å
349	P	68.8	Low	78.2	Confident	76 Å²	76	46 Å²	46	49%	0.494	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-55.1	-25.5	-175.9	-26.3	35.2	0	0	0	113.7	S345 L351 T352	S345-P349 WeakPolarHBondContact O-CA 3.35Å; P349-L351 PolarHBondContact O-N 2.93Å; P349-L351 VanDerWaalsContact O-N 3.11Å; P349-T352 VanDerWaalsContact O-CB 3.25Å; P349-T352 WeakPolarHBondContact O-CB 3.3Å; P349-T352 PolarHBondContact O-N 3.4Å; P349-T352 PolarHBondContact O-OG1 2.74Å
350	E	73.4	Confident	78.5	Confident	31 Å²	31	39.7 Å²	39.7	15%	0.145	20%	0.201	C	C	.	.	G	3₁₀ helix	trans	-65	-4.6	174.1	70.9	-86.8	-157.2	0	0	115	H348 H354 R358 P360	H348-E350 WeakPolarHBondContact CA-OE2 3.41Å; H348-E350 IonicContact ND1-OE1 3.86Å; H348-E350 PolarHBondContact O-N 3.05Å; E350-H354 PolarHBondContact O-CE1 3.44Å; E350-H354 PolarHBondContact O-NE2 2.71Å; E350-R358 VanDerWaalsContact O-CD 3.31Å; E350-R358 WeakPolarHBondContact O-CD 3.44Å; E350-R358 WeakPolarHBondContact O-CG 3.31Å; E350-R358 PolarHBondContact O-NE 3.26Å; E350-P360 WeakPolarHBondContact OE1-CA 3.29Å
351	L	79	Confident	78.6	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-95	-7.9	175.6	-60.6	-174.1	0	0	0	113.5	W333 H348 P349 G353 R358 P360	W333-L351 HydrophobicContact CB-CB 3.87Å; W333-L351 HydrophobicContact CB-CD1 4.47Å; W333-L351 HydrophobicContact CD2-CB 4.43Å; W333-L351 HydrophobicContact CD2-CD1 4.24Å; W333-L351 HydrophobicContact CD2-CD2 3.45Å; W333-L351 VanDerWaalsContact CD2-CD2 3.45Å; W333-L351 HydrophobicContact CD2-CG 4.24Å; W333-L351 VanDerWaalsContact CE2-CD2 3.46Å; W333-L351 HydrophobicContact CE3-CD1 4.09Å; W333-L351 HydrophobicContact CE3-CD2 3.9Å; W333-L351 HydrophobicContact CG-CB 3.88Å; W333-L351 HydrophobicContact CG-CD1 4.42Å; W333-L351 HydrophobicContact CG-CD2 3.72Å; W333-L351 HydrophobicContact CG-CG 4.21Å; W333-L351 HydrophobicContact CH2-CD2 4.33Å; W333-L351 HydrophobicContact CZ2-CD2 3.94Å; W333-L351 HydrophobicContact CZ3-CD2 4.32Å; H348-L351 HydrophobicContact CB-CD1 3.74Å; H348-L351 HydrophobicContact CB-CG 3.81Å; H348-L351 WeakPolarHBondContact O-CB 3.36Å; H348-L351 WeakPolarHBondContact O-CG 3.33Å; H348-L351 PolarHBondContact O-N 2.97Å; P349-L351 PolarHBondContact O-N 2.93Å; P349-L351 VanDerWaalsContact O-N 3.11Å; L351-G353 PolarHBondContact O-N 3.35Å; L351-R358 HydrophobicContact CD2-CB 3.63Å; L351-R358 HydrophobicContact CD2-CG 3.84Å; L351-P360 HydrophobicContact CD1-CB 4.36Å; L351-P360 HydrophobicContact CD1-CG 3.8Å; L351-P360 HydrophobicContact CD2-CG 3.52Å; L351-P360 HydrophobicContact CG-CG 3.98Å
352	T	67.5	Low	79.1	Confident	11 Å²	11	36.3 Å²	36.3	7%	0.067	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	127.3	-167.4	-60.4	0	0	0	0	112.4	L253 I258 P349 H354	L253-T352 HydrophobicContact CD1-CG2 4.01Å; L253-T352 HydrophobicContact CD2-CG2 4.35Å; I258-T352 HydrophobicContact CD1-CG2 3.35Å; I258-T352 HydrophobicContact CG1-CG2 3.63Å; P349-T352 VanDerWaalsContact O-CB 3.25Å; P349-T352 WeakPolarHBondContact O-CB 3.3Å; P349-T352 PolarHBondContact O-N 3.4Å; P349-T352 PolarHBondContact O-OG1 2.74Å; T352-H354 PolarHBondContact O-CD2 3.46Å; T352-H354 PolarHBondContact O-N 3.02Å
353	G	63.8	Low	79.4	Confident	18 Å²	18	35.3 Å²	35.3	19%	0.186	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.7	3.2	161	0	0	0	0	0	117.9	D257 R332 L351	D257-G353 PolarHBondContact OD2-N 3.49Å; D257-G353 VanDerWaalsContact OD2-N 3.08Å; R332-G353 PolarHBondContact NH1-O 2.81Å; L351-G353 PolarHBondContact O-N 3.35Å
354	H	75.2	Confident	79.9	Confident	15 Å²	15	36.4 Å²	36.4	7%	0.069	20%	0.198	C	C	.	.			trans	-136	177.5	-176.1	65.1	54.4	0	0	0	113.1	W333 E350 T352 Y356 R358	W333-H354 AromaticContact CD1-CE1 3.99Å; W333-H354 AromaticContact CD1-ND1 3.78Å; W333-H354 PolarHBondContact N-O 3.38Å; E350-H354 PolarHBondContact O-CE1 3.44Å; E350-H354 PolarHBondContact O-NE2 2.71Å; T352-H354 PolarHBondContact O-CD2 3.46Å; T352-H354 PolarHBondContact O-N 3.02Å; H354-Y356 HydrophobicContact CB-CD2 3.61Å; H354-Y356 HydrophobicContact CB-CE2 3.8Å; H354-Y356 HydrophobicContact CB-CG 4.26Å; H354-Y356 AromaticContact CD2-CD2 3.79Å; H354-Y356 AromaticContact CG-CD2 3.51Å; H354-Y356 AromaticContact ND1-CD2 3.93Å; H354-Y356 PolarHBondContact ND1-N 3.29Å; H354-R358 PolarHBondContact CE1-NE 2.89Å; H354-R358 VanDerWaalsContact CE1-NE 3.27Å; H354-R358 PolarHBondContact NE2-NE 3.1Å; H354-R358 PolarHBondContact NE2-NH2 3.33Å
355	N	86.3	Confident	80.9	Confident	33 Å²	33	35 Å²	35	18%	0.176	20%	0.202	C	C	.	.			trans	-119.7	15.6	175.8	69.2	-33.1	0	0	0	112.6	C330 G331 R332	C330-N355 HydrophobicContact CB-CB 4.49Å; C330-N355 WeakPolarHBondContact CB-O 3.3Å; C330-N355 WeakPolarHBondContact O-CB 3.43Å; C330-N355 PolarHBondContact O-ND2 3.01Å; G331-N355 VanDerWaalsContact O-CB 3.3Å; G331-N355 WeakPolarHBondContact O-CB 3.17Å; R332-N355 HydrophobicContact CG-CB 4.17Å
356	Y	89.4	Confident	82.1	Confident	70 Å²	70	37.3 Å²	37.3	28%	0.275	21%	0.211	S	C	.	.			trans	-68.8	150.6	179.3	-54	-46.2	0	0	0	111.9	T320 A321 W333 H354 R358	T320-Y356 VanDerWaalsContact C-CD1 3.49Å; T320-Y356 HydrophobicContact CG2-CD2 4.42Å; T320-Y356 HydrophobicContact CG2-CE1 4.17Å; T320-Y356 HydrophobicContact CG2-CE2 3.98Å; T320-Y356 WeakPolarHBondContact O-CD1 3.49Å; T320-Y356 WeakPolarHBondContact O-CE1 3.3Å; A321-Y356 CarbonylContact O-C 3.51Å; A321-Y356 VanDerWaalsContact O-CA 3.28Å; A321-Y356 WeakPolarHBondContact O-CA 3.21Å; W333-Y356 PolarHBondContact NE1-O 3.29Å; H354-Y356 HydrophobicContact CB-CD2 3.61Å; H354-Y356 HydrophobicContact CB-CE2 3.8Å; H354-Y356 HydrophobicContact CB-CG 4.26Å; H354-Y356 AromaticContact CD2-CD2 3.79Å; H354-Y356 AromaticContact CG-CD2 3.51Å; H354-Y356 AromaticContact ND1-CD2 3.93Å; H354-Y356 PolarHBondContact ND1-N 3.29Å; Y356-R358 PolarHBondContact O-N 3.17Å
357	C	92.7	Very high	83.6	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.196	C	C	.	.			trans	-58.4	131.9	174	-64.2	0	0	0	0	110.4	Y317 A321 P367 C379	Y317-C357 WeakPolarHBondContact CD1-O 3.42Å; Y317-C357 HydrophobicContact CE1-CB 4.28Å; A321-C357 WeakPolarHBondContact O-CB 3.12Å; A321-C357 PolarHBondContact O-N 2.89Å; A321-C357 PolarHBondContact O-SG 2.82Å; C357-P367 HydrophobicContact CB-CB 4.11Å; C357-C379 HydrophobicContact CB-CB 3.68Å; C357-C379 WeakPolarHBondContact CB-SG 3.39Å; C357-C379 WeakPolarHBondContact SG-CB 3.42Å; C357-C379 CovalentContact SG-SG 2.01Å; C357-C379 PolarHBondContact SG-SG 2.94Å
358	R	92.9	Very high	84.8	Confident	1 Å²	1	30.1 Å²	30.1	0%	0.004	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-142	167.4	179.9	-65.1	-66.4	178.3	-107.7	10.6	109.4	E299 G319 W333 E350 L351 H354 Y356 W368	E299-R358 IonicContact OE1-NH2 3.26Å; E299-R358 PolarHBondContact OE1-NH2 3Å; G319-R358 PolarHBondContact O-NH1 2.77Å; W333-R358 HydrophobicContact CZ2-CB 3.88Å; W333-R358 HydrophobicContact CZ2-CG 4.45Å; E350-R358 VanDerWaalsContact O-CD 3.31Å; E350-R358 WeakPolarHBondContact O-CD 3.44Å; E350-R358 WeakPolarHBondContact O-CG 3.31Å; E350-R358 PolarHBondContact O-NE 3.26Å; L351-R358 HydrophobicContact CD2-CB 3.63Å; L351-R358 HydrophobicContact CD2-CG 3.84Å; H354-R358 PolarHBondContact CE1-NE 2.89Å; H354-R358 VanDerWaalsContact CE1-NE 3.27Å; H354-R358 PolarHBondContact NE2-NE 3.1Å; H354-R358 PolarHBondContact NE2-NH2 3.33Å; Y356-R358 PolarHBondContact O-N 3.17Å; R358-W368 PolarHBondContact N-O 3.14Å; R358-W368 VanDerWaalsContact N-O 3.14Å; R358-W368 VanDerWaalsContact O-CD1 3.27Å; R358-W368 PolarHBondContact O-N 2.71Å; R358-W368 VanDerWaalsContact O-O 3.12Å
359	N	93.3	Very high	85.7	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.166	C	C	.	.			trans	-132.7	82.5	169.2	-174	5.7	0	0	0	109.7	S313 G361 G362 Q363 K364	S313-N359 PolarHBondContact O-ND2 2.91Å; N359-G361 PolarHBondContact O-N 3.02Å; N359-G362 PolarHBondContact O-N 3.29Å; N359-Q363 PolarHBondContact OD1-N 3.49Å; N359-K364 PolarHBondContact ND2-O 2.88Å; N359-K364 WeakPolarHBondContact OD1-CB 3.01Å; N359-K364 PolarHBondContact OD1-N 3.33Å
360	P	89.4	Confident	86.9	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.143	C	C	.	.	G	3₁₀ helix	trans	-59	121	-172.8	-25.9	37	0	0	0	112.3	Y343 H348 E350 L351 G362 Q363	Y343-P360 HydrophobicContact CD1-CB 4.01Å; Y343-P360 HydrophobicContact CD1-CG 4.07Å; Y343-P360 HydrophobicContact CE1-CB 4.41Å; H348-P360 HydrophobicContact CB-CB 3.94Å; H348-P360 VanDerWaalsContact CG-CB 3.46Å; E350-P360 WeakPolarHBondContact OE1-CA 3.29Å; L351-P360 HydrophobicContact CD1-CB 4.36Å; L351-P360 HydrophobicContact CD1-CG 3.8Å; L351-P360 HydrophobicContact CD2-CG 3.52Å; L351-P360 HydrophobicContact CG-CG 3.98Å; P360-G362 PolarHBondContact O-N 3.2Å; P360-G362 VanDerWaalsContact O-N 3.1Å; P360-Q363 PolarHBondContact O-N 3.38Å
361	G	84.1	Confident	87.9	Confident	35 Å²	35	24.3 Å²	24.3	36%	0.361	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	67	2.2	-175.9	0	0	0	0	0	115.7	N359 Q363	N359-G361 PolarHBondContact O-N 3.02Å; G361-Q363 PolarHBondContact O-N 2.99Å
362	G	87.3	Confident	88.4	Confident	22 Å²	22	29.6 Å²	29.6	23%	0.227	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	69.4	20.9	-173.1	0	0	0	0	0	113.6	N359 P360 K364	N359-G362 PolarHBondContact O-N 3.29Å; P360-G362 PolarHBondContact O-N 3.2Å; P360-G362 VanDerWaalsContact O-N 3.1Å; G362-K364 PolarHBondContact O-N 2.95Å
363	Q	87.2	Confident	89.4	Confident	119 Å²	119	36.1 Å²	36.1	56%	0.556	20%	0.196	S	C	*	.			trans	-69.8	-17.6	-174.8	-65.4	-178.3	48.5	0	0	113.3	N359 P360 G361	N359-Q363 PolarHBondContact OD1-N 3.49Å; P360-Q363 PolarHBondContact O-N 3.38Å; G361-Q363 PolarHBondContact O-N 2.99Å
364	K	92.9	Very high	90.5	Very high	52 Å²	52	36.9 Å²	36.9	23%	0.226	20%	0.204	C	C	.	.	S	Bend	trans	-105.6	161	175.2	-61.2	-62.9	-169.2	167.1	0	110.7	N359 G362 R366 W368 E376 Y378	N359-K364 PolarHBondContact ND2-O 2.88Å; N359-K364 WeakPolarHBondContact OD1-CB 3.01Å; N359-K364 PolarHBondContact OD1-N 3.33Å; G362-K364 PolarHBondContact O-N 2.95Å; K364-R366 PolarHBondContact O-N 3.41Å; K364-W368 HydrophobicContact CG-CG 4.27Å; K364-E376 WeakPolarHBondContact CE-OE1 3.4Å; K364-E376 IonicContact NZ-OE1 2.63Å; K364-E376 PolarHBondContact NZ-OE1 2.82Å; K364-Y378 HydrophobicContact CB-CE1 4.35Å
365	P	93.2	Very high	91.2	Very high	76 Å²	76	44.4 Å²	44.4	49%	0.494	23%	0.232	S	C	.	.	S	Bend	trans	-70.3	-17.5	177.9	26.1	-35.1	0	0	0	114.3	S313 Y378	S313-P365 WeakPolarHBondContact CA-O 3.32Å; P365-Y378 WeakPolarHBondContact CD-OH 3.39Å; P365-Y378 HydrophobicContact CG-CE1 4.05Å; P365-Y378 WeakPolarHBondContact CG-OH 3.43Å
366	R	94.3	Very high	91.6	Very high	50 Å²	50	46.9 Å²	46.9	19%	0.189	24%	0.243	C	C	.	.	S	Bend	trans	-161.1	167.7	-178.8	63.4	-172.2	175.4	114	-7.7	112.3	Y310 S313 E325 K364 Y378 C379	Y310-R366 HydrophobicContact CE1-CB 4.31Å; Y310-R366 HydrophobicContact CE2-CB 3.65Å; Y310-R366 VanDerWaalsContact CZ-CB 3.48Å; Y310-R366 VanDerWaalsContact OH-CB 3.26Å; Y310-R366 WeakPolarHBondContact OH-CB 3.5Å; S313-R366 CarbonylContact O-C 3.52Å; S313-R366 WeakPolarHBondContact O-CA 2.96Å; E325-R366 IonicContact OE1-CZ 2.84Å; E325-R366 IonicContact OE1-NH1 3.3Å; E325-R366 PolarHBondContact OE1-NH1 3.35Å; E325-R366 IonicContact OE1-NH2 3.54Å; E325-R366 PolarHBondContact OE1-NH2 2.9Å; E325-R366 IonicContact OE2-CZ 3.45Å; E325-R366 IonicContact OE2-NH1 3.6Å; E325-R366 IonicContact OE2-NH2 3.41Å; E325-R366 PolarHBondContact OE2-NH2 3.42Å; K364-R366 PolarHBondContact O-N 3.41Å; R366-Y378 HydrophobicContact CG-CD1 3.42Å; R366-Y378 VanDerWaalsContact CG-CD1 3.42Å; R366-Y378 HydrophobicContact CG-CE1 3.78Å; R366-Y378 HydrophobicContact CG-CG 4.12Å; R366-Y378 VanDerWaalsContact CZ-CG 3.42Å; R366-Y378 VanDerWaalsContact NH1-CB 3.34Å; R366-C379 PolarHBondContact NH1-O 3.43Å
367	P	95.4	Very high	92	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	24%	0.239	C	C	.	.			trans	-57.9	141.7	177.1	-28.3	38.7	0	0	0	113.9	Y310 Y317 C357 C379 L381	Y310-P367 HydrophobicContact CD1-CG 4.19Å; Y310-P367 HydrophobicContact CD2-CG 4.14Å; Y310-P367 HydrophobicContact CG-CG 3.82Å; Y317-P367 HydrophobicContact CD1-CB 4.45Å; Y317-P367 HydrophobicContact CD1-CG 4.32Å; Y317-P367 HydrophobicContact CG-CG 4.29Å; C357-P367 HydrophobicContact CB-CB 4.11Å; P367-C379 PolarHBondContact O-N 2.94Å; P367-L381 HydrophobicContact CB-CD2 4.16Å; P367-L381 HydrophobicContact CG-CD2 3.99Å
368	W	96.5	Very high	92.2	Very high	1 Å²	1	49.4 Å²	49.4	0%	0.004	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	173	-174.6	69.3	-80.8	0	0	0	110.5	W333 Y343 R358 K364 F370 E376 E377 Y378 C379	W333-W368 HydrophobicContact CH2-CD2 4.02Å; W333-W368 AromaticContact CH2-CE2 3.98Å; W333-W368 HydrophobicContact CH2-CE3 4.03Å; W333-W368 HydrophobicContact CH2-CH2 4.09Å; W333-W368 HydrophobicContact CH2-CZ2 4.03Å; W333-W368 HydrophobicContact CH2-CZ3 4.06Å; W333-W368 WeakPolarHBondContact CH2-O 3.16Å; W333-W368 VanDerWaalsContact CZ2-O 3.28Å; W333-W368 WeakPolarHBondContact CZ2-O 3.27Å; W333-W368 HydrophobicContact CZ3-CE3 4.35Å; W333-W368 AromaticContact CZ3-CH2 3.69Å; W333-W368 HydrophobicContact CZ3-CH2 3.69Å; W333-W368 AromaticContact CZ3-CZ2 3.92Å; W333-W368 HydrophobicContact CZ3-CZ2 3.92Å; W333-W368 AromaticContact CZ3-CZ3 3.91Å; W333-W368 HydrophobicContact CZ3-CZ3 3.91Å; Y343-W368 HydrophobicContact CD1-CH2 4.49Å; Y343-W368 AromaticContact CD1-CZ2 4Å; Y343-W368 HydrophobicContact CD1-CZ2 4Å; Y343-W368 AromaticContact CD2-CH2 3.78Å; Y343-W368 HydrophobicContact CD2-CH2 3.78Å; Y343-W368 HydrophobicContact CD2-CZ2 4.06Å; Y343-W368 HydrophobicContact CE1-CH2 4.38Å; Y343-W368 AromaticContact CE1-CZ2 3.69Å; Y343-W368 HydrophobicContact CE1-CZ2 3.69Å; Y343-W368 AromaticContact CE2-CH2 3.65Å; Y343-W368 HydrophobicContact CE2-CH2 3.65Å; Y343-W368 AromaticContact CE2-CZ2 3.76Å; Y343-W368 HydrophobicContact CE2-CZ2 3.76Å; Y343-W368 HydrophobicContact CG-CH2 4.21Å; Y343-W368 HydrophobicContact CG-CZ2 4.17Å; Y343-W368 AromaticContact CZ-CH2 3.96Å; Y343-W368 AromaticContact CZ-CZ2 3.55Å; R358-W368 PolarHBondContact N-O 3.14Å; R358-W368 VanDerWaalsContact N-O 3.14Å; R358-W368 VanDerWaalsContact O-CD1 3.27Å; R358-W368 PolarHBondContact O-N 2.71Å; R358-W368 VanDerWaalsContact O-O 3.12Å; K364-W368 HydrophobicContact CG-CG 4.27Å; W368-F370 HydrophobicContact CH2-CD2 4.37Å; W368-F370 HydrophobicContact CH2-CE1 4.16Å; W368-F370 AromaticContact CH2-CE2 3.61Å; W368-F370 HydrophobicContact CH2-CE2 3.61Å; W368-F370 AromaticContact CH2-CZ 3.48Å; W368-F370 HydrophobicContact CH2-CZ 3.48Å; W368-F370 VanDerWaalsContact CH2-CZ 3.48Å; W368-F370 HydrophobicContact CZ3-CD1 4.12Å; W368-F370 HydrophobicContact CZ3-CD2 4Å; W368-F370 AromaticContact CZ3-CE1 3.76Å; W368-F370 HydrophobicContact CZ3-CE1 3.76Å; W368-F370 AromaticContact CZ3-CE2 3.65Å; W368-F370 HydrophobicContact CZ3-CE2 3.65Å; W368-F370 HydrophobicContact CZ3-CG 4.23Å; W368-F370 AromaticContact CZ3-CZ 3.52Å; W368-F370 HydrophobicContact CZ3-CZ 3.52Å; W368-E376 HydrophobicContact CE3-CG 3.6Å; W368-E376 HydrophobicContact CH2-CG 4.44Å; W368-E376 HydrophobicContact CZ3-CB 4.34Å; W368-E376 HydrophobicContact CZ3-CG 3.54Å; W368-E377 WeakPolarHBondContact CA-O 3.48Å; W368-E377 WeakPolarHBondContact CB-O 3.29Å; W368-Y378 HydrophobicContact CB-CD1 3.91Å; W368-Y378 HydrophobicContact CB-CE1 4.49Å; W368-C379 VanDerWaalsContact C-SG 3.58Å
369	C	96.7	Very high	92.3	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	167.7	173.4	71.6	0	0	0	0	111.8	C330 W333 E377	C330-C369 VanDerWaalsContact CA-SG 3.58Å; C330-C369 HydrophobicContact CB-CB 3.58Å; C330-C369 WeakPolarHBondContact CB-SG 3.27Å; C330-C369 WeakPolarHBondContact SG-CB 3.43Å; C330-C369 CovalentContact SG-SG 2.03Å; C330-C369 PolarHBondContact SG-SG 3.16Å; W333-C369 HydrophobicContact CZ2-CB 4.21Å; C369-E377 PolarHBondContact N-O 3.47Å; C369-E377 PolarHBondContact O-N 3.25Å; C369-E377 VanDerWaalsContact O-O 3.07Å
370	F	95	Very high	92.3	Very high	2 Å²	2	56.8 Å²	56.8	1%	0.009	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	127.6	160.5	-62	-74	0	0	0	108.6	C330 G331 W333 F336 F340 Y343 W368 R375 E376	C330-F370 CarbonylContact C-O 3.44Å; C330-F370 WeakPolarHBondContact CA-O 3.27Å; G331-F370 PolarHBondContact N-O 3.27Å; W333-F370 AromaticContact CE3-CD2 3.94Å; W333-F370 HydrophobicContact CE3-CD2 3.94Å; W333-F370 HydrophobicContact CE3-CE2 4.02Å; W333-F370 AromaticContact CZ3-CD2 3.83Å; W333-F370 HydrophobicContact CZ3-CD2 3.83Å; W333-F370 AromaticContact CZ3-CE2 3.78Å; W333-F370 HydrophobicContact CZ3-CE2 3.78Å; F336-F370 HydrophobicContact CB-CD2 3.71Å; F336-F370 HydrophobicContact CB-CE2 3.99Å; F336-F370 HydrophobicContact CB-CG 4.15Å; F336-F370 HydrophobicContact CD1-CB 4.04Å; F336-F370 HydrophobicContact CD1-CG 4.19Å; F336-F370 HydrophobicContact CD2-CB 3.46Å; F336-F370 VanDerWaalsContact CD2-CB 3.46Å; F336-F370 AromaticContact CD2-CD2 3.71Å; F336-F370 HydrophobicContact CD2-CD2 3.71Å; F336-F370 AromaticContact CD2-CG 3.83Å; F336-F370 HydrophobicContact CD2-CG 3.83Å; F336-F370 HydrophobicContact CE1-CB 4Å; F336-F370 HydrophobicContact CE2-CB 3.39Å; F336-F370 HydrophobicContact CE2-CD2 4.5Å; F336-F370 HydrophobicContact CE2-CG 4.27Å; F336-F370 HydrophobicContact CG-CB 3.79Å; F336-F370 AromaticContact CG-CD2 3.74Å; F336-F370 HydrophobicContact CG-CD2 3.74Å; F336-F370 HydrophobicContact CG-CE2 4.49Å; F336-F370 AromaticContact CG-CG 3.78Å; F336-F370 HydrophobicContact CG-CG 3.78Å; F336-F370 HydrophobicContact CZ-CB 3.68Å; F340-F370 HydrophobicContact CB-CZ 4.05Å; F340-F370 HydrophobicContact CD1-CE1 4.27Å; F340-F370 HydrophobicContact CD1-CZ 4.06Å; F340-F370 HydrophobicContact CD2-CD1 4.36Å; F340-F370 AromaticContact CD2-CE1 3.56Å; F340-F370 HydrophobicContact CD2-CE1 3.56Å; F340-F370 HydrophobicContact CD2-CE2 4.04Å; F340-F370 AromaticContact CD2-CZ 3.36Å; F340-F370 HydrophobicContact CD2-CZ 3.36Å; F340-F370 HydrophobicContact CE1-CE1 4.1Å; F340-F370 HydrophobicContact CE1-CZ 4.36Å; F340-F370 AromaticContact CE2-CD1 3.97Å; F340-F370 HydrophobicContact CE2-CD1 3.97Å; F340-F370 AromaticContact CE2-CE1 3.35Å; F340-F370 HydrophobicContact CE2-CE1 3.35Å; F340-F370 AromaticContact CE2-CZ 3.71Å; F340-F370 HydrophobicContact CE2-CZ 3.71Å; F340-F370 HydrophobicContact CG-CE1 4.02Å; F340-F370 HydrophobicContact CG-CE2 4.38Å; F340-F370 AromaticContact CG-CZ 3.55Å; F340-F370 HydrophobicContact CG-CZ 3.55Å; F340-F370 HydrophobicContact CZ-CD1 4.44Å; F340-F370 AromaticContact CZ-CE1 3.64Å; F340-F370 HydrophobicContact CZ-CE1 3.64Å; F340-F370 HydrophobicContact CZ-CZ 4.19Å; Y343-F370 HydrophobicContact CD2-CE2 4.39Å; Y343-F370 HydrophobicContact CD2-CZ 4.14Å; W368-F370 HydrophobicContact CH2-CD2 4.37Å; W368-F370 HydrophobicContact CH2-CE1 4.16Å; W368-F370 AromaticContact CH2-CE2 3.61Å; W368-F370 HydrophobicContact CH2-CE2 3.61Å; W368-F370 AromaticContact CH2-CZ 3.48Å; W368-F370 HydrophobicContact CH2-CZ 3.48Å; W368-F370 VanDerWaalsContact CH2-CZ 3.48Å; W368-F370 HydrophobicContact CZ3-CD1 4.12Å; W368-F370 HydrophobicContact CZ3-CD2 4Å; W368-F370 AromaticContact CZ3-CE1 3.76Å; W368-F370 HydrophobicContact CZ3-CE1 3.76Å; W368-F370 AromaticContact CZ3-CE2 3.65Å; W368-F370 HydrophobicContact CZ3-CE2 3.65Å; W368-F370 HydrophobicContact CZ3-CG 4.23Å; W368-F370 AromaticContact CZ3-CZ 3.52Å; W368-F370 HydrophobicContact CZ3-CZ 3.52Å; F370-R375 CarbonylContact C-O 3.39Å; F370-R375 WeakPolarHBondContact CA-O 3.29Å; F370-E376 HydrophobicContact CD1-CB 4.08Å; F370-E376 HydrophobicContact CE1-CB 3.99Å; F370-E376 HydrophobicContact CE1-CG 4.49Å
371	T	93.2	Very high	92.3	Very high	4 Å²	4	57.6 Å²	57.6	3%	0.025	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-66.5	160.4	170.9	61.5	0	0	0	0	110.3	R329 F336 N373 G374 R375 E377	R329-T371 CarbonylContact O-C 3.39Å; R329-T371 VanDerWaalsContact O-CA 3.28Å; R329-T371 WeakPolarHBondContact O-CA 3.43Å; F336-T371 VanDerWaalsContact CZ-O 3.31Å; F336-T371 WeakPolarHBondContact CZ-O 3.45Å; T371-N373 PolarHBondContact O-N 2.95Å; T371-G374 WeakPolarHBondContact O-CA 3.34Å; T371-G374 PolarHBondContact O-N 2.95Å; T371-R375 PolarHBondContact N-O 2.93Å; T371-R375 WeakPolarHBondContact OG1-CB 3.35Å; T371-R375 PolarHBondContact OG1-N 2.84Å; T371-R375 VanDerWaalsContact OG1-N 3.15Å; T371-R375 PolarHBondContact OG1-O 2.97Å; T371-E377 HydrophobicContact CG2-CB 4.27Å; T371-E377 HydrophobicContact CG2-CG 4.14Å
372	E	90.4	Very high	92.4	Very high	111 Å²	111	62.2 Å²	62.2	52%	0.519	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-25.2	175.1	-72.8	-178.3	162.4	0	0	113	R329 G374	R329-E372 HydrophobicContact CB-CG 4.46Å; R329-E372 WeakPolarHBondContact CD-OE1 3.33Å; R329-E372 HydrophobicContact CG-CG 4.4Å; R329-E372 PolarHBondContact O-N 2.83Å; E372-G374 PolarHBondContact O-N 2.88Å
373	N	88.7	Confident	92.3	Very high	148 Å²	148	67.9 Å²	67.9	79%	0.791	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	3.5	174.7	-62.8	-21.1	0	0	0	113.6	T371	T371-N373 PolarHBondContact O-N 2.95Å
374	G	85.9	Confident	91.9	Very high	35 Å²	35	63 Å²	63	36%	0.361	30%	0.3	S	S	.	.	S	Bend	trans	78.5	13.2	178.3	0	0	0	0	0	115.4	T371 E372	T371-G374 WeakPolarHBondContact O-CA 3.34Å; T371-G374 PolarHBondContact O-N 2.95Å; E372-G374 PolarHBondContact O-N 2.88Å
375	R	91.4	Very high	90.9	Very high	173 Å²	173	63.3 Å²	63.3	65%	0.653	31%	0.308	S	S	*	.			trans	-87.6	132.3	175.6	-60.9	-174.6	177.7	-152.5	-1.6	110.7	F370 T371 E377	F370-R375 CarbonylContact C-O 3.39Å; F370-R375 WeakPolarHBondContact CA-O 3.29Å; T371-R375 PolarHBondContact N-O 2.93Å; T371-R375 WeakPolarHBondContact OG1-CB 3.35Å; T371-R375 PolarHBondContact OG1-N 2.84Å; T371-R375 VanDerWaalsContact OG1-N 3.15Å; T371-R375 PolarHBondContact OG1-O 2.97Å; R375-E377 HydrophobicContact CB-CG 4.31Å
376	E	94.4	Very high	89.3	Confident	85 Å²	85	63.7 Å²	63.7	40%	0.397	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	118.8	170.5	176.1	171.4	157.4	0	0	109.7	K364 W368 F370	K364-E376 WeakPolarHBondContact CE-OE1 3.4Å; K364-E376 IonicContact NZ-OE1 2.63Å; K364-E376 PolarHBondContact NZ-OE1 2.82Å; W368-E376 HydrophobicContact CE3-CG 3.6Å; W368-E376 HydrophobicContact CH2-CG 4.44Å; W368-E376 HydrophobicContact CZ3-CB 4.34Å; W368-E376 HydrophobicContact CZ3-CG 3.54Å; F370-E376 HydrophobicContact CD1-CB 4.08Å; F370-E376 HydrophobicContact CE1-CB 3.99Å; F370-E376 HydrophobicContact CE1-CG 4.49Å
377	E	96.7	Very high	87.6	Confident	43 Å²	43	68.6 Å²	68.6	20%	0.201	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	148.2	-177.9	-67	-172.2	-143.6	0	0	111.6	S324 S326 W368 C369 T371 R375	S324-E377 PolarHBondContact OG-OE2 3.11Å; S326-E377 WeakPolarHBondContact CB-OE2 3.35Å; S326-E377 PolarHBondContact OG-OE1 3.33Å; S326-E377 PolarHBondContact OG-OE2 3.23Å; W368-E377 WeakPolarHBondContact CA-O 3.48Å; W368-E377 WeakPolarHBondContact CB-O 3.29Å; C369-E377 PolarHBondContact N-O 3.47Å; C369-E377 PolarHBondContact O-N 3.25Å; C369-E377 VanDerWaalsContact O-O 3.07Å; T371-E377 HydrophobicContact CG2-CB 4.27Å; T371-E377 HydrophobicContact CG2-CG 4.14Å; R375-E377 HydrophobicContact CB-CG 4.31Å
378	Y	97.8	Very high	85.6	Confident	80 Å²	80	74.3 Å²	74.3	31%	0.314	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	152.5	169.8	-67	-69.1	0	0	0	111.2	S324 E325 K364 P365 R366 W368	S324-Y378 CarbonylContact C-O 3.55Å; S324-Y378 WeakPolarHBondContact CA-O 3.22Å; E325-Y378 PolarHBondContact N-O 2.99Å; K364-Y378 HydrophobicContact CB-CE1 4.35Å; P365-Y378 WeakPolarHBondContact CD-OH 3.39Å; P365-Y378 HydrophobicContact CG-CE1 4.05Å; P365-Y378 WeakPolarHBondContact CG-OH 3.43Å; R366-Y378 HydrophobicContact CG-CD1 3.42Å; R366-Y378 VanDerWaalsContact CG-CD1 3.42Å; R366-Y378 HydrophobicContact CG-CE1 3.78Å; R366-Y378 HydrophobicContact CG-CG 4.12Å; R366-Y378 VanDerWaalsContact CZ-CG 3.42Å; R366-Y378 VanDerWaalsContact NH1-CB 3.34Å; W368-Y378 HydrophobicContact CB-CD1 3.91Å; W368-Y378 HydrophobicContact CB-CE1 4.49Å
379	C	95.3	Very high	83.6	Confident	1 Å²	1	77.3 Å²	77.3	1%	0.007	38%	0.382	C	S	.	.	B	Isolated β-bridge	trans	-83.6	147.5	-179	-72.9	0	0	0	0	112.9	C357 R366 P367 W368 L381	C357-C379 HydrophobicContact CB-CB 3.68Å; C357-C379 WeakPolarHBondContact CB-SG 3.39Å; C357-C379 WeakPolarHBondContact SG-CB 3.42Å; C357-C379 CovalentContact SG-SG 2.01Å; C357-C379 PolarHBondContact SG-SG 2.94Å; R366-C379 PolarHBondContact NH1-O 3.43Å; P367-C379 PolarHBondContact O-N 2.94Å; W368-C379 VanDerWaalsContact C-SG 3.58Å; C379-L381 HydrophobicContact CB-CB 4.33Å; C379-L381 PolarHBondContact O-N 2.98Å
380	K	92.3	Very high	81.4	Confident	155 Å²	155	81.4 Å²	81.4	67%	0.674	41%	0.408	S	S	*	.	S	Bend	trans	-74	76.8	169.2	-170.6	-179.3	179.9	179.6	0	109.1	V323	V323-K380 PolarHBondContact O-N 2.94Å
381	L	89.3	Confident	79.3	Confident	17 Å²	17	89.4 Å²	89.4	9%	0.089	45%	0.445	C	S	.	.			trans	-143	130.7	-175.9	-170	73.6	0	0	0	108.4	P308 Y310 Y317 A321 P367 C379	P308-L381 VanDerWaalsContact O-CD1 3.27Å; P308-L381 WeakPolarHBondContact O-CD1 3.47Å; Y310-L381 HydrophobicContact CD1-CB 4.31Å; Y310-L381 HydrophobicContact CD1-CD2 3.71Å; Y310-L381 HydrophobicContact CD1-CG 3.88Å; Y310-L381 VanDerWaalsContact CE1-O 3.29Å; Y310-L381 WeakPolarHBondContact CE1-O 3.47Å; Y310-L381 HydrophobicContact CG-CD2 4.2Å; Y317-L381 HydrophobicContact CD1-CD2 4Å; Y317-L381 HydrophobicContact CD2-CD2 3.86Å; Y317-L381 HydrophobicContact CE1-CD2 3.71Å; Y317-L381 HydrophobicContact CE2-CD1 4.14Å; Y317-L381 HydrophobicContact CE2-CD2 3.57Å; Y317-L381 HydrophobicContact CE2-CG 4.44Å; Y317-L381 HydrophobicContact CG-CD2 4.06Å; Y317-L381 VanDerWaalsContact CZ-CD2 3.47Å; A321-L381 HydrophobicContact CB-CD1 3.82Å; P367-L381 HydrophobicContact CB-CD2 4.16Å; P367-L381 HydrophobicContact CG-CD2 3.99Å; C379-L381 HydrophobicContact CB-CB 4.33Å; C379-L381 PolarHBondContact O-N 2.98Å
382	D	87.4	Confident	77.2	Confident	131 Å²	131	91.4 Å²	91.4	70%	0.701	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	159.1	-177	-65.9	-36.6	0	0	0	111.8	C309 Y310	C309-D382 CarbonylContact C-O 3.49Å; C309-D382 WeakPolarHBondContact CA-O 3.42Å; C309-D382 WeakPolarHBondContact CB-O 3.11Å; Y310-D382 WeakPolarHBondContact CD1-O 3.38Å; Y310-D382 PolarHBondContact N-O 3.3Å
383	R	85.1	Confident	75.3	Confident	142 Å²	142	89.4 Å²	89.4	54%	0.536	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	140.8	170.8	-75	-178.7	174.1	-116.7	-5.4	109.8	Y310 G312	Y310-R383 HydrophobicContact CD2-CG 4.39Å; Y310-R383 HydrophobicContact CE1-CG 3.86Å; Y310-R383 HydrophobicContact CE2-CG 3.73Å; Y310-R383 VanDerWaalsContact CZ-CG 3.41Å; Y310-R383 CarbonylContact O-C 3.53Å; Y310-R383 VanDerWaalsContact O-CA 3.24Å; Y310-R383 WeakPolarHBondContact O-CA 3.17Å; Y310-R383 WeakPolarHBondContact OH-CG 3.35Å; Y310-R383 PolarHBondContact OH-NE 3.12Å; G312-R383 PolarHBondContact O-NH1 3.03Å; G312-R383 VanDerWaalsContact O-NH1 3.15Å; G312-R383 PolarHBondContact O-NH2 3Å
384	C	77.6	Confident	73.5	Confident	16 Å²	16	89.4 Å²	89.4	11%	0.108	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-63.1	133.7	176.5	-65.7	0	0	0	0	110.3	C309 Y310 V311 Y389	C309-C384 HydrophobicContact CB-CB 3.91Å; C309-C384 WeakPolarHBondContact CB-SG 3.44Å; C309-C384 PolarHBondContact O-SG 2.97Å; C309-C384 WeakPolarHBondContact SG-CA 3.35Å; C309-C384 WeakPolarHBondContact SG-CB 3.38Å; C309-C384 CovalentContact SG-SG 2.04Å; C309-C384 PolarHBondContact SG-SG 3.28Å; Y310-C384 PolarHBondContact O-N 3.45Å; V311-C384 HydrophobicContact CG2-CB 3.88Å; C384-Y389 HydrophobicContact CB-CD2 3.64Å; C384-Y389 HydrophobicContact CB-CE2 3.97Å; C384-Y389 HydrophobicContact CB-CG 4.34Å
385	P	71.2	Confident	71.6	Confident	59 Å²	59	97.4 Å²	97.4	38%	0.383	46%	0.463	S	S	.	.	P	Polyproline II helix	trans	-58.9	129.4	174.4	-22.3	32.8	0	0	0	109.7	D387 L388	P385-D387 PolarHBondContact O-N 3.04Å; P385-D387 VanDerWaalsContact O-N 3.16Å; P385-L388 HydrophobicContact CB-CB 4.5Å; P385-L388 HydrophobicContact CB-CD1 4.02Å; P385-L388 HydrophobicContact CG-CD1 3.95Å; P385-L388 PolarHBondContact O-N 3.47Å
386	P	60.5	Low	69.5	Low	83 Å²	83	92.4 Å²	92.4	54%	0.539	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-55	-36.6	-176.2	-25.9	33.4	0	0	0	113.5	L388 Y389 L393	P386-L388 VanDerWaalsContact C-N 3.28Å; P386-L388 PolarHBondContact O-N 3.32Å; P386-Y389 PolarHBondContact O-N 2.82Å; P386-L393 HydrophobicContact CB-CD1 3.86Å
387	D	58.9	Low	67.3	Low	154 Å²	154	94.7 Å²	94.7	82%	0.824	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-70.7	-23.7	-173.8	-52	-31	0	0	0	113.2	P385	P385-D387 PolarHBondContact O-N 3.04Å; P385-D387 VanDerWaalsContact O-N 3.16Å
388	L	54.2	Low	64.5	Low	121 Å²	121	96 Å²	96	63%	0.634	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-91.4	-14.7	-175.9	-82.3	157.1	0	0	0	113.3	P385 P386	P385-L388 HydrophobicContact CB-CB 4.5Å; P385-L388 HydrophobicContact CB-CD1 4.02Å; P385-L388 HydrophobicContact CG-CD1 3.95Å; P385-L388 PolarHBondContact O-N 3.47Å; P386-L388 VanDerWaalsContact C-N 3.28Å; P386-L388 PolarHBondContact O-N 3.32Å
389	Y	52.8	Low	61.7	Low	64 Å²	64	96.5 Å²	96.5	25%	0.251	51%	0.505	S	S	.	.			trans	-141.8	59.6	-171.7	-56	-87.1	0	0	0	113.9	C384 P386 E391 L392	C384-Y389 HydrophobicContact CB-CD2 3.64Å; C384-Y389 HydrophobicContact CB-CE2 3.97Å; C384-Y389 HydrophobicContact CB-CG 4.34Å; P386-Y389 PolarHBondContact O-N 2.82Å; Y389-E391 PolarHBondContact O-N 3.36Å; Y389-L392 HydrophobicContact CD1-CD1 3.93Å; Y389-L392 HydrophobicContact CG-CD1 4.2Å; Y389-L392 PolarHBondContact O-N 2.82Å
390	P	50.8	Low	58.7	Low	86 Å²	86	99.2 Å²	99.2	56%	0.558	53%	0.533	S	S	*	.	H	α-helix	trans	-62.8	-38	-175.7	23.7	-32.9	0	0	0	113.6	L392 L393 Q394	P390-L392 VanDerWaalsContact C-N 3.27Å; P390-L392 PolarHBondContact O-N 3.23Å; P390-L393 PolarHBondContact O-N 3.06Å; P390-Q394 PolarHBondContact O-N 2.83Å
391	E	50.7	Low	55.8	Low	169 Å²	169	97.3 Å²	97.3	79%	0.79	53%	0.534	S	S	*	.	H	α-helix	trans	-62.9	-32.3	179.9	-69.4	-173.9	165.2	0	0	113.1	Y389	Y389-E391 PolarHBondContact O-N 3.36Å
392	L	49.8	Very low	53.1	Low	47 Å²	47	105.6 Å²	105.6	25%	0.246	57%	0.572	C	S	.	*	H	α-helix	trans	-74.6	-35.8	-178.3	-64.7	-179	0	0	0	112	V303 V311 Y389 P390	V303-L392 HydrophobicContact CG2-CD2 4.21Å; V311-L392 HydrophobicContact CG2-CB 3.96Å; V311-L392 HydrophobicContact CG2-CD1 4.05Å; Y389-L392 HydrophobicContact CD1-CD1 3.93Å; Y389-L392 HydrophobicContact CG-CD1 4.2Å; Y389-L392 PolarHBondContact O-N 2.82Å; P390-L392 VanDerWaalsContact C-N 3.27Å; P390-L392 PolarHBondContact O-N 3.23Å
393	L	50.7	Low	50.1	Low	69 Å²	69	102.2 Å²	102.2	36%	0.361	57%	0.568	S	S	.	*	H	α-helix	trans	-65.4	-40.8	175.5	-88.7	150.1	0	0	0	111.8	P386 P390 R395 E396 M397	P386-L393 HydrophobicContact CB-CD1 3.86Å; P390-L393 PolarHBondContact O-N 3.06Å; L393-R395 VanDerWaalsContact C-N 3.29Å; L393-R395 PolarHBondContact O-N 3.4Å; L393-E396 PolarHBondContact O-N 3.02Å; L393-M397 WeakPolarHBondContact O-CG 3.23Å; L393-M397 PolarHBondContact O-N 2.93Å
394	Q	49.9	Very low	47.4	Very low	147 Å²	147	103.1 Å²	103.1	69%	0.687	58%	0.584	S	S	*	*	H	α-helix	trans	-60.2	-37.7	-180	-157.1	90.1	9.3	0	0	112.4	P390 E396 M397 G398	P390-Q394 PolarHBondContact O-N 2.83Å; Q394-E396 PolarHBondContact O-N 3.35Å; Q394-M397 PolarHBondContact O-N 2.87Å; Q394-G398 PolarHBondContact O-N 2.68Å; Q394-G398 VanDerWaalsContact O-N 3.17Å
395	R	47.4	Very low	45.1	Very low	204 Å²	204	111.6 Å²	111.6	77%	0.77	62%	0.619	S	S	*	*	H	α-helix	trans	-68.9	-28.4	-174.9	-120.4	178.3	-177.7	177.2	1.4	113.7	L393	L393-R395 VanDerWaalsContact C-N 3.29Å; L393-R395 PolarHBondContact O-N 3.4Å
396	E	46.1	Very low	42.9	Very low	67 Å²	67	116.7 Å²	116.7	31%	0.313	64%	0.643	S	S	.	*	H	α-helix	trans	-89.2	-33.8	172.8	-83	-165.9	164.9	0	0	112.9	G312 L393 Q394 G398 A399	G312-E396 VanDerWaalsContact CA-OE2 3.25Å; G312-E396 WeakPolarHBondContact CA-OE2 3.38Å; L393-E396 PolarHBondContact O-N 3.02Å; Q394-E396 PolarHBondContact O-N 3.35Å; E396-G398 PolarHBondContact O-N 2.95Å; E396-A399 PolarHBondContact O-N 2.85Å
397	M	48	Very low	41.3	Very low	133 Å²	133	120.6 Å²	120.6	66%	0.655	66%	0.659	S	S	*	*	H	α-helix	trans	-60.7	-30	174.7	-69	-176.5	77	0	0	111.9	L393 Q394 A399	L393-M397 WeakPolarHBondContact O-CG 3.23Å; L393-M397 PolarHBondContact O-N 2.93Å; Q394-M397 PolarHBondContact O-N 2.87Å; M397-A399 VanDerWaalsContact C-N 3.27Å; M397-A399 PolarHBondContact O-N 2.9Å
398	G	39.5	Very low	39.8	Very low	71 Å²	71	117.9 Å²	117.9	73%	0.732	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-14.5	172.4	0	0	0	0	0	115.3	Q394 E396	Q394-G398 PolarHBondContact O-N 2.68Å; Q394-G398 VanDerWaalsContact O-N 3.17Å; E396-G398 PolarHBondContact O-N 2.95Å
399	A	37.7	Very low	38.4	Very low	90 Å²	90	118.2 Å²	118.2	74%	0.744	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	3.9	-176.4	0	0	0	0	0	114.3	E396 M397	E396-A399 PolarHBondContact O-N 2.85Å; M397-A399 VanDerWaalsContact C-N 3.27Å; M397-A399 PolarHBondContact O-N 2.9Å
400	G	31.9	Very low	37.2	Very low	58 Å²	58	118.3 Å²	118.3	60%	0.598	69%	0.685	S	S	*	*	S	Bend	trans	149.4	83.4	163.4	0	0	0	0	0	114.3
401	V	32.9	Very low	36	Very low	115 Å²	115	122 Å²	122	70%	0.697	70%	0.7	S	S	*	*			trans	-150.7	76.8	152	-169.1	0	0	0	0	108.3	G403	V401-G403 PolarHBondContact O-N 3.28Å
402	H	31.2	Very low	35	Very low	191 Å²	191	125 Å²	125	88%	0.884	70%	0.703	S	S	*	*			trans	-66.8	117.8	146.2	-103.4	-60.4	0	0	0	105.3	D404	H402-D404 PolarHBondContact O-N 2.95Å; H402-D404 VanDerWaalsContact O-N 3.11Å
403	G	26.1	Very low	34.1	Very low	61 Å²	61	131.2 Å²	131.2	63%	0.629	74%	0.736	S	S	*	*			trans	-64.5	108.3	-164.5	0	0	0	0	0	113.8	V401 K405	V401-G403 PolarHBondContact O-N 3.28Å; G403-K405 PolarHBondContact O-N 3.12Å
404	D	27.9	Very low	33.1	Very low	161 Å²	161	134.7 Å²	134.7	86%	0.861	76%	0.755	S	S	*	*			trans	-87	92.1	163.8	-74.4	-28.7	0	0	0	109.3	H402 N406	H402-D404 PolarHBondContact O-N 2.95Å; H402-D404 VanDerWaalsContact O-N 3.11Å; D404-N406 PolarHBondContact O-N 3.45Å
405	K	28.7	Very low	32.4	Very low	193 Å²	193	136.9 Å²	136.9	84%	0.839	76%	0.763	S	S	*	*			trans	-63.7	119.8	156.3	-69.7	177.5	177.8	176.6	0	107.4	G403 L407	G403-K405 PolarHBondContact O-N 3.12Å; K405-L407 PolarHBondContact O-N 3.38Å
406	N	25.5	Very low	31.6	Very low	167 Å²	167	138.2 Å²	138.2	89%	0.893	77%	0.768	S	S	*	*			trans	26.9	84.1	154.9	-65.1	-15.8	0	0	0	115.4	D404	D404-N406 PolarHBondContact O-N 3.45Å
407	L	27.1	Very low	31.1	Very low	165 Å²	165	142.9 Å²	142.9	86%	0.864	80%	0.795	S	S	*	*			trans	-127	111	157.6	-158.8	61.5	0	0	0	110.3	K405	K405-L407 PolarHBondContact O-N 3.38Å
408	S	26.4	Very low	30.9	Very low	97 Å²	97	144.5 Å²	144.5	68%	0.678	81%	0.805	S	S	*	*			trans	-50.1	133.2	178.3	44.5	0	0	0	0	113.6
409	S	25.9	Very low	31.6	Very low	128 Å²	128	144.5 Å²	144.5	90%	0.895	79%	0.794	S	S	*	*	S	Bend	trans	16.6	103.7	138.3	-50.9	0	0	0	0	116.9
410	G	26.9	Very low	32.5	Very low	66 Å²	66	144.4 Å²	144.4	68%	0.68	79%	0.788	S	S	*	*			trans	127.5	70.6	155.6	0	0	0	0	0	113.7
411	D	26.5	Very low	33.9	Very low	164 Å²	164	146.8 Å²	146.8	88%	0.877	79%	0.787	S	S	*	*			trans	-150.3	125.1	142.2	-91.3	-35	0	0	0	109.9	L413	D411-L413 PolarHBondContact O-N 3.46Å
412	R	28.4	Very low	34.9	Very low	230 Å²	230	149 Å²	149	87%	0.868	78%	0.784	S	S	*	*			trans	-61.7	121.7	177	-76.2	171.1	147.7	-172.4	-7.1	108.2	N414	R412-N414 PolarHBondContact O-N 3.07Å
413	L	31.3	Very low	36.5	Very low	178 Å²	178	146.9 Å²	146.9	93%	0.932	77%	0.773	S	S	*	*			trans	-53.3	99.2	174.2	-86.8	131.5	0	0	0	110.5	D411 F415	D411-L413 PolarHBondContact O-N 3.46Å; L413-F415 PolarHBondContact O-N 3.47Å; L413-F415 VanDerWaalsContact O-N 3.13Å
414	N	30.8	Very low	38.4	Very low	142 Å²	142	150 Å²	150	76%	0.759	77%	0.771	S	S	*	*			trans	-73.3	98.4	173	-70.5	-38.1	0	0	0	108.8	R412 W416	R412-N414 PolarHBondContact O-N 3.07Å; N414-W416 PolarHBondContact O-N 2.86Å
415	F	34.6	Very low	40.5	Very low	194 Å²	194	150.5 Å²	150.5	85%	0.851	76%	0.762	S	S	*	*			trans	-70	14.8	178.4	-163.3	-100	0	0	0	114.1	L413	L413-F415 PolarHBondContact O-N 3.47Å; L413-F415 VanDerWaalsContact O-N 3.13Å
416	W	30.9	Very low	42.4	Very low	232 Å²	232	145.8 Å²	145.8	88%	0.879	75%	0.745	S	S	*	*			trans	-112.9	79.7	-178.8	-60.7	102.7	0	0	0	110.6	N414	N414-W416 PolarHBondContact O-N 2.86Å
417	N	35.3	Very low	44.7	Very low	165 Å²	165	143.4 Å²	143.4	88%	0.882	73%	0.73	S	S	*	*			trans	-145.7	34.5	161.8	-123.2	-0.6	0	0	0	112.3	S419	N417-S419 PolarHBondContact O-N 2.66Å
418	L	43.6	Very low	47.2	Very low	166 Å²	166	139.7 Å²	139.7	87%	0.869	71%	0.714	S	S	*	*	S	Bend	trans	-76.7	115.1	163.4	-152.7	76.5	0	0	0	106.8	S420	L418-S420 PolarHBondContact O-N 2.02Å
419	S	53.3	Low	49.6	Very low	71 Å²	71	137.9 Å²	137.9	50%	0.497	71%	0.705	S	S	.	*			trans	-37.8	119.1	-169.6	58.2	0	0	0	0	113.6	N417 D421 Y422	N417-S419 PolarHBondContact O-N 2.66Å; S419-D421 PolarHBondContact O-N 3.3Å; S419-Y422 PolarHBondContact O-N 2.64Å; S419-Y422 VanDerWaalsContact O-N 3.08Å
420	S	57.2	Low	51.9	Low	89 Å²	89	134.8 Å²	134.8	62%	0.622	69%	0.687	S	S	*	*	H	α-helix	trans	-43.9	-33.9	176.3	-177.2	0	0	0	0	113.3	L418 Y422 Q424	L418-S420 PolarHBondContact O-N 2.02Å; S420-Y422 PolarHBondContact O-N 2.98Å; S420-Q424 PolarHBondContact O-N 2.8Å
421	D	60.8	Low	54.6	Low	108 Å²	108	133.5 Å²	133.5	58%	0.578	67%	0.674	S	S	*	*	H	α-helix	trans	-65.5	-36.6	-175.1	-60.7	-12.9	0	0	0	112.9	S419 Q424 Y425	S419-D421 PolarHBondContact O-N 3.3Å; D421-Q424 WeakPolarHBondContact O-CB 2.93Å; D421-Q424 PolarHBondContact O-N 3.12Å; D421-Y425 WeakPolarHBondContact O-CD2 3.46Å; D421-Y425 PolarHBondContact O-N 2.85Å
422	Y	53.7	Low	57.5	Low	162 Å²	162	129.5 Å²	129.5	64%	0.635	66%	0.655	S	S	*	*	H	α-helix	trans	-72.4	-36	-174.4	-152	-92.7	0	0	0	112.4	S419 S420 Q424 Y425 I426	S419-Y422 PolarHBondContact O-N 2.64Å; S419-Y422 VanDerWaalsContact O-N 3.08Å; S420-Y422 PolarHBondContact O-N 2.98Å; Y422-Q424 VanDerWaalsContact C-N 3.28Å; Y422-Q424 PolarHBondContact O-N 2.8Å; Y422-Y425 PolarHBondContact O-N 3.16Å; Y422-I426 HydrophobicContact CD1-CD1 3.97Å; Y422-I426 HydrophobicContact CD1-CG1 4.45Å; Y422-I426 HydrophobicContact CE1-CD1 4.02Å; Y422-I426 HydrophobicContact CE1-CG1 4.45Å; Y422-I426 PolarHBondContact O-N 3.16Å
423	F	64.9	Low	60.2	Low	146 Å²	146	124.3 Å²	124.3	64%	0.64	64%	0.644	S	S	*	*	H	α-helix	trans	-66	-35.6	175.7	-163.2	-95.4	0	0	0	111.1	I426 M427	F423-I426 PolarHBondContact O-N 3.1Å; F423-M427 HydrophobicContact CD1-CG 3.99Å; F423-M427 HydrophobicContact CE1-CG 3.78Å; F423-M427 HydrophobicContact CE1-SD 4.16Å; F423-M427 HydrophobicContact CZ-CG 4.48Å; F423-M427 HydrophobicContact CZ-SD 4.4Å; F423-M427 WeakPolarHBondContact O-CG 3.43Å; F423-M427 PolarHBondContact O-N 3.4Å; F423-M427 VanDerWaalsContact O-N 3.16Å
424	Q	67.3	Low	62.7	Low	126 Å²	126	117.4 Å²	117.4	59%	0.589	62%	0.616	S	S	*	*	H	α-helix	trans	-65	-39.6	177.5	-161.9	163.3	-25.4	0	0	111.9	S420 D421 Y422 M427 V428	S420-Q424 PolarHBondContact O-N 2.8Å; D421-Q424 WeakPolarHBondContact O-CB 2.93Å; D421-Q424 PolarHBondContact O-N 3.12Å; Y422-Q424 VanDerWaalsContact C-N 3.28Å; Y422-Q424 PolarHBondContact O-N 2.8Å; Q424-M427 PolarHBondContact O-N 2.59Å; Q424-V428 VanDerWaalsContact O-CG2 3.26Å; Q424-V428 WeakPolarHBondContact O-CG2 3.23Å; Q424-V428 PolarHBondContact O-N 2.97Å; Q424-V428 VanDerWaalsContact O-N 3.07Å
425	Y	70.7	Confident	65.5	Low	172 Å²	172	115.3 Å²	115.3	68%	0.675	61%	0.608	S	S	*	*	H	α-helix	trans	-64.4	-41.3	175.3	-80.5	-74.5	0	0	0	113.5	D421 Y422 V428 A429	D421-Y425 WeakPolarHBondContact O-CD2 3.46Å; D421-Y425 PolarHBondContact O-N 2.85Å; Y422-Y425 PolarHBondContact O-N 3.16Å; Y425-V428 PolarHBondContact O-N 3.47Å; Y425-A429 WeakPolarHBondContact O-CB 3.22Å; Y425-A429 PolarHBondContact O-N 2.93Å
426	I	68.4	Low	68.1	Low	93 Å²	93	111.1 Å²	111.1	48%	0.477	59%	0.594	S	S	.	*	H	α-helix	trans	-64.8	-42.7	179.4	-65.3	174	0	0	0	110.6	Y422 F423 V428 A429 A430	Y422-I426 HydrophobicContact CD1-CD1 3.97Å; Y422-I426 HydrophobicContact CD1-CG1 4.45Å; Y422-I426 HydrophobicContact CE1-CD1 4.02Å; Y422-I426 HydrophobicContact CE1-CG1 4.45Å; Y422-I426 PolarHBondContact O-N 3.16Å; F423-I426 PolarHBondContact O-N 3.1Å; I426-V428 PolarHBondContact O-N 2.84Å; I426-A429 PolarHBondContact O-N 3.45Å; I426-A430 WeakPolarHBondContact O-CB 3.26Å; I426-A430 PolarHBondContact O-N 3.04Å
427	M	73.9	Confident	71	Confident	118 Å²	118	103.9 Å²	103.9	58%	0.581	58%	0.575	S	S	*	*	H	α-helix	trans	-65.5	-38.8	178.5	-67.8	-62.1	-70.2	0	0	112.1	F423 Q424 G431	F423-M427 HydrophobicContact CD1-CG 3.99Å; F423-M427 HydrophobicContact CE1-CG 3.78Å; F423-M427 HydrophobicContact CE1-SD 4.16Å; F423-M427 HydrophobicContact CZ-CG 4.48Å; F423-M427 HydrophobicContact CZ-SD 4.4Å; F423-M427 WeakPolarHBondContact O-CG 3.43Å; F423-M427 PolarHBondContact O-N 3.4Å; F423-M427 VanDerWaalsContact O-N 3.16Å; Q424-M427 PolarHBondContact O-N 2.59Å; M427-G431 PolarHBondContact O-N 3.49Å
428	V	79.8	Confident	73.6	Confident	87 Å²	87	101.7 Å²	101.7	53%	0.527	56%	0.563	S	S	.	*	H	α-helix	trans	-67	-45.7	175.1	173.3	0	0	0	0	110.8	Q424 Y425 I426 A430 G431 V432	Q424-V428 VanDerWaalsContact O-CG2 3.26Å; Q424-V428 WeakPolarHBondContact O-CG2 3.23Å; Q424-V428 PolarHBondContact O-N 2.97Å; Q424-V428 VanDerWaalsContact O-N 3.07Å; Y425-V428 PolarHBondContact O-N 3.47Å; I426-V428 PolarHBondContact O-N 2.84Å; V428-A430 PolarHBondContact O-N 3.41Å; V428-G431 PolarHBondContact O-N 2.71Å; V428-V432 HydrophobicContact CG1-CG2 4.29Å; V428-V432 VanDerWaalsContact O-CG2 3.24Å; V428-V432 WeakPolarHBondContact O-CG2 3.28Å; V428-V432 PolarHBondContact O-N 2.85Å
429	A	76.9	Confident	75.8	Confident	59 Å²	59	96 Å²	96	49%	0.488	54%	0.54	S	S	.	.	H	α-helix	trans	-62.6	-43.3	179.3	0	0	0	0	0	112.2	Y425 I426 G431 V432 L433	Y425-A429 WeakPolarHBondContact O-CB 3.22Å; Y425-A429 PolarHBondContact O-N 2.93Å; I426-A429 PolarHBondContact O-N 3.45Å; A429-G431 VanDerWaalsContact C-N 3.33Å; A429-G431 PolarHBondContact O-N 2.95Å; A429-V432 PolarHBondContact O-N 2.83Å; A429-L433 WeakPolarHBondContact O-CB 3.35Å; A429-L433 PolarHBondContact O-N 3.47Å
430	A	75.7	Confident	77.6	Confident	63 Å²	63	96.6 Å²	96.6	52%	0.521	54%	0.54	S	S	.	.	H	α-helix	trans	-63.1	-39.5	175.3	0	0	0	0	0	112	I426 V428 L433 G434	I426-A430 WeakPolarHBondContact O-CB 3.26Å; I426-A430 PolarHBondContact O-N 3.04Å; V428-A430 PolarHBondContact O-N 3.41Å; A430-L433 PolarHBondContact O-N 3.04Å; A430-G434 PolarHBondContact O-N 3.5Å
431	G	82.7	Confident	79.1	Confident	39 Å²	39	97.1 Å²	97.1	40%	0.402	54%	0.535	S	S	.	.	H	α-helix	trans	-63.2	-46.2	174.6	0	0	0	0	0	112.8	M427 V428 A429 L433 G434 V435	M427-G431 PolarHBondContact O-N 3.49Å; V428-G431 PolarHBondContact O-N 2.71Å; A429-G431 VanDerWaalsContact C-N 3.33Å; A429-G431 PolarHBondContact O-N 2.95Å; G431-L433 PolarHBondContact O-N 2.86Å; G431-G434 PolarHBondContact O-N 2.82Å; G431-V435 WeakPolarHBondContact O-CG2 3.33Å; G431-V435 PolarHBondContact O-N 3.47Å
432	V	88.4	Confident	80.3	Confident	80 Å²	80	94.6 Å²	94.6	49%	0.485	53%	0.53	S	S	.	.	H	α-helix	trans	-61.5	-44.5	177.6	174.2	0	0	0	0	110.7	V428 A429 G434 V435 L436	V428-V432 HydrophobicContact CG1-CG2 4.29Å; V428-V432 VanDerWaalsContact O-CG2 3.24Å; V428-V432 WeakPolarHBondContact O-CG2 3.28Å; V428-V432 PolarHBondContact O-N 2.85Å; A429-V432 PolarHBondContact O-N 2.83Å; V432-G434 VanDerWaalsContact C-N 3.34Å; V432-G434 PolarHBondContact O-N 3.24Å; V432-V435 PolarHBondContact O-N 3.28Å; V432-L436 HydrophobicContact CG1-CD1 4.16Å; V432-L436 WeakPolarHBondContact O-CG 3.5Å; V432-L436 PolarHBondContact O-N 2.97Å
433	L	84.1	Confident	81.9	Confident	121 Å²	121	92.3 Å²	92.3	63%	0.634	53%	0.527	S	S	*	.	H	α-helix	trans	-62.5	-42.5	178	-144.9	97.9	0	0	0	111.5	A429 A430 G431 V435 L436 V437	A429-L433 WeakPolarHBondContact O-CB 3.35Å; A429-L433 PolarHBondContact O-N 3.47Å; A430-L433 PolarHBondContact O-N 3.04Å; G431-L433 PolarHBondContact O-N 2.86Å; L433-V435 PolarHBondContact O-N 2.95Å; L433-L436 PolarHBondContact O-N 2.65Å; L433-V437 WeakPolarHBondContact O-CG2 3.22Å; L433-V437 PolarHBondContact O-N 2.89Å
434	G	84.8	Confident	82.6	Confident	33 Å²	33	90 Å²	90	34%	0.34	52%	0.521	S	S	.	.	H	α-helix	trans	-61.2	-42	176.4	0	0	0	0	0	113	A430 G431 V432 V437 L438	A430-G434 PolarHBondContact O-N 3.5Å; G431-G434 PolarHBondContact O-N 2.82Å; V432-G434 VanDerWaalsContact C-N 3.34Å; V432-G434 PolarHBondContact O-N 3.24Å; G434-V437 PolarHBondContact O-N 3.35Å; G434-L438 WeakPolarHBondContact O-CG 3.32Å; G434-L438 PolarHBondContact O-N 3.45Å; G434-L438 VanDerWaalsContact O-N 3.12Å
435	V	88.9	Confident	83.1	Confident	98 Å²	98	90.3 Å²	90.3	59%	0.594	52%	0.52	S	S	*	.	H	α-helix	trans	-65.1	-41.1	176.9	172.8	0	0	0	0	111.5	G431 V432 L433 L438 A439	G431-V435 WeakPolarHBondContact O-CG2 3.33Å; G431-V435 PolarHBondContact O-N 3.47Å; V432-V435 PolarHBondContact O-N 3.28Å; L433-V435 PolarHBondContact O-N 2.95Å; V435-L438 PolarHBondContact O-N 3.12Å; V435-A439 WeakPolarHBondContact O-CB 3.49Å; V435-A439 PolarHBondContact O-N 2.81Å
436	L	89.5	Confident	83.4	Confident	105 Å²	105	85.3 Å²	85.3	55%	0.55	51%	0.508	S	S	.	.	H	α-helix	trans	-64.1	-43.2	178	-71.1	172.2	0	0	0	112	V432 L433 L438 A439 V440	V432-L436 HydrophobicContact CG1-CD1 4.16Å; V432-L436 WeakPolarHBondContact O-CG 3.5Å; V432-L436 PolarHBondContact O-N 2.97Å; L433-L436 PolarHBondContact O-N 2.65Å; L436-L438 VanDerWaalsContact C-N 3.35Å; L436-L438 PolarHBondContact O-N 2.85Å; L436-A439 PolarHBondContact O-N 2.8Å; L436-V440 WeakPolarHBondContact O-CG2 3.32Å; L436-V440 PolarHBondContact O-N 3.21Å
437	V	91.1	Very high	83.2	Confident	81 Å²	81	89.8 Å²	89.8	49%	0.491	52%	0.52	S	S	.	.	H	α-helix	trans	-61.5	-44.1	176.7	172.4	0	0	0	0	111	L433 G434 A439 V440 L441	L433-V437 WeakPolarHBondContact O-CG2 3.22Å; L433-V437 PolarHBondContact O-N 2.89Å; G434-V437 PolarHBondContact O-N 3.35Å; V437-A439 VanDerWaalsContact C-N 3.34Å; V437-A439 PolarHBondContact O-N 3.41Å; V437-V440 PolarHBondContact O-N 3.31Å; V437-L441 HydrophobicContact CG1-CD1 4.12Å; V437-L441 WeakPolarHBondContact O-CG 3.05Å; V437-L441 PolarHBondContact O-N 3.34Å
438	L	89	Confident	82.8	Confident	119 Å²	119	88.6 Å²	88.6	62%	0.623	52%	0.522	S	S	*	.	H	α-helix	trans	-64.8	-37.2	177.8	-70.5	173.8	0	0	0	112.6	G434 V435 L436 L441 A442	G434-L438 WeakPolarHBondContact O-CG 3.32Å; G434-L438 PolarHBondContact O-N 3.45Å; G434-L438 VanDerWaalsContact O-N 3.12Å; V435-L438 PolarHBondContact O-N 3.12Å; L436-L438 VanDerWaalsContact C-N 3.35Å; L436-L438 PolarHBondContact O-N 2.85Å; L438-L441 PolarHBondContact O-N 2.76Å; L438-A442 WeakPolarHBondContact O-CB 3.38Å; L438-A442 PolarHBondContact O-N 3.31Å
439	A	90.4	Very high	81.7	Confident	47 Å²	47	90.5 Å²	90.5	39%	0.388	52%	0.523	S	S	.	.	H	α-helix	trans	-64.9	-43.9	176	0	0	0	0	0	112.1	V435 L436 V437 A442 I443	V435-A439 WeakPolarHBondContact O-CB 3.49Å; V435-A439 PolarHBondContact O-N 2.81Å; L436-A439 PolarHBondContact O-N 2.8Å; V437-A439 VanDerWaalsContact C-N 3.34Å; V437-A439 PolarHBondContact O-N 3.41Å; A439-A442 PolarHBondContact O-N 2.02Å; A439-I443 VanDerWaalsContact O-CG1 3.32Å; A439-I443 WeakPolarHBondContact O-CG1 3.33Å; A439-I443 PolarHBondContact O-N 2.77Å
440	V	92	Very high	80.1	Confident	82 Å²	82	97 Å²	97	50%	0.497	54%	0.535	S	S	.	.	H	α-helix	trans	-61.9	-44.9	176.4	172.6	0	0	0	0	110.8	L436 V437 A442 I443 L444	L436-V440 WeakPolarHBondContact O-CG2 3.32Å; L436-V440 PolarHBondContact O-N 3.21Å; V437-V440 PolarHBondContact O-N 3.31Å; V440-A442 VanDerWaalsContact C-N 3.32Å; V440-A442 PolarHBondContact O-N 3.13Å; V440-I443 PolarHBondContact O-N 3.08Å; V440-L444 HydrophobicContact CG1-CD1 4.01Å; V440-L444 HydrophobicContact CG1-CG 4.42Å; V440-L444 WeakPolarHBondContact O-CG 3.44Å; V440-L444 PolarHBondContact O-N 3.39Å
441	L	88.3	Confident	78.5	Confident	101 Å²	101	97.2 Å²	97.2	53%	0.529	54%	0.544	S	S	.	.	H	α-helix	trans	-61.7	-39.5	176.8	-69.8	174	0	0	0	112.1	V437 L438 L444 F445	V437-L441 HydrophobicContact CG1-CD1 4.12Å; V437-L441 WeakPolarHBondContact O-CG 3.05Å; V437-L441 PolarHBondContact O-N 3.34Å; L438-L441 PolarHBondContact O-N 2.76Å; L441-L444 PolarHBondContact O-N 2.63Å; L441-F445 VanDerWaalsContact O-CB 3.31Å; L441-F445 WeakPolarHBondContact O-CB 3.34Å; L441-F445 PolarHBondContact O-N 3.33Å
442	A	86.1	Confident	76.2	Confident	55 Å²	55	105.8 Å²	105.8	46%	0.455	56%	0.564	S	S	.	*	H	α-helix	trans	-65.7	-40.7	175.8	0	0	0	0	0	112.4	L438 A439 V440 F445 V446	L438-A442 WeakPolarHBondContact O-CB 3.38Å; L438-A442 PolarHBondContact O-N 3.31Å; A439-A442 PolarHBondContact O-N 2.02Å; V440-A442 VanDerWaalsContact C-N 3.32Å; V440-A442 PolarHBondContact O-N 3.13Å; A442-F445 PolarHBondContact O-N 3.11Å; A442-V446 VanDerWaalsContact O-CG2 3.31Å; A442-V446 WeakPolarHBondContact O-CG2 3.35Å; A442-V446 PolarHBondContact O-N 2.66Å
443	I	87	Confident	73.5	Confident	114 Å²	114	111 Å²	111	59%	0.585	58%	0.58	S	S	*	*	H	α-helix	trans	-63.2	-47.1	176.3	-68.3	165	0	0	0	110.3	A439 V440 F445 V446 Y447	A439-I443 VanDerWaalsContact O-CG1 3.32Å; A439-I443 WeakPolarHBondContact O-CG1 3.33Å; A439-I443 PolarHBondContact O-N 2.77Å; V440-I443 PolarHBondContact O-N 3.08Å; I443-F445 VanDerWaalsContact C-N 3.3Å; I443-F445 PolarHBondContact O-N 2.81Å; I443-V446 PolarHBondContact O-N 3.29Å; I443-Y447 WeakPolarHBondContact O-CB 3.08Å; I443-Y447 PolarHBondContact O-N 2.91Å
444	L	79.5	Confident	71.1	Confident	98 Å²	98	109.8 Å²	109.8	51%	0.513	59%	0.588	S	S	.	*	H	α-helix	trans	-60.9	-41	176.7	-69.7	173.3	0	0	0	111.3	V440 L441 Y447 C448	V440-L444 HydrophobicContact CG1-CD1 4.01Å; V440-L444 HydrophobicContact CG1-CG 4.42Å; V440-L444 WeakPolarHBondContact O-CG 3.44Å; V440-L444 PolarHBondContact O-N 3.39Å; L441-L444 PolarHBondContact O-N 2.63Å; L444-Y447 PolarHBondContact O-N 3.47Å; L444-C448 WeakPolarHBondContact O-CB 3.01Å; L444-C448 PolarHBondContact O-N 3.19Å; L444-C448 PolarHBondContact O-SG 2.98Å
445	F	77.5	Confident	68.4	Low	131 Å²	131	119.7 Å²	119.7	58%	0.575	62%	0.615	S	S	*	*	H	α-helix	trans	-63	-44.1	176	-164	-94	0	0	0	111.9	L441 A442 I443 Y447 C448 F449	L441-F445 VanDerWaalsContact O-CB 3.31Å; L441-F445 WeakPolarHBondContact O-CB 3.34Å; L441-F445 PolarHBondContact O-N 3.33Å; A442-F445 PolarHBondContact O-N 3.11Å; I443-F445 VanDerWaalsContact C-N 3.3Å; I443-F445 PolarHBondContact O-N 2.81Å; F445-Y447 VanDerWaalsContact C-N 3.32Å; F445-Y447 PolarHBondContact O-N 2.86Å; F445-C448 PolarHBondContact O-N 3.25Å; F445-F449 AromaticContact CD1-CD2 3.77Å; F445-F449 HydrophobicContact CD1-CD2 3.77Å; F445-F449 HydrophobicContact CD1-CE2 4.08Å; F445-F449 HydrophobicContact CD2-CE2 4.38Å; F445-F449 AromaticContact CE1-CD2 3.47Å; F445-F449 HydrophobicContact CE1-CD2 3.47Å; F445-F449 VanDerWaalsContact CE1-CD2 3.47Å; F445-F449 AromaticContact CE1-CE2 3.36Å; F445-F449 HydrophobicContact CE1-CE2 3.36Å; F445-F449 HydrophobicContact CE1-CG 4.43Å; F445-F449 HydrophobicContact CE1-CZ 4.23Å; F445-F449 HydrophobicContact CE2-CD2 4.28Å; F445-F449 AromaticContact CE2-CE2 3.73Å; F445-F449 HydrophobicContact CE2-CE2 3.73Å; F445-F449 HydrophobicContact CG-CD2 4.31Å; F445-F449 AromaticContact CZ-CD2 3.78Å; F445-F449 HydrophobicContact CZ-CD2 3.78Å; F445-F449 AromaticContact CZ-CE2 3.18Å; F445-F449 HydrophobicContact CZ-CE2 3.18Å; F445-F449 AromaticContact CZ-CZ 3.98Å; F445-F449 HydrophobicContact CZ-CZ 3.98Å; F445-F449 WeakPolarHBondContact O-CD2 3.47Å; F445-F449 PolarHBondContact O-N 3.5Å
446	V	78.2	Confident	65.4	Low	67 Å²	67	123.8 Å²	123.8	41%	0.406	62%	0.624	S	S	.	*	H	α-helix	trans	-63.3	-38.4	174.8	170.7	0	0	0	0	111.3	A442 I443 F449 R450	A442-V446 VanDerWaalsContact O-CG2 3.31Å; A442-V446 WeakPolarHBondContact O-CG2 3.35Å; A442-V446 PolarHBondContact O-N 2.66Å; I443-V446 PolarHBondContact O-N 3.29Å; V446-F449 PolarHBondContact O-N 3.49Å; V446-R450 HydrophobicContact CG1-CG 4.36Å; V446-R450 WeakPolarHBondContact O-CB 3.25Å; V446-R450 PolarHBondContact O-N 3.45Å
447	Y	64	Low	62.5	Low	188 Å²	188	125.9 Å²	125.9	74%	0.737	64%	0.636	S	S	*	*	H	α-helix	trans	-65.8	-45.8	177.8	-140.2	-94.7	0	0	0	111.2	I443 L444 F445 F449 R450 G451	I443-Y447 WeakPolarHBondContact O-CB 3.08Å; I443-Y447 PolarHBondContact O-N 2.91Å; L444-Y447 PolarHBondContact O-N 3.47Å; F445-Y447 VanDerWaalsContact C-N 3.32Å; F445-Y447 PolarHBondContact O-N 2.86Å; Y447-F449 VanDerWaalsContact C-N 3.33Å; Y447-F449 PolarHBondContact O-N 3.24Å; Y447-R450 PolarHBondContact O-N 3.19Å; Y447-G451 PolarHBondContact O-N 3.47Å
448	C	64	Low	59.5	Low	92 Å²	92	131.5 Å²	131.5	62%	0.622	65%	0.654	S	S	*	*	H	α-helix	trans	-61.3	-38.6	175	-71.5	0	0	0	0	112.5	L444 F445	L444-C448 WeakPolarHBondContact O-CB 3.01Å; L444-C448 PolarHBondContact O-N 3.19Å; L444-C448 PolarHBondContact O-SG 2.98Å; F445-C448 PolarHBondContact O-N 3.25Å
449	F	57.2	Low	56.4	Low	127 Å²	127	133.3 Å²	133.3	56%	0.557	66%	0.664	S	S	*	*	H	α-helix	trans	-77.9	-36.2	178.1	-92.8	-90.4	0	0	0	113.5	F445 V446 Y447 G451 R452	F445-F449 AromaticContact CD1-CD2 3.77Å; F445-F449 HydrophobicContact CD1-CD2 3.77Å; F445-F449 HydrophobicContact CD1-CE2 4.08Å; F445-F449 HydrophobicContact CD2-CE2 4.38Å; F445-F449 AromaticContact CE1-CD2 3.47Å; F445-F449 HydrophobicContact CE1-CD2 3.47Å; F445-F449 VanDerWaalsContact CE1-CD2 3.47Å; F445-F449 AromaticContact CE1-CE2 3.36Å; F445-F449 HydrophobicContact CE1-CE2 3.36Å; F445-F449 HydrophobicContact CE1-CG 4.43Å; F445-F449 HydrophobicContact CE1-CZ 4.23Å; F445-F449 HydrophobicContact CE2-CD2 4.28Å; F445-F449 AromaticContact CE2-CE2 3.73Å; F445-F449 HydrophobicContact CE2-CE2 3.73Å; F445-F449 HydrophobicContact CG-CD2 4.31Å; F445-F449 AromaticContact CZ-CD2 3.78Å; F445-F449 HydrophobicContact CZ-CD2 3.78Å; F445-F449 AromaticContact CZ-CE2 3.18Å; F445-F449 HydrophobicContact CZ-CE2 3.18Å; F445-F449 AromaticContact CZ-CZ 3.98Å; F445-F449 HydrophobicContact CZ-CZ 3.98Å; F445-F449 WeakPolarHBondContact O-CD2 3.47Å; F445-F449 PolarHBondContact O-N 3.5Å; V446-F449 PolarHBondContact O-N 3.49Å; Y447-F449 VanDerWaalsContact C-N 3.33Å; Y447-F449 PolarHBondContact O-N 3.24Å; F449-G451 VanDerWaalsContact C-N 3.29Å; F449-R452 PolarHBondContact O-N 2.94Å
450	R	44.1	Very low	53.3	Low	195 Å²	195	137.2 Å²	137.2	74%	0.736	69%	0.687	S	S	*	*	H	α-helix	trans	-69.6	-29	174	-80.7	-171.8	155.3	119.6	-3.3	112.1	V446 Y447 R452 K453	V446-R450 HydrophobicContact CG1-CG 4.36Å; V446-R450 WeakPolarHBondContact O-CB 3.25Å; V446-R450 PolarHBondContact O-N 3.45Å; Y447-R450 PolarHBondContact O-N 3.19Å; R450-R452 PolarHBondContact O-N 2.92Å; R450-K453 PolarHBondContact O-N 3.27Å
451	G	40.9	Very low	50	Low	68 Å²	68	137.5 Å²	137.5	70%	0.701	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-16.2	175.1	0	0	0	0	0	115	Y447 F449	Y447-G451 PolarHBondContact O-N 3.47Å; F449-G451 VanDerWaalsContact C-N 3.29Å
452	R	34.8	Very low	47	Very low	220 Å²	220	138.1 Å²	138.1	83%	0.83	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	2.9	179.2	-88.8	-174.5	-179.9	167.2	1.7	115.6	F449 R450 A454	F449-R452 PolarHBondContact O-N 2.94Å; R450-R452 PolarHBondContact O-N 2.92Å; R452-A454 PolarHBondContact O-N 2.03Å
453	K	31	Very low	44.1	Very low	190 Å²	190	141.5 Å²	141.5	83%	0.826	72%	0.723	S	S	*	*	S	Bend	trans	-99.1	89.3	178	-129.1	173.8	-174.9	177.1	0	111.9	R450	R450-K453 PolarHBondContact O-N 3.27Å
454	A	34.4	Very low	41	Very low	95 Å²	95	145.7 Å²	145.7	79%	0.785	73%	0.733	S	S	*	*			trans	33.5	97.6	150.9	0	0	0	0	0	117.3	R452	R452-A454 PolarHBondContact O-N 2.03Å
455	R	28.4	Very low	38.7	Very low	241 Å²	241	147.3 Å²	147.3	91%	0.909	75%	0.746	S	S	*	*			trans	-122.5	96.7	154	-153.3	167.5	-171.1	169.1	0.6	109.3
456	K	25.8	Very low	36.4	Very low	183 Å²	183	147.7 Å²	147.7	80%	0.796	75%	0.754	S	S	*	*			trans	-55.5	137.3	161.6	-79.3	177.6	168.9	-178.7	0	109.6
457	D	28.5	Very low	33.9	Very low	150 Å²	150	147.5 Å²	147.5	80%	0.802	77%	0.767	S	S	*	*			trans	21.9	102.6	144.4	-53.8	-32.1	0	0	0	115.9
458	K	27.8	Very low	32	Very low	198 Å²	198	146.4 Å²	146.4	86%	0.861	77%	0.773	S	S	*	*			trans	-137	114.3	145.2	-75.9	-159.7	176.1	-172.6	0	109.9
459	D	24.9	Very low	30.2	Very low	158 Å²	158	150.6 Å²	150.6	85%	0.845	79%	0.788	S	S	*	*			trans	-21.1	140.8	168.4	-64.2	-53.9	0	0	0	118.2
460	C	24.2	Very low	28.6	Very low	129 Å²	129	150.4 Å²	150.4	87%	0.872	80%	0.802	S	S	*	*			trans	-46.6	131	162.4	-50.9	0	0	0	0	112.6
461	A	23.6	Very low	27.7	Very low	87 Å²	87	144 Å²	144	72%	0.719	80%	0.797	S	S	*	*			trans	-142.8	119.5	148.9	0	0	0	0	0	108.6	V463	A461-V463 PolarHBondContact O-N 3.28Å
462	P	25.9	Very low	26.9	Very low	114 Å²	114	148.3 Å²	148.3	74%	0.74	80%	0.803	S	S	*	*			trans	-76.1	120.5	-179.8	29.3	-30.3	0	0	0	109.8	Y464	P462-Y464 PolarHBondContact O-N 3.37Å
463	V	24.5	Very low	26.6	Very low	127 Å²	127	142.1 Å²	142.1	77%	0.77	80%	0.8	S	S	*	*			trans	-81.2	107.7	173.2	-177.5	0	0	0	0	107.9	A461 V465	A461-V463 PolarHBondContact O-N 3.28Å; V463-V465 HydrophobicContact CG1-CG2 3.81Å; V463-V465 PolarHBondContact O-N 2.92Å
464	Y	22.6	Very low	26.5	Very low	202 Å²	202	141.4 Å²	141.4	79%	0.792	80%	0.804	S	S	*	*			trans	-65.6	118.1	160.6	-85.1	-98.1	0	0	0	108.4	P462	P462-Y464 PolarHBondContact O-N 3.37Å
465	V	30	Very low	26	Very low	131 Å²	131	146.4 Å²	146.4	79%	0.794	81%	0.808	S	S	*	*			trans	-116	101.2	159.3	-173.6	0	0	0	0	106.9	V463	V463-V465 HydrophobicContact CG1-CG2 3.81Å; V463-V465 PolarHBondContact O-N 2.92Å
466	N	28.7	Very low	26	Very low	139 Å²	139	142.1 Å²	142.1	74%	0.743	80%	0.803	S	S	*	*			trans	-56.7	147.5	168.1	-77.5	-31	0	0	0	110.1
467	G	26.2	Very low	26.1	Very low	64 Å²	64	141 Å²	141	66%	0.66	81%	0.806	S	S	*	*			trans	-47	137.1	-171	0	0	0	0	0	114.8
468	N	24.8	Very low	26	Very low	164 Å²	164	142 Å²	142	88%	0.877	81%	0.81	S	S	*	*				-161.2	109.9	126.8	-88.5	-26.5	0	0	0	106.9	C470	N468-C470 PolarHBondContact O-N 3.3Å; N468-C470 VanDerWaalsContact O-N 3.13Å
469	L	25.6	Very low	26	Very low	180 Å²	180	139.2 Å²	139.2	94%	0.942	81%	0.805	S	S	*	*			trans	-55.7	113.4	168.8	-143.4	81.2	0	0	0	107	G471	L469-G471 PolarHBondContact O-N 2.79Å
470	C	24.8	Very low	26.3	Very low	124 Å²	124	139.7 Å²	139.7	84%	0.838	80%	0.802	S	S	*	*			trans	-77.1	71.9	179.2	-156.2	0	0	0	0	109.3	N468 N472	N468-C470 PolarHBondContact O-N 3.3Å; N468-C470 VanDerWaalsContact O-N 3.13Å; C470-N472 PolarHBondContact O-N 3.47Å
471	G	24.1	Very low	26.8	Very low	61 Å²	61	140.6 Å²	140.6	63%	0.629	79%	0.793	S	S	*	*			trans	-81.9	87.8	158.8	0	0	0	0	0	107.9	L469	L469-G471 PolarHBondContact O-N 2.79Å
472	N	25.4	Very low	27.3	Very low	157 Å²	157	143.6 Å²	143.6	84%	0.84	80%	0.796	S	S	*	*			trans	-171.2	63.5	166.3	-90.8	-23.3	0	0	0	110.4	C470	C470-N472 PolarHBondContact O-N 3.47Å
473	A	28	Very low	27.8	Very low	91 Å²	91	145.1 Å²	145.1	75%	0.752	79%	0.794	S	S	*	*	S	Bend	trans	-158.6	52.8	167.7	0	0	0	0	0	112.4
474	L	27.6	Very low	28.2	Very low	175 Å²	175	144.7 Å²	144.7	92%	0.916	78%	0.783	S	S	*	*			trans	-169	57.5	153.6	-132.2	74	0	0	0	111.7
475	K	25	Very low	28.8	Very low	200 Å²	200	141.2 Å²	141.2	87%	0.87	77%	0.774	S	S	*	*			trans	-113.9	89.3	160.6	-109.4	-177.7	178.7	175.2	0	105.5
476	N	27.3	Very low	29.2	Very low	150 Å²	150	140.4 Å²	140.4	80%	0.802	77%	0.769	S	S	*	*	S	Bend	trans	174.5	143.9	151.8	-83	-16.1	0	0	0	108.1
477	D	28	Very low	29.7	Very low	161 Å²	161	137.4 Å²	137.4	86%	0.861	76%	0.755	S	S	*	*			trans	82.7	46.5	177.9	-55.4	-19.4	0	0	0	116.5	N479	D477-N479 VanDerWaalsContact C-N 3.31Å; D477-N479 PolarHBondContact O-N 2.85Å
478	L	27	Very low	30.5	Very low	170 Å²	170	138.9 Å²	138.9	89%	0.89	75%	0.747	S	S	*	*			trans	-81.5	77.9	148	-165	83.2	0	0	0	108.9
479	N	28.8	Very low	31.3	Very low	140 Å²	140	135.9 Å²	135.9	75%	0.749	73%	0.73	S	S	*	*			trans	178.3	93.7	159.3	-95.3	-20.2	0	0	0	107.8	D477	D477-N479 VanDerWaalsContact C-N 3.31Å; D477-N479 PolarHBondContact O-N 2.85Å
480	H	30.6	Very low	32.1	Very low	168 Å²	168	130.8 Å²	130.8	78%	0.778	71%	0.706	S	S	*	*	S	Bend	trans	161.4	125.6	143.5	-85.6	-53.7	0	0	0	111.6
481	H	34.2	Very low	33.2	Very low	148 Å²	148	128.9 Å²	128.9	69%	0.685	69%	0.69	S	S	*	*			trans	70.5	92.2	156.5	-57.9	-57.9	0	0	0	119.7	H483	H481-H483 PolarHBondContact O-N 3.21Å
482	N	34.1	Very low	34.2	Very low	149 Å²	149	129 Å²	129	80%	0.797	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	37.1	174.9	-70.3	-21.2	0	0	0	117
483	H	36.1	Very low	35.2	Very low	147 Å²	147	125.5 Å²	125.5	68%	0.681	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.2	-3.8	169	-90.5	-82.7	0	0	0	113.8	H481	H481-H483 PolarHBondContact O-N 3.21Å
484	H	34.5	Very low	36	Very low	118 Å²	118	126.6 Å²	126.6	55%	0.546	65%	0.65	S	S	.	*	S	Bend	trans	-97.2	-4.6	-175.7	-79.1	-83	0	0	0	115.5	V486 V487 I488	H484-V486 PolarHBondContact O-N 3.06Å; H484-V487 PolarHBondContact O-N 3.3Å; H484-I488 HydrophobicContact CB-CD1 4.08Å; H484-I488 HydrophobicContact CB-CG1 4.48Å; H484-I488 WeakPolarHBondContact O-CB 3.45Å; H484-I488 WeakPolarHBondContact O-CD1 3.28Å; H484-I488 WeakPolarHBondContact O-CG1 3.41Å; H484-I488 PolarHBondContact O-N 3.18Å
485	Q	34.2	Very low	36.8	Very low	129 Å²	129	120.8 Å²	120.8	60%	0.603	62%	0.624	S	S	*	*	H	α-helix	trans	-69.1	-37.7	-176.5	-77.9	-169.8	-9.6	0	0	114.4	I488 I489	Q485-I488 PolarHBondContact O-N 3.18Å; Q485-I489 WeakPolarHBondContact O-CG1 3.44Å; Q485-I489 PolarHBondContact O-N 3.41Å
486	V	38.7	Very low	37.7	Very low	113 Å²	113	113.9 Å²	113.9	69%	0.685	60%	0.598	S	S	*	*	H	α-helix	trans	-71.4	-37.8	177.5	-176.7	0	0	0	0	110.8	H484 I488 I489 V490	H484-V486 PolarHBondContact O-N 3.06Å; V486-I488 VanDerWaalsContact C-N 3.34Å; V486-I489 PolarHBondContact O-N 2.66Å; V486-V490 WeakPolarHBondContact O-CG2 3.17Å; V486-V490 PolarHBondContact O-N 2.92Å; V486-V490 VanDerWaalsContact O-N 3.08Å
487	V	39.9	Very low	38.5	Very low	76 Å²	76	110.8 Å²	110.8	46%	0.461	58%	0.581	S	S	.	*	H	α-helix	trans	-67.1	-38.3	174.4	-178.5	0	0	0	0	110.3	H484 I489 V490 V491	H484-V487 PolarHBondContact O-N 3.3Å; V487-I489 PolarHBondContact O-N 3.02Å; V487-V490 PolarHBondContact O-N 2.71Å; V487-V491 HydrophobicContact CG1-CG2 3.7Å; V487-V491 WeakPolarHBondContact O-CB 3.48Å; V487-V491 WeakPolarHBondContact O-CG2 3.42Å; V487-V491 PolarHBondContact O-N 3.11Å
488	I	42.1	Very low	39.2	Very low	95 Å²	95	111.4 Å²	111.4	49%	0.487	58%	0.579	S	S	.	*	H	α-helix	trans	-64.9	-39.6	175.3	-70	163.2	0	0	0	110.5	H484 Q485 V486 V490 V491 V492	H484-I488 HydrophobicContact CB-CD1 4.08Å; H484-I488 HydrophobicContact CB-CG1 4.48Å; H484-I488 WeakPolarHBondContact O-CB 3.45Å; H484-I488 WeakPolarHBondContact O-CD1 3.28Å; H484-I488 WeakPolarHBondContact O-CG1 3.41Å; H484-I488 PolarHBondContact O-N 3.18Å; Q485-I488 PolarHBondContact O-N 3.18Å; V486-I488 VanDerWaalsContact C-N 3.34Å; I488-V490 PolarHBondContact O-N 3.25Å; I488-V491 PolarHBondContact O-N 2.89Å; I488-V492 HydrophobicContact CG2-CG2 3.74Å; I488-V492 WeakPolarHBondContact O-CA 3.4Å; I488-V492 WeakPolarHBondContact O-CB 3.33Å; I488-V492 WeakPolarHBondContact O-CG2 3.31Å; I488-V492 PolarHBondContact O-N 2.93Å
489	I	41.5	Very low	40	Very low	101 Å²	101	107.3 Å²	107.3	52%	0.518	56%	0.564	S	S	.	*	H	α-helix	trans	-63.4	-43.7	175.8	-67.4	167.9	0	0	0	111	Q485 V486 V487 M493	Q485-I489 WeakPolarHBondContact O-CG1 3.44Å; Q485-I489 PolarHBondContact O-N 3.41Å; V486-I489 PolarHBondContact O-N 2.66Å; V487-I489 PolarHBondContact O-N 3.02Å; I489-M493 WeakPolarHBondContact O-CB 3.44Å; I489-M493 WeakPolarHBondContact O-CG 2.95Å; I489-M493 PolarHBondContact O-N 3.02Å
490	V	42.4	Very low	40.4	Very low	74 Å²	74	107 Å²	107	45%	0.448	55%	0.554	S	S	.	*	H	α-helix	trans	-70.6	-40	178.9	178.3	0	0	0	0	111.8	V486 V487 I488 M493 M494	V486-V490 WeakPolarHBondContact O-CG2 3.17Å; V486-V490 PolarHBondContact O-N 2.92Å; V486-V490 VanDerWaalsContact O-N 3.08Å; V487-V490 PolarHBondContact O-N 2.71Å; I488-V490 PolarHBondContact O-N 3.25Å; V490-M493 WeakPolarHBondContact O-CB 3.22Å; V490-M493 PolarHBondContact O-N 2.67Å; V490-M494 HydrophobicContact CG1-CG 4.37Å; V490-M494 WeakPolarHBondContact O-CB 3.31Å; V490-M494 VanDerWaalsContact O-CG 3.24Å; V490-M494 WeakPolarHBondContact O-CG 3.2Å; V490-M494 PolarHBondContact O-N 3.17Å
491	V	47.4	Very low	40.7	Very low	83 Å²	83	106.5 Å²	106.5	50%	0.503	55%	0.552	S	S	.	*	H	α-helix	trans	-71.6	-36	177.9	172.2	0	0	0	0	110.7	V487 I488 M494 S495	V487-V491 HydrophobicContact CG1-CG2 3.7Å; V487-V491 WeakPolarHBondContact O-CB 3.48Å; V487-V491 WeakPolarHBondContact O-CG2 3.42Å; V487-V491 PolarHBondContact O-N 3.11Å; I488-V491 PolarHBondContact O-N 2.89Å; V491-M494 PolarHBondContact O-N 3.28Å; V491-S495 WeakPolarHBondContact O-CB 3.16Å; V491-S495 PolarHBondContact O-N 3.08Å; V491-S495 PolarHBondContact O-OG 3.11Å
492	V	46.7	Very low	40.8	Very low	65 Å²	65	108.4 Å²	108.4	39%	0.394	57%	0.566	S	S	.	*	H	α-helix	trans	-65.9	-42.3	169.8	172.9	0	0	0	0	109.2	I488 M494 S495 V496	I488-V492 HydrophobicContact CG2-CG2 3.74Å; I488-V492 WeakPolarHBondContact O-CA 3.4Å; I488-V492 WeakPolarHBondContact O-CB 3.33Å; I488-V492 WeakPolarHBondContact O-CG2 3.31Å; I488-V492 PolarHBondContact O-N 2.93Å; V492-M494 PolarHBondContact O-N 3.11Å; V492-S495 WeakPolarHBondContact CA-OG 3.26Å; V492-S495 PolarHBondContact O-N 3.39Å; V492-S495 PolarHBondContact O-OG 3.4Å; V492-V496 HydrophobicContact CG1-CG2 3.96Å; V492-V496 WeakPolarHBondContact O-CB 3.35Å; V492-V496 WeakPolarHBondContact O-CG2 3.45Å; V492-V496 PolarHBondContact O-N 3.3Å
493	M	45.3	Very low	40.8	Very low	83 Å²	83	105.4 Å²	105.4	41%	0.409	56%	0.562	S	S	.	*	H	α-helix	trans	-60	-45	173	-80.4	-150.9	-174	0	0	112.3	I489 V490 L497 I653	I489-M493 WeakPolarHBondContact O-CB 3.44Å; I489-M493 WeakPolarHBondContact O-CG 2.95Å; I489-M493 PolarHBondContact O-N 3.02Å; V490-M493 WeakPolarHBondContact O-CB 3.22Å; V490-M493 PolarHBondContact O-N 2.67Å; M493-L497 WeakPolarHBondContact O-CB 3.38Å; M493-L497 WeakPolarHBondContact O-CD1 3.47Å; M493-L497 WeakPolarHBondContact O-CG 3.46Å; M493-L497 PolarHBondContact O-N 3.48Å; M493-I653 HydrophobicContact CE-CD1 4.19Å; M493-I653 HydrophobicContact CG-CD1 4.29Å; M493-I653 HydrophobicContact SD-CD1 4.2Å
494	M	44.7	Very low	40.8	Very low	114 Å²	114	103.3 Å²	103.3	56%	0.562	56%	0.559	S	S	*	*	H	α-helix	trans	-72.5	-36.3	-179.8	-66.6	-64.3	170.8	0	0	112.7	V490 V491 V492 L497 E498	V490-M494 HydrophobicContact CG1-CG 4.37Å; V490-M494 WeakPolarHBondContact O-CB 3.31Å; V490-M494 VanDerWaalsContact O-CG 3.24Å; V490-M494 WeakPolarHBondContact O-CG 3.2Å; V490-M494 PolarHBondContact O-N 3.17Å; V491-M494 PolarHBondContact O-N 3.28Å; V492-M494 PolarHBondContact O-N 3.11Å; M494-L497 WeakPolarHBondContact O-CB 3.18Å; M494-L497 PolarHBondContact O-N 3.37Å; M494-L497 HydrophobicContact SD-CD1 3.9Å; M494-E498 PolarHBondContact O-N 3.39Å
495	S	44.9	Very low	40.6	Very low	53 Å²	53	103.2 Å²	103.2	37%	0.371	56%	0.562	S	S	.	*	H	α-helix	trans	-76	-31.4	176.1	58.2	0	0	0	0	112.4	V491 V492 L497 E498 S499	V491-S495 WeakPolarHBondContact O-CB 3.16Å; V491-S495 PolarHBondContact O-N 3.08Å; V491-S495 PolarHBondContact O-OG 3.11Å; V492-S495 WeakPolarHBondContact CA-OG 3.26Å; V492-S495 PolarHBondContact O-N 3.39Å; V492-S495 PolarHBondContact O-OG 3.4Å; S495-L497 VanDerWaalsContact C-N 3.31Å; S495-E498 PolarHBondContact O-N 3.29Å; S495-S499 VanDerWaalsContact O-CB 3.23Å; S495-S499 WeakPolarHBondContact O-CB 3.4Å; S495-S499 PolarHBondContact O-N 2.94Å; S495-S499 PolarHBondContact O-OG 3.19Å
496	V	42.9	Very low	40.4	Very low	55 Å²	55	105 Å²	105	33%	0.333	58%	0.575	S	S	.	*	H	α-helix	trans	-66	-37.7	168	172	0	0	0	0	109.9	V492 E498 Y500	V492-V496 HydrophobicContact CG1-CG2 3.96Å; V492-V496 WeakPolarHBondContact O-CB 3.35Å; V492-V496 WeakPolarHBondContact O-CG2 3.45Å; V492-V496 PolarHBondContact O-N 3.3Å; V496-E498 PolarHBondContact O-N 3.1Å; V496-Y500 PolarHBondContact O-N 2.82Å; V496-Y500 VanDerWaalsContact O-N 3.17Å
497	L	45.6	Very low	39.9	Very low	85 Å²	85	104.9 Å²	104.9	45%	0.445	58%	0.577	S	S	.	*	H	α-helix	trans	-63.3	-36.4	172.6	-78.7	161.3	0	0	0	113	M493 M494 S495 H657	M493-L497 WeakPolarHBondContact O-CB 3.38Å; M493-L497 WeakPolarHBondContact O-CD1 3.47Å; M493-L497 WeakPolarHBondContact O-CG 3.46Å; M493-L497 PolarHBondContact O-N 3.48Å; M494-L497 WeakPolarHBondContact O-CB 3.18Å; M494-L497 PolarHBondContact O-N 3.37Å; M494-L497 HydrophobicContact SD-CD1 3.9Å; S495-L497 VanDerWaalsContact C-N 3.31Å; L497-H657 WeakPolarHBondContact CD2-NE2 3.3Å
498	E	42.6	Very low	39.2	Very low	174 Å²	174	113 Å²	113	81%	0.813	60%	0.599	S	S	*	*	H	α-helix	trans	-82.8	-31.9	178	-77	-176.7	167.5	0	0	113.7	M494 S495 V496	M494-E498 PolarHBondContact O-N 3.39Å; S495-E498 PolarHBondContact O-N 3.29Å; V496-E498 PolarHBondContact O-N 3.1Å
499	S	42.5	Very low	38.5	Very low	84 Å²	84	113.1 Å²	113.1	59%	0.587	61%	0.608	S	S	*	*	H	α-helix	trans	-87.7	-12.1	-175.6	59	0	0	0	0	114.5	S495 E501	S495-S499 VanDerWaalsContact O-CB 3.23Å; S495-S499 WeakPolarHBondContact O-CB 3.4Å; S495-S499 PolarHBondContact O-N 2.94Å; S495-S499 PolarHBondContact O-OG 3.19Å; S499-E501 PolarHBondContact O-N 3.23Å
500	Y	36.7	Very low	37.8	Very low	134 Å²	134	114.4 Å²	114.4	53%	0.525	62%	0.623	S	S	.	*	S	Bend	trans	-76.4	75.3	168.9	-125.7	-92.9	0	0	0	109.6	V496 L502 L505	V496-Y500 PolarHBondContact O-N 2.82Å; V496-Y500 VanDerWaalsContact O-N 3.17Å; Y500-L502 PolarHBondContact O-N 2.85Å; Y500-L505 HydrophobicContact CE1-CD1 3.59Å; Y500-L505 HydrophobicContact CE1-CG 4.02Å
501	E	37.9	Very low	37	Very low	157 Å²	157	114.3 Å²	114.3	73%	0.734	64%	0.637	S	S	*	*			trans	-47.2	131.9	167	-77.8	-174.4	150.8	0	0	109.3	S499 A503	S499-E501 PolarHBondContact O-N 3.23Å; E501-A503 PolarHBondContact O-N 2.7Å
502	L	36.5	Very low	36.1	Very low	188 Å²	188	117 Å²	117	98%	0.984	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51	7.5	-174	-138.2	81.8	0	0	0	116.8	Y500	Y500-L502 PolarHBondContact O-N 2.85Å
503	A	34.7	Very low	35.1	Very low	85 Å²	85	117.3 Å²	117.3	70%	0.702	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	-11.3	-157.8	0	0	0	0	0	116.4	E501	E501-A503 PolarHBondContact O-N 2.7Å
504	T	34.6	Very low	34.2	Very low	103 Å²	103	124 Å²	124	63%	0.632	70%	0.697	S	S	*	*	S	Bend	trans	-113.5	-4.2	-165.4	46.5	0	0	0	0	118.2
505	L	31.6	Very low	33.4	Very low	117 Å²	117	122.7 Å²	122.7	61%	0.613	70%	0.699	S	S	*	*			trans	-126.6	46.6	-178.4	-66.6	177.9	0	0	0	114.8	Y500 P507	Y500-L505 HydrophobicContact CE1-CD1 3.59Å; Y500-L505 HydrophobicContact CE1-CG 4.02Å; L505-P507 VanDerWaalsContact O-CD 3.29Å; L505-P507 WeakPolarHBondContact O-CD 3.29Å
506	L	28.2	Very low	32.8	Very low	165 Å²	165	126.2 Å²	126.2	86%	0.864	72%	0.724	S	S	*	*			trans	-86.6	106.7	146.5	-74.2	173.9	0	0	0	106.7	R508	L506-R508 PolarHBondContact O-N 3.33Å
507	P	29.4	Very low	32.5	Very low	112 Å²	112	126.8 Å²	126.8	73%	0.727	73%	0.73	S	S	*	*			trans	-58.3	115.6	167.9	-12.4	26.9	0	0	0	106.3	L505 S509	L505-P507 VanDerWaalsContact O-CD 3.29Å; L505-P507 WeakPolarHBondContact O-CD 3.29Å; P507-S509 PolarHBondContact O-N 3.04Å
508	R	25.2	Very low	32.7	Very low	247 Å²	247	128.2 Å²	128.2	93%	0.932	74%	0.742	S	S	*	*			trans	-66.1	80.5	156.6	-78.2	-179.3	175.4	158.3	-1.2	106.5	L506	L506-R508 PolarHBondContact O-N 3.33Å
509	S	27.6	Very low	33.5	Very low	96 Å²	96	125.6 Å²	125.6	67%	0.671	73%	0.734	S	S	*	*			trans	-70.6	135.2	149.4	56.5	0	0	0	0	107	P507 G511	P507-S509 PolarHBondContact O-N 3.04Å; S509-G511 PolarHBondContact O-N 2.75Å
510	P	27.3	Very low	34.8	Very low	128 Å²	128	128.2 Å²	128.2	83%	0.831	74%	0.741	S	S	*	*			trans	-72.7	116.3	-174.1	28.6	-33.1	0	0	0	110
511	G	25.4	Very low	36.9	Very low	72 Å²	72	122.6 Å²	122.6	74%	0.742	72%	0.72	S	S	*	*			trans	56.2	82.6	150.2	0	0	0	0	0	117.8	S509	S509-G511 PolarHBondContact O-N 2.75Å
512	T	27.6	Very low	39.4	Very low	140 Å²	140	118.3 Å²	118.3	86%	0.859	71%	0.706	S	S	*	*			trans	-135.3	125.5	138.6	52.2	0	0	0	0	107.7
513	G	25.3	Very low	41.9	Very low	71 Å²	71	113.1 Å²	113.1	73%	0.732	68%	0.677	S	S	*	*			trans	-57.3	148.3	-176.4	0	0	0	0	0	111.8	S515	G513-S515 PolarHBondContact O-N 2.96Å
514	F	26.4	Very low	44.6	Very low	225 Å²	225	109.6 Å²	109.6	99%	0.987	65%	0.646	S	S	*	*			trans	-56.5	84.5	166.5	-113.8	-101.4	0	0	0	109
515	S	27.6	Very low	47.2	Very low	85 Å²	85	107.4 Å²	107.4	59%	0.594	63%	0.634	S	S	*	*			trans	-88.2	122.6	167.6	-177.8	0	0	0	0	106.9	G513 S517	G513-S515 PolarHBondContact O-N 2.96Å; S515-S517 PolarHBondContact O-N 2.81Å
516	S	32.6	Very low	49.8	Very low	127 Å²	127	103.8 Å²	103.8	89%	0.888	62%	0.618	S	S	*	*			trans	-69.2	23.7	-177.3	55.1	0	0	0	0	114.5
517	S	38.4	Very low	52.6	Low	68 Å²	68	101 Å²	101	48%	0.476	61%	0.611	S	S	.	*	S	Bend	trans	-80.6	119.6	168.7	51.6	0	0	0	0	108	S515 N519	S515-S517 PolarHBondContact O-N 2.81Å; S517-N519 PolarHBondContact O-N 3.06Å
518	V	49.7	Very low	55.5	Low	115 Å²	115	98.3 Å²	98.3	70%	0.697	59%	0.591	S	S	*	*			trans	-43.2	113.4	162.1	178.6	0	0	0	0	106.5	L520	V518-L520 HydrophobicContact CG1-CD1 4.38Å; V518-L520 PolarHBondContact O-N 2.8Å
519	N	59	Low	58.7	Low	118 Å²	118	87.1 Å²	87.1	63%	0.631	55%	0.549	S	S	*	.			trans	-67.9	85.3	-178.7	-75.2	-31.6	0	0	0	107.2	S517 S585	S517-N519 PolarHBondContact O-N 3.06Å; N519-S585 PolarHBondContact O-OG 2.74Å; N519-S585 VanDerWaalsContact O-OG 3.04Å
520	L	69.1	Low	61.7	Low	140 Å²	140	87.4 Å²	87.4	73%	0.733	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-57.3	132.5	166.8	-116.7	78.7	0	0	0	106.2	V518	V518-L520 HydrophobicContact CG1-CD1 4.38Å; V518-L520 PolarHBondContact O-N 2.8Å
521	P	82	Confident	64.7	Low	15 Å²	15	85.2 Å²	85.2	10%	0.097	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-59.5	149	174.8	18.7	-22.6	0	0	0	109.7	E523 V581 M595 V598	P521-E523 PolarHBondContact O-N 3.37Å; P521-V581 HydrophobicContact CG-CG1 3.48Å; P521-V581 VanDerWaalsContact CG-CG1 3.48Å; P521-M595 HydrophobicContact CB-SD 4.15Å; P521-M595 HydrophobicContact CG-SD 4.21Å; P521-V598 HydrophobicContact CB-CG1 4.14Å; P521-V598 HydrophobicContact CB-CG2 4.26Å; P521-V598 HydrophobicContact CG-CB 4.35Å; P521-V598 HydrophobicContact CG-CG1 3.61Å; P521-V598 HydrophobicContact CG-CG2 3.83Å
522	P	88.8	Confident	67.7	Low	68 Å²	68	85 Å²	85	44%	0.442	50%	0.502	S	S	.	.	P	Polyproline II helix	trans	-54	132.6	177.7	-24.7	33.4	0	0	0	111.4	I524 G597 V598	P522-I524 PolarHBondContact O-N 3.24Å; P522-G597 CarbonylContact O-C 3.58Å; P522-G597 WeakPolarHBondContact O-CA 3.39Å; P522-V598 PolarHBondContact O-N 3.15Å
523	E	90.2	Very high	70.5	Confident	78 Å²	78	82.9 Å²	82.9	36%	0.364	48%	0.482	S	S	.	.	B	Isolated β-bridge	trans	-75.1	120.2	170.4	177.1	67.1	-162.4	0	0	109	P521 V598 T600 S601	P521-E523 PolarHBondContact O-N 3.37Å; E523-V598 CarbonylContact C-O 3.54Å; E523-V598 VanDerWaalsContact CA-O 3.27Å; E523-V598 WeakPolarHBondContact CA-O 3.48Å; E523-T600 VanDerWaalsContact CD-N 3.31Å; E523-T600 PolarHBondContact OE1-N 2.73Å; E523-T600 PolarHBondContact OE1-OG1 3.2Å; E523-T600 VanDerWaalsContact OE1-OG1 3.11Å; E523-T600 WeakPolarHBondContact OE2-CB 2.96Å; E523-T600 WeakPolarHBondContact OE2-CG2 3.36Å; E523-T600 PolarHBondContact OE2-N 3.46Å; E523-T600 PolarHBondContact OE2-OG1 3.49Å; E523-S601 WeakPolarHBondContact OE1-CB 3.15Å; E523-S601 PolarHBondContact OE1-N 3.27Å; E523-S601 PolarHBondContact OE1-OG 3.23Å
524	I	91.5	Very high	73.4	Confident	11 Å²	11	83.6 Å²	83.6	6%	0.056	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-103.6	119.2	178.4	-64.1	176.4	0	0	0	107.7	P522 S526 I529 L548 V598 S599 I608	P522-I524 PolarHBondContact O-N 3.24Å; I524-S526 PolarHBondContact O-N 3.45Å; I524-I529 HydrophobicContact CG2-CD1 3.9Å; I524-I529 HydrophobicContact CG2-CG1 3.8Å; I524-L548 HydrophobicContact CD1-CD1 4.42Å; I524-L548 HydrophobicContact CD1-CD2 3.98Å; I524-L548 HydrophobicContact CG2-CD1 3.47Å; I524-L548 VanDerWaalsContact CG2-CD1 3.47Å; I524-V598 PolarHBondContact N-O 3.13Å; I524-S599 VanDerWaalsContact O-CB 3.26Å; I524-S599 WeakPolarHBondContact O-CB 3.28Å; I524-S599 PolarHBondContact O-OG 3.18Å; I524-I608 HydrophobicContact CB-CD1 4.44Å; I524-I608 HydrophobicContact CD1-CB 4.1Å; I524-I608 HydrophobicContact CD1-CD1 4.23Å; I524-I608 HydrophobicContact CD1-CG1 4.22Å; I524-I608 HydrophobicContact CD1-CG2 4.32Å
525	P	88.8	Confident	76.2	Confident	57 Å²	57	76.8 Å²	76.8	37%	0.37	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-57.7	131.7	176.7	-24.4	34	0	0	0	111.4	C527 N528	P525-C527 PolarHBondContact O-N 2.88Å; P525-N528 WeakPolarHBondContact O-CB 3.15Å; P525-N528 PolarHBondContact O-N 3.24Å
526	S	86.2	Confident	78.9	Confident	42 Å²	42	74 Å²	74	29%	0.294	43%	0.427	S	S	.	.	G	3₁₀ helix	trans	-55.9	-27.3	178.2	-71.3	0	0	0	0	113.9	I524 N528 I529 S599 S601	I524-S526 PolarHBondContact O-N 3.45Å; S526-N528 PolarHBondContact O-N 2.47Å; S526-I529 PolarHBondContact O-N 3.11Å; S526-S599 PolarHBondContact OG-OG 3.37Å; S526-S601 WeakPolarHBondContact CB-O 3.44Å; S526-S601 PolarHBondContact OG-O 2.81Å
527	C	85.9	Confident	81.2	Confident	106 Å²	106	73.6 Å²	73.6	72%	0.716	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-67.6	-18.9	176.7	59.5	0	0	0	0	114	P525 I529	P525-C527 PolarHBondContact O-N 2.88Å; C527-I529 VanDerWaalsContact C-N 3.34Å
528	N	90.7	Very high	82.9	Confident	55 Å²	55	71.6 Å²	71.6	29%	0.294	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-88.7	-7.1	176.9	-69.1	18.3	0	0	0	112.1	P525 S526 L548 L549	P525-N528 WeakPolarHBondContact O-CB 3.15Å; P525-N528 PolarHBondContact O-N 3.24Å; S526-N528 PolarHBondContact O-N 2.47Å; N528-L548 HydrophobicContact CB-CD1 4.27Å; N528-L549 HydrophobicContact CB-CB 4.44Å; N528-L549 PolarHBondContact ND2-O 2.98Å; N528-L549 PolarHBondContact O-N 3.03Å
529	I	92.3	Very high	84.3	Confident	12 Å²	12	73.6 Å²	73.6	6%	0.062	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	109.7	-178.2	-54.3	171.5	0	0	0	108.4	I524 S526 C527 F531 L548 V562 I608	I524-I529 HydrophobicContact CG2-CD1 3.9Å; I524-I529 HydrophobicContact CG2-CG1 3.8Å; S526-I529 PolarHBondContact O-N 3.11Å; C527-I529 VanDerWaalsContact C-N 3.34Å; I529-F531 HydrophobicContact CG2-CD2 4.38Å; I529-F531 HydrophobicContact CG2-CE2 3.99Å; I529-F531 HydrophobicContact CG2-CZ 4.12Å; I529-L548 HydrophobicContact CG1-CD1 4.11Å; I529-V562 HydrophobicContact CG2-CG1 4.43Å; I529-V562 HydrophobicContact CG2-CG2 3.86Å; I529-I608 HydrophobicContact CD1-CD1 3.82Å; I529-I608 HydrophobicContact CD1-CG1 3.84Å
530	H	90.1	Very high	85.5	Confident	102 Å²	102	69 Å²	69	47%	0.472	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	114.4	173.9	-179.8	-114.3	0	0	0	109.7	G546 E547	H530-G546 CarbonylContact O-C 3.59Å; H530-G546 WeakPolarHBondContact O-CA 3.45Å; H530-E547 HydrophobicContact CB-CB 4.22Å; H530-E547 IonicContact CE1-OE2 3.19Å; H530-E547 PolarHBondContact N-O 3.31Å; H530-E547 IonicContact ND1-OE2 2.98Å; H530-E547 PolarHBondContact ND1-OE2 3.49Å; H530-E547 PolarHBondContact O-N 3.45Å
531	F	90.4	Very high	86.3	Confident	82 Å²	82	62.4 Å²	62.4	36%	0.36	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	124.7	178.9	-67.2	-94.2	0	0	0	110.2	I529 W544 V562 T564	I529-F531 HydrophobicContact CG2-CD2 4.38Å; I529-F531 HydrophobicContact CG2-CE2 3.99Å; I529-F531 HydrophobicContact CG2-CZ 4.12Å; F531-W544 HydrophobicContact CB-CE3 4.12Å; F531-W544 HydrophobicContact CD1-CB 3.75Å; F531-W544 AromaticContact CD1-CD2 3.76Å; F531-W544 HydrophobicContact CD1-CD2 3.76Å; F531-W544 HydrophobicContact CD1-CE3 4.13Å; F531-W544 AromaticContact CD1-CG 3.6Å; F531-W544 HydrophobicContact CD1-CG 3.6Å; F531-W544 HydrophobicContact CE1-CB 4.29Å; F531-W544 HydrophobicContact CE1-CD2 4.48Å; F531-W544 HydrophobicContact CE1-CG 4.05Å; F531-V562 HydrophobicContact CE1-CB 4.01Å; F531-V562 HydrophobicContact CE1-CG1 3.58Å; F531-V562 HydrophobicContact CZ-CG1 3.95Å; F531-T564 HydrophobicContact CE1-CG2 3.91Å; F531-T564 HydrophobicContact CZ-CG2 4.32Å
532	V	89.3	Confident	86.6	Confident	68 Å²	68	65.3 Å²	65.3	41%	0.412	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	-62.3	-176.1	178.9	0	0	0	0	111.2	K545 E547	V532-K545 WeakPolarHBondContact CA-O 3.44Å; V532-K545 WeakPolarHBondContact CB-O 3.12Å; V532-K545 PolarHBondContact N-O 2.93Å; V532-E547 HydrophobicContact CG2-CG 3.96Å
533	E	86.1	Confident	86.7	Confident	96 Å²	96	63.5 Å²	63.5	45%	0.449	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	155.6	-177.5	61.3	-179.1	166.4	0	0	112	L535 W544 K545	E533-L535 PolarHBondContact O-N 3.11Å; E533-W544 CarbonylContact O-C 3.54Å; E533-W544 VanDerWaalsContact O-CA 3.25Å; E533-W544 WeakPolarHBondContact O-CA 3.5Å; E533-K545 HydrophobicContact CG-CB 3.74Å; E533-K545 HydrophobicContact CG-CD 4.05Å; E533-K545 PolarHBondContact N-O 2.97Å; E533-K545 PolarHBondContact O-N 3.09Å; E533-K545 VanDerWaalsContact OE1-CD 3.29Å; E533-K545 WeakPolarHBondContact OE1-CD 3.42Å; E533-K545 IonicContact OE1-NZ 3.8Å
534	I	86.9	Confident	86.8	Confident	86 Å²	86	63.1 Å²	63.1	44%	0.441	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	119.6	174.3	-59.4	175.9	0	0	0	108.6	K542 W544	I534-K542 HydrophobicContact CG2-CD 4.16Å; I534-W544 HydrophobicContact CB-CE3 4.44Å; I534-W544 HydrophobicContact CD1-CH2 3.58Å; I534-W544 HydrophobicContact CD1-CZ2 3.75Å; I534-W544 HydrophobicContact CD1-CZ3 4.02Å; I534-W544 HydrophobicContact CG1-CD2 3.72Å; I534-W544 HydrophobicContact CG1-CE3 3.49Å; I534-W544 VanDerWaalsContact CG1-CE3 3.49Å; I534-W544 HydrophobicContact CG1-CH2 3.39Å; I534-W544 HydrophobicContact CG1-CZ2 3.62Å; I534-W544 HydrophobicContact CG1-CZ3 3.33Å
535	L	84.2	Confident	86.9	Confident	82 Å²	82	64.5 Å²	64.5	43%	0.429	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	-33.3	174.3	-64.3	174.9	0	0	0	111.8	E533 V543 K545 F611	E533-L535 PolarHBondContact O-N 3.11Å; L535-V543 HydrophobicContact CB-CG1 4.33Å; L535-V543 HydrophobicContact CD1-CG1 4.39Å; L535-V543 PolarHBondContact N-O 2.86Å; L535-K545 HydrophobicContact CD1-CB 3.92Å; L535-K545 HydrophobicContact CD2-CB 3.94Å; L535-K545 HydrophobicContact CG-CB 3.86Å; L535-F611 HydrophobicContact CD1-CD2 4.2Å; L535-F611 HydrophobicContact CD1-CE2 3.76Å; L535-F611 HydrophobicContact CD2-CE2 4.32Å
536	G	84.6	Confident	87.2	Confident	27 Å²	27	61.8 Å²	61.8	28%	0.278	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	173.4	-166.2	-179.6	0	0	0	0	0	115.3	V543	G536-V543 PolarHBondContact N-O 3.3Å; G536-V543 VanDerWaalsContact N-O 3.14Å; G536-V543 PolarHBondContact O-N 3.38Å
537	D	81.9	Confident	87.5	Confident	118 Å²	118	63.3 Å²	63.3	63%	0.631	33%	0.33	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	120.9	174.4	-75	-64.4	0	0	0	109.6	K542	D537-K542 VanDerWaalsContact OD1-CD 3.24Å; D537-K542 WeakPolarHBondContact OD1-CD 3.46Å; D537-K542 WeakPolarHBondContact OD1-CE 3.47Å; D537-K542 IonicContact OD1-NZ 3.02Å; D537-K542 PolarHBondContact OD1-NZ 3.23Å; D537-K542 IonicContact OD2-NZ 2.66Å; D537-K542 PolarHBondContact OD2-NZ 3.05Å
538	G	72.8	Confident	87.9	Confident	25 Å²	25	58.4 Å²	58.4	26%	0.258	30%	0.297	S	S	.	.			trans	-93.4	173.7	172.4	0	0	0	0	0	111.9	F540 G541	G538-F540 PolarHBondContact O-N 3.32Å; G538-G541 WeakPolarHBondContact CA-O 3.26Å; G538-G541 PolarHBondContact N-O 3.16Å; G538-G541 PolarHBondContact O-N 2.83Å
539	H	80.3	Confident	87.8	Confident	158 Å²	158	59.7 Å²	59.7	73%	0.731	30%	0.303	S	S	*	.	S	Bend	trans	-57.5	-37.1	179.3	-177.8	-102	0	0	0	113
540	F	84.3	Confident	87.4	Confident	21 Å²	21	61.7 Å²	61.7	9%	0.092	33%	0.327	C	S	.	.	S	Bend	trans	-98.1	-20.6	-175.1	-61.4	-68.1	0	0	0	114.4	G538 T564 L565 K566 D576 F577 E580 M607	G538-F540 PolarHBondContact O-N 3.32Å; F540-T564 CarbonylContact C-O 3.51Å; F540-L565 HydrophobicContact CB-CD1 3.81Å; F540-L565 HydrophobicContact CD1-CD1 4.26Å; F540-L565 HydrophobicContact CG-CD1 4.41Å; F540-K566 WeakPolarHBondContact O-CG 3.31Å; F540-K566 PolarHBondContact O-N 2.89Å; F540-K566 VanDerWaalsContact O-N 3.13Å; F540-D576 HydrophobicContact CE1-CB 3.84Å; F540-D576 HydrophobicContact CZ-CB 4.47Å; F540-F577 HydrophobicContact CB-CD2 4Å; F540-F577 HydrophobicContact CD1-CB 3.95Å; F540-F577 HydrophobicContact CD1-CD2 4.31Å; F540-F577 AromaticContact CD2-CD2 3.87Å; F540-F577 HydrophobicContact CD2-CD2 3.87Å; F540-F577 HydrophobicContact CE1-CB 4.04Å; F540-F577 HydrophobicContact CE2-CD2 4.44Å; F540-F577 HydrophobicContact CG-CB 4.3Å; F540-F577 AromaticContact CG-CD2 3.79Å; F540-F577 HydrophobicContact CG-CD2 3.79Å; F540-F577 HydrophobicContact CZ-CB 4.45Å; F540-E580 HydrophobicContact CE2-CB 3.89Å; F540-E580 HydrophobicContact CE2-CG 3.99Å; F540-E580 HydrophobicContact CZ-CB 3.87Å; F540-E580 HydrophobicContact CZ-CG 4.32Å; F540-M607 HydrophobicContact CD2-CE 4.11Å; F540-M607 HydrophobicContact CE2-CE 4.25Å
541	G	85.6	Confident	86.8	Confident	1 Å²	1	61.9 Å²	61.9	1%	0.01	32%	0.324	C	S	.	.	S	Bend	trans	171.6	-138.9	-171	0	0	0	0	0	111.6	G538 T564	G538-G541 WeakPolarHBondContact CA-O 3.26Å; G538-G541 PolarHBondContact N-O 3.16Å; G538-G541 PolarHBondContact O-N 2.83Å; G541-T564 WeakPolarHBondContact CA-O 3.44Å; G541-T564 PolarHBondContact N-O 3.46Å
542	K	88.3	Confident	85.8	Confident	77 Å²	77	59.7 Å²	59.7	34%	0.335	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	146.5	-175.9	-69.2	-68.2	-174.2	-176.6	0	110.4	I534 D537 W544 T564	I534-K542 HydrophobicContact CG2-CD 4.16Å; D537-K542 VanDerWaalsContact OD1-CD 3.24Å; D537-K542 WeakPolarHBondContact OD1-CD 3.46Å; D537-K542 WeakPolarHBondContact OD1-CE 3.47Å; D537-K542 IonicContact OD1-NZ 3.02Å; D537-K542 PolarHBondContact OD1-NZ 3.23Å; D537-K542 IonicContact OD2-NZ 2.66Å; D537-K542 PolarHBondContact OD2-NZ 3.05Å; K542-W544 VanDerWaalsContact CB-NE1 3.27Å; K542-T564 PolarHBondContact N-OG1 3.19Å; K542-T564 PolarHBondContact O-N 3.11Å; K542-T564 PolarHBondContact O-OG1 3.31Å
543	V	91.4	Very high	85	Confident	30 Å²	30	64.3 Å²	64.3	18%	0.182	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	124.9	168.1	-172.6	0	0	0	0	107.6	L535 G536 V562 V563	L535-V543 HydrophobicContact CB-CG1 4.33Å; L535-V543 HydrophobicContact CD1-CG1 4.39Å; L535-V543 PolarHBondContact N-O 2.86Å; G536-V543 PolarHBondContact N-O 3.3Å; G536-V543 VanDerWaalsContact N-O 3.14Å; G536-V543 PolarHBondContact O-N 3.38Å; V543-V562 CarbonylContact C-O 3.54Å; V543-V562 WeakPolarHBondContact CA-O 3.35Å; V543-V563 HydrophobicContact CG1-CG2 4.23Å; V543-V563 HydrophobicContact CG2-CG1 4.48Å; V543-V563 HydrophobicContact CG2-CG2 4.2Å
544	W	92	Very high	84	Confident	70 Å²	70	65.9 Å²	65.9	27%	0.265	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	150	-179.3	-60.6	77.5	0	0	0	110.2	F531 E533 I534 K542 A561 V562	F531-W544 HydrophobicContact CB-CE3 4.12Å; F531-W544 HydrophobicContact CD1-CB 3.75Å; F531-W544 AromaticContact CD1-CD2 3.76Å; F531-W544 HydrophobicContact CD1-CD2 3.76Å; F531-W544 HydrophobicContact CD1-CE3 4.13Å; F531-W544 AromaticContact CD1-CG 3.6Å; F531-W544 HydrophobicContact CD1-CG 3.6Å; F531-W544 HydrophobicContact CE1-CB 4.29Å; F531-W544 HydrophobicContact CE1-CD2 4.48Å; F531-W544 HydrophobicContact CE1-CG 4.05Å; E533-W544 CarbonylContact O-C 3.54Å; E533-W544 VanDerWaalsContact O-CA 3.25Å; E533-W544 WeakPolarHBondContact O-CA 3.5Å; I534-W544 HydrophobicContact CB-CE3 4.44Å; I534-W544 HydrophobicContact CD1-CH2 3.58Å; I534-W544 HydrophobicContact CD1-CZ2 3.75Å; I534-W544 HydrophobicContact CD1-CZ3 4.02Å; I534-W544 HydrophobicContact CG1-CD2 3.72Å; I534-W544 HydrophobicContact CG1-CE3 3.49Å; I534-W544 VanDerWaalsContact CG1-CE3 3.49Å; I534-W544 HydrophobicContact CG1-CH2 3.39Å; I534-W544 HydrophobicContact CG1-CZ2 3.62Å; I534-W544 HydrophobicContact CG1-CZ3 3.33Å; K542-W544 VanDerWaalsContact CB-NE1 3.27Å; W544-A561 CarbonylContact O-C 3.51Å; W544-A561 WeakPolarHBondContact O-CA 3.27Å; W544-V562 HydrophobicContact CB-CB 4.28Å; W544-V562 PolarHBondContact N-O 3.24Å; W544-V562 PolarHBondContact O-N 3.45Å
545	K	93.8	Very high	83	Confident	40 Å²	40	68.6 Å²	68.6	17%	0.174	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	136.1	155.8	-174.2	179.4	177.6	-178.4	0	107.2	V532 E533 L535 F611	V532-K545 WeakPolarHBondContact CA-O 3.44Å; V532-K545 WeakPolarHBondContact CB-O 3.12Å; V532-K545 PolarHBondContact N-O 2.93Å; E533-K545 HydrophobicContact CG-CB 3.74Å; E533-K545 HydrophobicContact CG-CD 4.05Å; E533-K545 PolarHBondContact N-O 2.97Å; E533-K545 PolarHBondContact O-N 3.09Å; E533-K545 VanDerWaalsContact OE1-CD 3.29Å; E533-K545 WeakPolarHBondContact OE1-CD 3.42Å; E533-K545 IonicContact OE1-NZ 3.8Å; L535-K545 HydrophobicContact CD1-CB 3.92Å; L535-K545 HydrophobicContact CD2-CB 3.94Å; L535-K545 HydrophobicContact CG-CB 3.86Å; K545-F611 HydrophobicContact CD-CE1 4.41Å; K545-F611 HydrophobicContact CD-CE2 4.2Å; K545-F611 HydrophobicContact CD-CZ 4.01Å; K545-F611 HydrophobicContact CG-CD2 4.28Å; K545-F611 HydrophobicContact CG-CE2 4.1Å; K545-F611 HydrophobicContact CG-CZ 4.37Å
546	G	93.2	Very high	82.8	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	175	178	0	0	0	0	0	112.5	H530 V560	H530-G546 CarbonylContact O-C 3.59Å; H530-G546 WeakPolarHBondContact O-CA 3.45Å; G546-V560 PolarHBondContact N-O 2.78Å; G546-V560 PolarHBondContact O-N 3.29Å
547	E	94.1	Very high	82.9	Confident	74 Å²	74	72.2 Å²	72.2	35%	0.346	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.6	172.5	-71.4	169.7	164.5	0	0	108.3	H530 V532 A557 I558	H530-E547 HydrophobicContact CB-CB 4.22Å; H530-E547 IonicContact CE1-OE2 3.19Å; H530-E547 PolarHBondContact N-O 3.31Å; H530-E547 IonicContact ND1-OE2 2.98Å; H530-E547 PolarHBondContact ND1-OE2 3.49Å; H530-E547 PolarHBondContact O-N 3.45Å; V532-E547 HydrophobicContact CG2-CG 3.96Å; E547-A557 HydrophobicContact CB-CB 4.12Å; E547-I558 CarbonylContact C-O 3.54Å; E547-I558 WeakPolarHBondContact CA-O 3.44Å
548	L	93.4	Very high	83.3	Confident	3 Å²	3	69 Å²	69	2%	0.016	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	119.2	-179.5	178.2	63.7	0	0	0	110.2	I524 N528 I529 Y551 A557 I558 V560 L596 I608	I524-L548 HydrophobicContact CD1-CD1 4.42Å; I524-L548 HydrophobicContact CD1-CD2 3.98Å; I524-L548 HydrophobicContact CG2-CD1 3.47Å; I524-L548 VanDerWaalsContact CG2-CD1 3.47Å; N528-L548 HydrophobicContact CB-CD1 4.27Å; I529-L548 HydrophobicContact CG1-CD1 4.11Å; L548-Y551 HydrophobicContact CD2-CD2 3.55Å; L548-Y551 HydrophobicContact CD2-CE2 4.33Å; L548-Y551 HydrophobicContact CD2-CG 3.71Å; L548-Y551 HydrophobicContact CG-CG 4.47Å; L548-A557 WeakPolarHBondContact O-CA 3.42Å; L548-I558 HydrophobicContact CB-CG1 3.92Å; L548-I558 HydrophobicContact CD2-CD1 4.32Å; L548-I558 HydrophobicContact CD2-CG1 4.44Å; L548-I558 PolarHBondContact N-O 3.3Å; L548-I558 PolarHBondContact O-N 2.88Å; L548-V560 HydrophobicContact CB-CG1 3.71Å; L548-V560 HydrophobicContact CB-CG2 4.1Å; L548-V560 HydrophobicContact CD2-CG1 4.22Å; L548-L596 HydrophobicContact CD2-CD1 4.46Å; L548-I608 HydrophobicContact CD2-CG2 4.42Å
549	L	89.4	Confident	84.3	Confident	82 Å²	82	72 Å²	72	43%	0.429	37%	0.373	S	S	.	.			trans	-91.3	142.5	-178.3	-63.4	169.1	0	0	0	112.2	N528 Y551 A557	N528-L549 HydrophobicContact CB-CB 4.44Å; N528-L549 PolarHBondContact ND2-O 2.98Å; N528-L549 PolarHBondContact O-N 3.03Å; L549-Y551 VanDerWaalsContact C-N 3.27Å; L549-Y551 PolarHBondContact O-N 3.41Å; L549-A557 HydrophobicContact CD2-CB 3.62Å
550	G	82.5	Confident	85.1	Confident	54 Å²	54	64.5 Å²	64.5	56%	0.557	34%	0.338	S	S	*	.	S	Bend	trans	68.2	20.6	173.5	0	0	0	0	0	114.8
551	Y	77.7	Confident	85.6	Confident	105 Å²	105	64.3 Å²	64.3	41%	0.412	34%	0.341	S	S	.	.	S	Bend	trans	-84.9	-33.6	176.5	-171.4	-96.7	0	0	0	112.7	L548 L549 I558 L596	L548-Y551 HydrophobicContact CD2-CD2 3.55Å; L548-Y551 HydrophobicContact CD2-CE2 4.33Å; L548-Y551 HydrophobicContact CD2-CG 3.71Å; L548-Y551 HydrophobicContact CG-CG 4.47Å; L549-Y551 VanDerWaalsContact C-N 3.27Å; L549-Y551 PolarHBondContact O-N 3.41Å; Y551-I558 HydrophobicContact CD1-CD1 3.46Å; Y551-I558 VanDerWaalsContact CD1-CD1 3.46Å; Y551-I558 HydrophobicContact CE1-CD1 4.07Å; Y551-I558 HydrophobicContact CG-CD1 3.97Å; Y551-L596 HydrophobicContact CE1-CD2 4.34Å; Y551-L596 HydrophobicContact CE2-CB 4.17Å
552	S	70.9	Confident	86	Confident	37 Å²	37	64.3 Å²	64.3	26%	0.259	34%	0.34	S	S	.	.	S	Bend	trans	-100.6	160.3	174.9	73.9	0	0	0	0	110.3	D554 E556	S552-D554 PolarHBondContact O-N 2.91Å; S552-D554 PolarHBondContact OG-N 3.17Å; S552-E556 PolarHBondContact OG-O 2.88Å
553	N	70.8	Confident	86.3	Confident	165 Å²	165	61.6 Å²	61.6	88%	0.882	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-14.1	175.8	-69.6	-27.1	0	0	0	113.1	D555	N553-D555 VanDerWaalsContact C-N 3.29Å; N553-D555 PolarHBondContact O-N 3.4Å
554	D	65.6	Low	86.3	Confident	128 Å²	128	60.8 Å²	60.8	68%	0.684	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	9.2	-169.2	-62.3	-37.5	0	0	0	112.8	S552 E556	S552-D554 PolarHBondContact O-N 2.91Å; S552-D554 PolarHBondContact OG-N 3.17Å; D554-E556 PolarHBondContact O-N 3.22Å
555	D	66.6	Low	86.3	Confident	144 Å²	144	57.7 Å²	57.7	77%	0.77	31%	0.314	S	S	*	.			trans	54.9	3.6	-173.5	-77	-30.8	0	0	0	114.8	N553	N553-D555 VanDerWaalsContact C-N 3.29Å; N553-D555 PolarHBondContact O-N 3.4Å
556	E	79.1	Confident	86	Confident	142 Å²	142	61 Å²	61	66%	0.664	33%	0.328	S	S	*	.	P	Polyproline II helix	trans	-79.4	138.6	177.6	-69.7	-165.1	163.7	0	0	111.9	S552 D554	S552-E556 PolarHBondContact OG-O 2.88Å; D554-E556 PolarHBondContact O-N 3.22Å
557	A	86.4	Confident	85.4	Confident	43 Å²	43	68.8 Å²	68.8	36%	0.355	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-72.7	130.6	174.3	0	0	0	0	0	110.4	E547 L548 L549	E547-A557 HydrophobicContact CB-CB 4.12Å; L548-A557 WeakPolarHBondContact O-CA 3.42Å; L549-A557 HydrophobicContact CD2-CB 3.62Å
558	I	91.8	Very high	84.8	Confident	50 Å²	50	71.6 Å²	71.6	26%	0.256	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	147.8	175.1	64.2	165.6	0	0	0	111.2	E547 L548 Y551 V560 L596	E547-I558 CarbonylContact C-O 3.54Å; E547-I558 WeakPolarHBondContact CA-O 3.44Å; L548-I558 HydrophobicContact CB-CG1 3.92Å; L548-I558 HydrophobicContact CD2-CD1 4.32Å; L548-I558 HydrophobicContact CD2-CG1 4.44Å; L548-I558 PolarHBondContact N-O 3.3Å; L548-I558 PolarHBondContact O-N 2.88Å; Y551-I558 HydrophobicContact CD1-CD1 3.46Å; Y551-I558 VanDerWaalsContact CD1-CD1 3.46Å; Y551-I558 HydrophobicContact CE1-CD1 4.07Å; Y551-I558 HydrophobicContact CG-CD1 3.97Å; I558-V560 HydrophobicContact CD1-CG1 4.21Å; I558-V560 HydrophobicContact CG1-CG1 4.09Å; I558-L596 HydrophobicContact CD1-CD1 3.89Å
559	Q	93.7	Very high	84.4	Confident	89 Å²	89	71.9 Å²	71.9	42%	0.416	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	132.4	174.9	-68.7	-172.9	-11	0	0	110.9	F611	Q559-F611 HydrophobicContact CB-CB 3.86Å; Q559-F611 HydrophobicContact CB-CD1 4.02Å; Q559-F611 HydrophobicContact CB-CG 4.24Å; Q559-F611 WeakPolarHBondContact O-CB 3.34Å; Q559-F611 PolarHBondContact O-N 2.92Å; Q559-F611 VanDerWaalsContact OE1-CD1 3.32Å
560	V	95.7	Very high	84.3	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	154.6	-178.2	-63.6	0	0	0	0	111.8	G546 L548 I558 V562 L596 I608 F609	G546-V560 PolarHBondContact N-O 2.78Å; G546-V560 PolarHBondContact O-N 3.29Å; L548-V560 HydrophobicContact CB-CG1 3.71Å; L548-V560 HydrophobicContact CB-CG2 4.1Å; L548-V560 HydrophobicContact CD2-CG1 4.22Å; I558-V560 HydrophobicContact CD1-CG1 4.21Å; I558-V560 HydrophobicContact CG1-CG1 4.09Å; V560-V562 HydrophobicContact CG2-CG2 3.8Å; V560-L596 HydrophobicContact CG1-CD1 3.63Å; V560-I608 HydrophobicContact CB-CG2 3.75Å; V560-I608 HydrophobicContact CG1-CG2 3.86Å; V560-I608 HydrophobicContact CG2-CG2 4.02Å; V560-F609 CarbonylContact C-O 3.48Å; V560-F609 VanDerWaalsContact CA-O 3.29Å; V560-F609 WeakPolarHBondContact CA-O 3.5Å; V560-F609 WeakPolarHBondContact CB-O 3.46Å
561	A	95.7	Very high	84.5	Confident	17 Å²	17	75.1 Å²	75.1	14%	0.14	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	122.3	165.1	0	0	0	0	0	109.3	W544 F609	W544-A561 CarbonylContact O-C 3.51Å; W544-A561 WeakPolarHBondContact O-CA 3.27Å; A561-F609 HydrophobicContact CB-CB 4.35Å; A561-F609 PolarHBondContact N-O 3.01Å; A561-F609 PolarHBondContact O-N 2.8Å
562	V	94.5	Very high	85	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	112.6	-175.7	-171	0	0	0	0	109.7	I529 F531 V543 W544 V560 T564 A606 M607	I529-V562 HydrophobicContact CG2-CG1 4.43Å; I529-V562 HydrophobicContact CG2-CG2 3.86Å; F531-V562 HydrophobicContact CE1-CB 4.01Å; F531-V562 HydrophobicContact CE1-CG1 3.58Å; F531-V562 HydrophobicContact CZ-CG1 3.95Å; V543-V562 CarbonylContact C-O 3.54Å; V543-V562 WeakPolarHBondContact CA-O 3.35Å; W544-V562 HydrophobicContact CB-CB 4.28Å; W544-V562 PolarHBondContact N-O 3.24Å; W544-V562 PolarHBondContact O-N 3.45Å; V560-V562 HydrophobicContact CG2-CG2 3.8Å; V562-T564 HydrophobicContact CG1-CG2 4.22Å; V562-A606 HydrophobicContact CG1-CB 3.77Å; V562-M607 WeakPolarHBondContact CA-O 2.96Å
563	V	93.3	Very high	85.8	Confident	21 Å²	21	76.1 Å²	76.1	13%	0.127	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	110.3	178.7	-176.5	0	0	0	0	108.9	V543 A606 M607 F609	V543-V563 HydrophobicContact CG1-CG2 4.23Å; V543-V563 HydrophobicContact CG2-CG1 4.48Å; V543-V563 HydrophobicContact CG2-CG2 4.2Å; V563-A606 CarbonylContact O-C 3.56Å; V563-A606 VanDerWaalsContact O-CA 3.23Å; V563-A606 WeakPolarHBondContact O-CA 3.25Å; V563-M607 HydrophobicContact CB-CB 4.36Å; V563-M607 HydrophobicContact CB-CE 4.4Å; V563-M607 HydrophobicContact CG1-CE 4.12Å; V563-M607 PolarHBondContact N-O 3.4Å; V563-M607 PolarHBondContact O-N 2.8Å; V563-F609 HydrophobicContact CB-CE2 4.35Å; V563-F609 HydrophobicContact CG2-CD2 3.92Å; V563-F609 HydrophobicContact CG2-CE2 3.79Å
564	T	91.8	Very high	86.6	Confident	13 Å²	13	73.2 Å²	73.2	8%	0.08	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	152.3	-176.4	67.9	0	0	0	0	112.5	F531 F540 G541 K542 V562 A606	F531-T564 HydrophobicContact CE1-CG2 3.91Å; F531-T564 HydrophobicContact CZ-CG2 4.32Å; F540-T564 CarbonylContact C-O 3.51Å; G541-T564 WeakPolarHBondContact CA-O 3.44Å; G541-T564 PolarHBondContact N-O 3.46Å; K542-T564 PolarHBondContact N-OG1 3.19Å; K542-T564 PolarHBondContact O-N 3.11Å; K542-T564 PolarHBondContact O-OG1 3.31Å; V562-T564 HydrophobicContact CG1-CG2 4.22Å; T564-A606 HydrophobicContact CG2-CB 4.17Å
565	L	91.4	Very high	87.6	Confident	4 Å²	4	72.9 Å²	72.9	2%	0.021	37%	0.371	C	S	.	.	P	Polyproline II helix	trans	-88.1	141.9	165.5	-175.1	65.1	0	0	0	110	F540 A569 K574 F577 S604 P605	F540-L565 HydrophobicContact CB-CD1 3.81Å; F540-L565 HydrophobicContact CD1-CD1 4.26Å; F540-L565 HydrophobicContact CG-CD1 4.41Å; L565-A569 HydrophobicContact CD1-CB 3.86Å; L565-A569 HydrophobicContact CD2-CB 3.99Å; L565-A569 HydrophobicContact CG-CB 3.76Å; L565-K574 HydrophobicContact CD2-CB 4.45Å; L565-K574 HydrophobicContact CD2-CG 3.79Å; L565-F577 HydrophobicContact CB-CD2 4.17Å; L565-F577 HydrophobicContact CB-CE2 4.27Å; L565-F577 HydrophobicContact CD1-CB 4.19Å; L565-F577 HydrophobicContact CD1-CD2 4.33Å; L565-F577 HydrophobicContact CD1-CG 4.43Å; L565-F577 HydrophobicContact CD2-CB 4.4Å; L565-F577 HydrophobicContact CD2-CG 4.39Å; L565-S604 WeakPolarHBondContact O-CB 3.13Å; L565-P605 HydrophobicContact CB-CB 4.41Å; L565-P605 HydrophobicContact CD2-CG 4.26Å; L565-P605 PolarHBondContact N-O 3.45Å
566	K	87.6	Confident	88.7	Confident	109 Å²	109	69 Å²	69	47%	0.474	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-59.9	143.2	175	-70	172.5	-174.7	-179.7	0	112.2	F540 D568 A569	F540-K566 WeakPolarHBondContact O-CG 3.31Å; F540-K566 PolarHBondContact O-N 2.89Å; F540-K566 VanDerWaalsContact O-N 3.13Å; K566-D568 VanDerWaalsContact C-N 3.31Å; K566-D568 PolarHBondContact O-N 3.33Å; K566-A569 HydrophobicContact CB-CB 4.5Å; K566-A569 WeakPolarHBondContact O-CB 3.37Å; K566-A569 PolarHBondContact O-N 3.26Å; K566-A569 VanDerWaalsContact O-N 3.15Å
567	E	80.9	Confident	89.2	Confident	164 Å²	164	62.8 Å²	62.8	77%	0.766	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-37	-179.3	-64.7	-177.6	174.5	0	0	112.7	A569	E567-A569 VanDerWaalsContact C-N 3.28Å; E567-A569 PolarHBondContact O-N 2.88Å
568	D	81.7	Confident	89.2	Confident	134 Å²	134	66.8 Å²	66.8	72%	0.717	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	17.8	178.3	65	-28.6	0	0	0	113.3	K566 L570	K566-D568 VanDerWaalsContact C-N 3.31Å; K566-D568 PolarHBondContact O-N 3.33Å; D568-L570 PolarHBondContact O-N 3.01Å
569	A	84.9	Confident	89	Confident	9 Å²	9	68 Å²	68	7%	0.074	34%	0.337	C	S	.	.			trans	-58.4	128.7	-176.7	0	0	0	0	0	112.7	L565 K566 E567 Q573 K574	L565-A569 HydrophobicContact CD1-CB 3.86Å; L565-A569 HydrophobicContact CD2-CB 3.99Å; L565-A569 HydrophobicContact CG-CB 3.76Å; K566-A569 HydrophobicContact CB-CB 4.5Å; K566-A569 WeakPolarHBondContact O-CB 3.37Å; K566-A569 PolarHBondContact O-N 3.26Å; K566-A569 VanDerWaalsContact O-N 3.15Å; E567-A569 VanDerWaalsContact C-N 3.28Å; E567-A569 PolarHBondContact O-N 2.88Å; A569-Q573 HydrophobicContact CB-CB 4.23Å; A569-K574 HydrophobicContact CB-CG 4.29Å; A569-K574 WeakPolarHBondContact O-CE 3.34Å
570	L	88.6	Confident	88.7	Confident	95 Å²	95	66.5 Å²	66.5	50%	0.497	33%	0.33	S	S	.	.			trans	-63.9	155.4	175.6	-65.9	170.7	0	0	0	110.9	D568 H572 Q573 K574	D568-L570 PolarHBondContact O-N 3.01Å; L570-H572 WeakPolarHBondContact CD1-NE2 3.3Å; L570-H572 PolarHBondContact O-N 3.03Å; L570-H572 VanDerWaalsContact O-N 3.11Å; L570-Q573 HydrophobicContact CB-CG 4.26Å; L570-Q573 WeakPolarHBondContact O-CB 3.25Å; L570-Q573 PolarHBondContact O-N 2.88Å; L570-K574 PolarHBondContact O-N 3.27Å; L570-K574 VanDerWaalsContact O-N 3.14Å
571	P	86.7	Confident	88.4	Confident	108 Å²	108	67.4 Å²	67.4	70%	0.701	34%	0.336	S	S	*	.	H	α-helix	trans	-54.6	-34.6	-179.4	-27.6	35	0	0	0	114.3	K575	P571-K575 PolarHBondContact O-N 3.17Å
572	H	87.9	Confident	87.9	Confident	105 Å²	105	68.7 Å²	68.7	49%	0.486	35%	0.346	S	S	.	.	H	α-helix	trans	-69.3	-35.8	176.6	76.4	79.4	0	0	0	112.2	L570 K575 D576	L570-H572 WeakPolarHBondContact CD1-NE2 3.3Å; L570-H572 PolarHBondContact O-N 3.03Å; L570-H572 VanDerWaalsContact O-N 3.11Å; H572-K575 WeakPolarHBondContact O-CB 3.46Å; H572-K575 PolarHBondContact O-N 2.98Å; H572-D576 IonicContact ND1-OD2 3.53Å; H572-D576 PolarHBondContact O-N 3.36Å
573	Q	87.3	Confident	87.4	Confident	59 Å²	59	74.4 Å²	74.4	28%	0.276	37%	0.368	S	S	.	.	H	α-helix	trans	-69.4	-36.3	178.7	-60.7	178	-65.3	0	0	111.2	A569 L570 K575 D576 F577	A569-Q573 HydrophobicContact CB-CB 4.23Å; L570-Q573 HydrophobicContact CB-CG 4.26Å; L570-Q573 WeakPolarHBondContact O-CB 3.25Å; L570-Q573 PolarHBondContact O-N 2.88Å; Q573-K575 VanDerWaalsContact C-N 3.34Å; Q573-D576 PolarHBondContact O-N 3.4Å; Q573-F577 WeakPolarHBondContact O-CB 3.21Å; Q573-F577 PolarHBondContact O-N 2.79Å
574	K	87	Confident	87.1	Confident	103 Å²	103	75.3 Å²	75.3	45%	0.448	37%	0.372	S	S	.	.	H	α-helix	trans	-59.4	-46.1	171.1	-68.6	-179.3	179.1	-171.1	0	111	L565 A569 L570 F577 E578	L565-K574 HydrophobicContact CD2-CB 4.45Å; L565-K574 HydrophobicContact CD2-CG 3.79Å; A569-K574 HydrophobicContact CB-CG 4.29Å; A569-K574 WeakPolarHBondContact O-CE 3.34Å; L570-K574 PolarHBondContact O-N 3.27Å; L570-K574 VanDerWaalsContact O-N 3.14Å; K574-F577 WeakPolarHBondContact O-CB 3.47Å; K574-F577 PolarHBondContact O-N 3.27Å; K574-E578 WeakPolarHBondContact O-CG 3.35Å; K574-E578 PolarHBondContact O-N 2.99Å
575	K	87.7	Confident	86.7	Confident	122 Å²	122	75.5 Å²	75.5	53%	0.53	37%	0.374	S	S	.	.	H	α-helix	trans	-63.6	-41.3	176.3	-172.1	179.1	-178.9	178.5	0	112.6	P571 H572 Q573 F577 E578 Q579	P571-K575 PolarHBondContact O-N 3.17Å; H572-K575 WeakPolarHBondContact O-CB 3.46Å; H572-K575 PolarHBondContact O-N 2.98Å; Q573-K575 VanDerWaalsContact C-N 3.34Å; K575-F577 VanDerWaalsContact C-N 3.31Å; K575-F577 PolarHBondContact O-N 3.35Å; K575-E578 PolarHBondContact O-N 3.27Å; K575-Q579 WeakPolarHBondContact O-CG 3.39Å; K575-Q579 PolarHBondContact O-N 3.47Å
576	D	88.8	Confident	86.2	Confident	63 Å²	63	77.7 Å²	77.7	34%	0.337	39%	0.388	S	S	.	.	H	α-helix	trans	-65	-37.7	177.4	-65.9	-22	0	0	0	111.1	F540 H572 Q573 Q579 E580	F540-D576 HydrophobicContact CE1-CB 3.84Å; F540-D576 HydrophobicContact CZ-CB 4.47Å; H572-D576 IonicContact ND1-OD2 3.53Å; H572-D576 PolarHBondContact O-N 3.36Å; Q573-D576 PolarHBondContact O-N 3.4Å; D576-Q579 PolarHBondContact O-N 3.29Å; D576-E580 WeakPolarHBondContact O-CB 3.26Å; D576-E580 PolarHBondContact O-N 2.74Å
577	F	89.1	Confident	85.9	Confident	10 Å²	10	72.9 Å²	72.9	4%	0.044	37%	0.368	C	S	.	.	H	α-helix	trans	-62.8	-48.4	173.1	178.7	-89.2	0	0	0	111.6	F540 L565 Q573 K574 K575 Q579 E580 V581 P605 M607	F540-F577 HydrophobicContact CB-CD2 4Å; F540-F577 HydrophobicContact CD1-CB 3.95Å; F540-F577 HydrophobicContact CD1-CD2 4.31Å; F540-F577 AromaticContact CD2-CD2 3.87Å; F540-F577 HydrophobicContact CD2-CD2 3.87Å; F540-F577 HydrophobicContact CE1-CB 4.04Å; F540-F577 HydrophobicContact CE2-CD2 4.44Å; F540-F577 HydrophobicContact CG-CB 4.3Å; F540-F577 AromaticContact CG-CD2 3.79Å; F540-F577 HydrophobicContact CG-CD2 3.79Å; F540-F577 HydrophobicContact CZ-CB 4.45Å; L565-F577 HydrophobicContact CB-CD2 4.17Å; L565-F577 HydrophobicContact CB-CE2 4.27Å; L565-F577 HydrophobicContact CD1-CB 4.19Å; L565-F577 HydrophobicContact CD1-CD2 4.33Å; L565-F577 HydrophobicContact CD1-CG 4.43Å; L565-F577 HydrophobicContact CD2-CB 4.4Å; L565-F577 HydrophobicContact CD2-CG 4.39Å; Q573-F577 WeakPolarHBondContact O-CB 3.21Å; Q573-F577 PolarHBondContact O-N 2.79Å; K574-F577 WeakPolarHBondContact O-CB 3.47Å; K574-F577 PolarHBondContact O-N 3.27Å; K575-F577 VanDerWaalsContact C-N 3.31Å; K575-F577 PolarHBondContact O-N 3.35Å; F577-Q579 VanDerWaalsContact C-N 3.31Å; F577-Q579 PolarHBondContact O-N 3.36Å; F577-E580 PolarHBondContact O-N 2.89Å; F577-E580 VanDerWaalsContact O-N 3.14Å; F577-V581 HydrophobicContact CD1-CG2 4.14Å; F577-V581 HydrophobicContact CE1-CG2 3.86Å; F577-V581 HydrophobicContact CZ-CG2 4.29Å; F577-V581 WeakPolarHBondContact O-CG2 3.18Å; F577-V581 PolarHBondContact O-N 3.15Å; F577-P605 HydrophobicContact CD1-CB 4.41Å; F577-P605 HydrophobicContact CE1-CB 3.76Å; F577-P605 HydrophobicContact CZ-CB 4.11Å; F577-M607 HydrophobicContact CD2-CE 4.08Å; F577-M607 HydrophobicContact CE2-CE 3.73Å; F577-M607 HydrophobicContact CE2-CG 3.96Å; F577-M607 HydrophobicContact CE2-SD 4.42Å; F577-M607 HydrophobicContact CZ-CE 4.45Å; F577-M607 HydrophobicContact CZ-CG 3.74Å
578	E	88.1	Confident	85.9	Confident	128 Å²	128	71.9 Å²	71.9	60%	0.598	36%	0.357	S	S	*	.	H	α-helix	trans	-60.6	-38.9	176	-71.3	168.1	-174.7	0	0	112.6	K574 K575 E580 A582	K574-E578 WeakPolarHBondContact O-CG 3.35Å; K574-E578 PolarHBondContact O-N 2.99Å; K575-E578 PolarHBondContact O-N 3.27Å; E578-E580 VanDerWaalsContact C-N 3.34Å; E578-A582 PolarHBondContact O-N 3.03Å
579	Q	86.7	Confident	86	Confident	75 Å²	75	68.2 Å²	68.2	35%	0.35	34%	0.335	S	S	.	.	H	α-helix	trans	-64.9	-40.2	174.5	-76.4	-177	10.1	0	0	111.9	K575 D576 F577 A582 R583	K575-Q579 WeakPolarHBondContact O-CG 3.39Å; K575-Q579 PolarHBondContact O-N 3.47Å; D576-Q579 PolarHBondContact O-N 3.29Å; F577-Q579 VanDerWaalsContact C-N 3.31Å; F577-Q579 PolarHBondContact O-N 3.36Å; Q579-A582 PolarHBondContact O-N 2.01Å; Q579-R583 WeakPolarHBondContact O-CG 3.28Å; Q579-R583 PolarHBondContact O-N 2.78Å
580	E	88.1	Confident	86.1	Confident	58 Å²	58	72.8 Å²	72.8	27%	0.271	37%	0.367	S	S	.	.	H	α-helix	trans	-67.2	-42.4	178.7	-164.1	68.1	178.3	0	0	111.4	F540 D576 F577 E578 A582 R583 L584	F540-E580 HydrophobicContact CE2-CB 3.89Å; F540-E580 HydrophobicContact CE2-CG 3.99Å; F540-E580 HydrophobicContact CZ-CB 3.87Å; F540-E580 HydrophobicContact CZ-CG 4.32Å; D576-E580 WeakPolarHBondContact O-CB 3.26Å; D576-E580 PolarHBondContact O-N 2.74Å; F577-E580 PolarHBondContact O-N 2.89Å; F577-E580 VanDerWaalsContact O-N 3.14Å; E578-E580 VanDerWaalsContact C-N 3.34Å; E580-A582 VanDerWaalsContact C-N 3.3Å; E580-A582 PolarHBondContact O-N 3.14Å; E580-R583 PolarHBondContact O-N 2.84Å; E580-R583 VanDerWaalsContact O-N 3.12Å; E580-R583 IonicContact OE2-NH1 2.95Å; E580-R583 PolarHBondContact OE2-NH1 2.92Å; E580-L584 HydrophobicContact CG-CD1 3.85Å; E580-L584 HydrophobicContact CG-CG 4.24Å; E580-L584 WeakPolarHBondContact O-CB 3.39Å; E580-L584 WeakPolarHBondContact O-CG 2.94Å; E580-L584 PolarHBondContact O-N 2.03Å
581	V	89.3	Confident	86	Confident	18 Å²	18	71 Å²	71	11%	0.109	36%	0.358	C	S	.	.	H	α-helix	trans	-52.3	-49.4	170.5	169.9	0	0	0	0	110.9	P521 F577 R583 L584 S585 V598 M607	P521-V581 HydrophobicContact CG-CG1 3.48Å; P521-V581 VanDerWaalsContact CG-CG1 3.48Å; F577-V581 HydrophobicContact CD1-CG2 4.14Å; F577-V581 HydrophobicContact CE1-CG2 3.86Å; F577-V581 HydrophobicContact CZ-CG2 4.29Å; F577-V581 WeakPolarHBondContact O-CG2 3.18Å; F577-V581 PolarHBondContact O-N 3.15Å; V581-R583 VanDerWaalsContact C-N 3.3Å; V581-R583 PolarHBondContact O-N 2.86Å; V581-L584 PolarHBondContact O-N 2.96Å; V581-S585 WeakPolarHBondContact O-CB 3.01Å; V581-S585 PolarHBondContact O-N 3.44Å; V581-V598 HydrophobicContact CG1-CG1 3.71Å; V581-V598 HydrophobicContact CG2-CG1 3.98Å; V581-M607 HydrophobicContact CG2-CG 3.63Å; V581-M607 HydrophobicContact CG2-SD 3.63Å
582	A	85.6	Confident	86	Confident	44 Å²	44	67 Å²	67	36%	0.364	33%	0.331	S	S	.	.	H	α-helix	trans	-67.5	-27.3	-179.2	0	0	0	0	0	113.9	E578 Q579 E580 P586	E578-A582 PolarHBondContact O-N 3.03Å; Q579-A582 PolarHBondContact O-N 2.01Å; E580-A582 VanDerWaalsContact C-N 3.3Å; E580-A582 PolarHBondContact O-N 3.14Å; A582-P586 WeakPolarHBondContact O-CD 3.49Å
583	R	83.6	Confident	86.1	Confident	121 Å²	121	65 Å²	65	46%	0.457	33%	0.326	S	S	.	.	H	α-helix	trans	-78.3	-37.4	175.8	-74.4	179.5	-162.9	124.2	7.4	112.5	Q579 E580 V581 P586	Q579-R583 WeakPolarHBondContact O-CG 3.28Å; Q579-R583 PolarHBondContact O-N 2.78Å; E580-R583 PolarHBondContact O-N 2.84Å; E580-R583 VanDerWaalsContact O-N 3.12Å; E580-R583 IonicContact OE2-NH1 2.95Å; E580-R583 PolarHBondContact OE2-NH1 2.92Å; V581-R583 VanDerWaalsContact C-N 3.3Å; V581-R583 PolarHBondContact O-N 2.86Å; R583-P586 WeakPolarHBondContact O-CD 3.08Å
584	L	85.7	Confident	86.1	Confident	39 Å²	39	63.9 Å²	63.9	20%	0.204	32%	0.322	C	S	.	.	H	α-helix	trans	-87	-30.5	-174.6	-64.5	-179.8	0	0	0	112.8	E580 V581 P586 L587 M595 M607 F609	E580-L584 HydrophobicContact CG-CD1 3.85Å; E580-L584 HydrophobicContact CG-CG 4.24Å; E580-L584 WeakPolarHBondContact O-CB 3.39Å; E580-L584 WeakPolarHBondContact O-CG 2.94Å; E580-L584 PolarHBondContact O-N 2.03Å; V581-L584 PolarHBondContact O-N 2.96Å; L584-P586 VanDerWaalsContact C-N 3.35Å; L584-L587 HydrophobicContact CD2-CD1 3.85Å; L584-L587 WeakPolarHBondContact O-CB 3.3Å; L584-L587 PolarHBondContact O-N 2.92Å; L584-M595 HydrophobicContact CB-CE 3.55Å; L584-M595 HydrophobicContact CD1-CE 4Å; L584-M595 HydrophobicContact CG-CE 4.43Å; L584-M607 HydrophobicContact CD1-SD 4.46Å; L584-F609 HydrophobicContact CD1-CE1 4.26Å; L584-F609 HydrophobicContact CD1-CZ 3.92Å
585	S	84.7	Confident	86.3	Confident	18 Å²	18	59.3 Å²	59.3	13%	0.126	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-35.2	-179.3	78.1	0	0	0	0	116.1	N519 V581	N519-S585 PolarHBondContact O-OG 2.74Å; N519-S585 VanDerWaalsContact O-OG 3.04Å; V581-S585 WeakPolarHBondContact O-CB 3.01Å; V581-S585 PolarHBondContact O-N 3.44Å
586	P	80.8	Confident	86.6	Confident	50 Å²	50	54.1 Å²	54.1	33%	0.325	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-6.9	178.5	30.9	-30.1	0	0	0	114.1	A582 R583 L584 R588 V662 F666	A582-P586 WeakPolarHBondContact O-CD 3.49Å; R583-P586 WeakPolarHBondContact O-CD 3.08Å; L584-P586 VanDerWaalsContact C-N 3.35Å; P586-R588 VanDerWaalsContact C-N 3.32Å; P586-R588 PolarHBondContact O-N 2.97Å; P586-V662 HydrophobicContact CG-CG1 4.2Å; P586-F666 HydrophobicContact CG-CE2 3.87Å; P586-F666 HydrophobicContact CG-CZ 4.35Å
587	L	81.3	Confident	86.8	Confident	8 Å²	8	51.1 Å²	51.1	4%	0.042	27%	0.265	C	S	.	.			trans	-83.5	69.9	-174	-65.2	174.8	0	0	0	112.4	L584 V592 F659 V662	L584-L587 HydrophobicContact CD2-CD1 3.85Å; L584-L587 WeakPolarHBondContact O-CB 3.3Å; L584-L587 PolarHBondContact O-N 2.92Å; L587-V592 HydrophobicContact CB-CG1 4.5Å; L587-F659 HydrophobicContact CD1-CD1 4.31Å; L587-F659 HydrophobicContact CD1-CD2 4.21Å; L587-F659 HydrophobicContact CD1-CE1 3.66Å; L587-F659 HydrophobicContact CD1-CE2 3.55Å; L587-F659 HydrophobicContact CD1-CZ 3.24Å; L587-F659 HydrophobicContact CD2-CD2 4.34Å; L587-F659 HydrophobicContact CD2-CE2 4.47Å; L587-F659 HydrophobicContact CD2-CG 4.38Å; L587-V662 HydrophobicContact CD2-CB 3.83Å; L587-V662 HydrophobicContact CD2-CG1 3.82Å; L587-V662 HydrophobicContact CD2-CG2 3.95Å
588	R	80.3	Confident	87	Confident	143 Å²	143	51.1 Å²	51.1	54%	0.54	27%	0.265	S	S	.	.			trans	-96.2	113.4	174.7	-68.2	-166.4	162.5	-169	-3.5	111.9	P586 D594 L658	P586-R588 VanDerWaalsContact C-N 3.32Å; P586-R588 PolarHBondContact O-N 2.97Å; R588-D594 IonicContact NE-OD1 3.68Å; R588-D594 IonicContact NE-OD2 3.84Å; R588-L658 WeakPolarHBondContact O-CD2 3.08Å
589	H	85	Confident	87.1	Confident	56 Å²	56	45.1 Å²	45.1	26%	0.259	24%	0.237	S	C	.	.			trans	-146.5	154	175.6	-158.9	-99.9	0	0	0	111.3	N591 V592 L658	H589-N591 PolarHBondContact CE1-OD1 3.45Å; H589-N591 PolarHBondContact ND1-N 2.75Å; H589-N591 VanDerWaalsContact ND1-N 3.12Å; H589-N591 PolarHBondContact O-N 2.54Å; H589-V592 HydrophobicContact CB-CB 3.89Å; H589-V592 HydrophobicContact CB-CG2 3.68Å; H589-V592 PolarHBondContact O-N 2.87Å; H589-L658 HydrophobicContact CB-CD2 3.52Å
590	S	85.4	Confident	87.1	Confident	106 Å²	106	45.9 Å²	45.9	74%	0.741	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-8.5	173	55.4	0	0	0	0	115.4
591	N	87.1	Confident	86.1	Confident	57 Å²	57	46 Å²	46	31%	0.305	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.4	21.2	-174.3	-54.6	99.6	0	0	0	111.7	H589 Q651 S655	H589-N591 PolarHBondContact CE1-OD1 3.45Å; H589-N591 PolarHBondContact ND1-N 2.75Å; H589-N591 VanDerWaalsContact ND1-N 3.12Å; H589-N591 PolarHBondContact O-N 2.54Å; N591-Q651 PolarHBondContact ND2-OE1 2.9Å; N591-S655 WeakPolarHBondContact O-CB 2.95Å
592	V	86.7	Confident	84.9	Confident	23 Å²	23	47.5 Å²	47.5	14%	0.139	27%	0.274	C	S	.	.	S	Bend	trans	-124.3	136.4	171	176.4	0	0	0	0	105.9	L587 H589 D594	L587-V592 HydrophobicContact CB-CG1 4.5Å; H589-V592 HydrophobicContact CB-CB 3.89Å; H589-V592 HydrophobicContact CB-CG2 3.68Å; H589-V592 PolarHBondContact O-N 2.87Å; V592-D594 PolarHBondContact O-N 3.44Å; V592-D594 VanDerWaalsContact O-N 3.15Å
593	V	89.3	Confident	84.1	Confident	63 Å²	63	54.4 Å²	54.4	38%	0.382	30%	0.298	S	S	.	.			trans	-61.6	115.8	178.1	-178.5	0	0	0	0	109.2	F609 E610 M612	V593-F609 HydrophobicContact CG1-CB 4.13Å; V593-F609 HydrophobicContact CG1-CD1 4.36Å; V593-E610 VanDerWaalsContact CA-OE1 3.3Å; V593-E610 WeakPolarHBondContact CA-OE1 3.46Å; V593-E610 HydrophobicContact CG1-CG 3.72Å; V593-M612 HydrophobicContact CG1-CG 4.48Å; V593-M612 HydrophobicContact CG2-CE 4.43Å; V593-M612 HydrophobicContact CG2-CG 3.98Å; V593-M612 HydrophobicContact CG2-SD 3.84Å
594	D	88.4	Confident	84	Confident	37 Å²	37	50 Å²	50	20%	0.198	29%	0.286	C	S	.	.			trans	-76.5	140	-172.9	-163.3	13.4	0	0	0	112.3	R588 V592 F609 E610	R588-D594 IonicContact NE-OD1 3.68Å; R588-D594 IonicContact NE-OD2 3.84Å; V592-D594 PolarHBondContact O-N 3.44Å; V592-D594 VanDerWaalsContact O-N 3.15Å; D594-F609 VanDerWaalsContact O-CA 3.31Å; D594-F609 WeakPolarHBondContact O-CA 3.41Å; D594-E610 PolarHBondContact N-OE1 3.3Å; D594-E610 PolarHBondContact O-N 3.47Å; D594-E610 VanDerWaalsContact O-N 3.13Å
595	M	91.6	Very high	84.2	Confident	7 Å²	7	50.2 Å²	50.2	3%	0.034	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	108.8	169.3	-176.9	-177.3	-73.1	0	0	108.6	P521 L584 V598 M607 I608 F609	P521-M595 HydrophobicContact CB-SD 4.15Å; P521-M595 HydrophobicContact CG-SD 4.21Å; L584-M595 HydrophobicContact CB-CE 3.55Å; L584-M595 HydrophobicContact CD1-CE 4Å; L584-M595 HydrophobicContact CG-CE 4.43Å; M595-V598 HydrophobicContact SD-CG1 4.2Å; M595-M607 HydrophobicContact CE-CB 4.14Å; M595-M607 HydrophobicContact CE-CG 3.89Å; M595-M607 HydrophobicContact CE-SD 3.44Å; M595-M607 WeakPolarHBondContact CE-SD 3.29Å; M595-I608 CarbonylContact C-O 3.55Å; M595-F609 HydrophobicContact CB-CD1 4.02Å; M595-F609 HydrophobicContact CB-CE1 3.84Å; M595-F609 HydrophobicContact CE-CE1 3.7Å; M595-F609 HydrophobicContact CE-CE2 4.28Å; M595-F609 HydrophobicContact CE-CZ 3.4Å; M595-F609 VanDerWaalsContact CE-CZ 3.4Å; M595-F609 HydrophobicContact CG-CE1 4.23Å
596	L	92.6	Very high	84.6	Confident	13 Å²	13	49.5 Å²	49.5	7%	0.068	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	-33.9	-178.5	-55.2	-178.1	0	0	0	111.7	L548 Y551 I558 V560 I608	L548-L596 HydrophobicContact CD2-CD1 4.46Å; Y551-L596 HydrophobicContact CE1-CD2 4.34Å; Y551-L596 HydrophobicContact CE2-CB 4.17Å; I558-L596 HydrophobicContact CD1-CD1 3.89Å; V560-L596 HydrophobicContact CG1-CD1 3.63Å; L596-I608 HydrophobicContact CB-CG2 4.35Å; L596-I608 HydrophobicContact CD1-CG2 4.4Å; L596-I608 PolarHBondContact N-O 3.38Å
597	G	92.6	Very high	85.2	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.6	-171.7	178.1	0	0	0	0	0	113.4	P522 I608	P522-G597 CarbonylContact O-C 3.58Å; P522-G597 WeakPolarHBondContact O-CA 3.39Å; G597-I608 PolarHBondContact N-O 3.26Å; G597-I608 PolarHBondContact O-N 3.25Å
598	V	94.1	Very high	85.8	Confident	10 Å²	10	47 Å²	47	6%	0.061	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	147.5	175.8	-69	0	0	0	0	109.8	P521 P522 E523 I524 V581 M595 T600 A606 M607	P521-V598 HydrophobicContact CB-CG1 4.14Å; P521-V598 HydrophobicContact CB-CG2 4.26Å; P521-V598 HydrophobicContact CG-CB 4.35Å; P521-V598 HydrophobicContact CG-CG1 3.61Å; P521-V598 HydrophobicContact CG-CG2 3.83Å; P522-V598 PolarHBondContact O-N 3.15Å; E523-V598 CarbonylContact C-O 3.54Å; E523-V598 VanDerWaalsContact CA-O 3.27Å; E523-V598 WeakPolarHBondContact CA-O 3.48Å; I524-V598 PolarHBondContact N-O 3.13Å; V581-V598 HydrophobicContact CG1-CG1 3.71Å; V581-V598 HydrophobicContact CG2-CG1 3.98Å; M595-V598 HydrophobicContact SD-CG1 4.2Å; V598-T600 HydrophobicContact CG2-CG2 4.49Å; V598-A606 CarbonylContact C-O 3.46Å; V598-A606 WeakPolarHBondContact CA-O 3.04Å; V598-M607 HydrophobicContact CG1-CG 4.24Å
599	S	91.1	Very high	86.5	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.007	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	114	165.5	175.6	0	0	0	0	107.9	I524 S526 P605 A606	I524-S599 VanDerWaalsContact O-CB 3.26Å; I524-S599 WeakPolarHBondContact O-CB 3.28Å; I524-S599 PolarHBondContact O-OG 3.18Å; S526-S599 PolarHBondContact OG-OG 3.37Å; S599-P605 CarbonylContact O-C 3.56Å; S599-P605 VanDerWaalsContact O-CA 3.23Å; S599-P605 WeakPolarHBondContact O-CA 3.45Å; S599-A606 PolarHBondContact N-O 2.95Å; S599-A606 PolarHBondContact O-N 2.69Å
600	T	85	Confident	86.9	Confident	92 Å²	92	42.7 Å²	42.7	56%	0.564	25%	0.254	S	S	*	.			trans	-103.2	-20.9	169.7	62.9	0	0	0	0	111.4	E523 V598 G602	E523-T600 VanDerWaalsContact CD-N 3.31Å; E523-T600 PolarHBondContact OE1-N 2.73Å; E523-T600 PolarHBondContact OE1-OG1 3.2Å; E523-T600 VanDerWaalsContact OE1-OG1 3.11Å; E523-T600 WeakPolarHBondContact OE2-CB 2.96Å; E523-T600 WeakPolarHBondContact OE2-CG2 3.36Å; E523-T600 PolarHBondContact OE2-N 3.46Å; E523-T600 PolarHBondContact OE2-OG1 3.49Å; V598-T600 HydrophobicContact CG2-CG2 4.49Å; T600-G602 PolarHBondContact O-N 3.16Å
601	S	68.7	Low	87.3	Confident	60 Å²	60	39.7 Å²	39.7	42%	0.42	23%	0.228	S	C	.	.	S	Bend	trans	-80.6	87.8	178	52.7	0	0	0	0	112	E523 S526	E523-S601 WeakPolarHBondContact OE1-CB 3.15Å; E523-S601 PolarHBondContact OE1-N 3.27Å; E523-S601 PolarHBondContact OE1-OG 3.23Å; S526-S601 WeakPolarHBondContact CB-O 3.44Å; S526-S601 PolarHBondContact OG-O 2.81Å
602	G	63.9	Low	87.4	Confident	50 Å²	50	41.5 Å²	41.5	52%	0.515	24%	0.236	S	C	.	.	S	Bend	trans	165.5	-168.1	177.3	0	0	0	0	0	115.3	T600	T600-G602 PolarHBondContact O-N 3.16Å
603	H	68.2	Low	87.3	Confident	188 Å²	188	44.7 Å²	44.7	87%	0.87	26%	0.255	S	S	*	.	S	Bend	trans	-72.5	-25.9	-179.9	-69.5	92.2	0	0	0	113.4
604	S	80.5	Confident	86.9	Confident	30 Å²	30	47.9 Å²	47.9	21%	0.21	27%	0.266	C	S	.	.	S	Bend	trans	-145.2	130.8	174.1	52.7	0	0	0	0	110.9	L565	L565-S604 WeakPolarHBondContact O-CB 3.13Å
605	P	90.1	Very high	86.6	Confident	43 Å²	43	47.8 Å²	47.8	28%	0.279	27%	0.273	S	S	.	.			trans	-60	143.4	172.5	-24.6	34.1	0	0	0	111.9	L565 F577 S599	L565-P605 HydrophobicContact CB-CB 4.41Å; L565-P605 HydrophobicContact CD2-CG 4.26Å; L565-P605 PolarHBondContact N-O 3.45Å; F577-P605 HydrophobicContact CD1-CB 4.41Å; F577-P605 HydrophobicContact CE1-CB 3.76Å; F577-P605 HydrophobicContact CZ-CB 4.11Å; S599-P605 CarbonylContact O-C 3.56Å; S599-P605 VanDerWaalsContact O-CA 3.23Å; S599-P605 WeakPolarHBondContact O-CA 3.45Å
606	A	93	Very high	86.2	Confident	3 Å²	3	51.6 Å²	51.6	3%	0.025	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	147.5	-179.4	0	0	0	0	0	112.9	V562 V563 T564 V598 S599	V562-A606 HydrophobicContact CG1-CB 3.77Å; V563-A606 CarbonylContact O-C 3.56Å; V563-A606 VanDerWaalsContact O-CA 3.23Å; V563-A606 WeakPolarHBondContact O-CA 3.25Å; T564-A606 HydrophobicContact CG2-CB 4.17Å; V598-A606 CarbonylContact C-O 3.46Å; V598-A606 WeakPolarHBondContact CA-O 3.04Å; S599-A606 PolarHBondContact N-O 2.95Å; S599-A606 PolarHBondContact O-N 2.69Å
607	M	94.3	Very high	85.8	Confident	6 Å²	6	54.9 Å²	54.9	3%	0.03	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	136.3	166.5	-67.9	180	-74.6	0	0	109.2	F540 V562 V563 F577 V581 L584 M595 V598 F609	F540-M607 HydrophobicContact CD2-CE 4.11Å; F540-M607 HydrophobicContact CE2-CE 4.25Å; V562-M607 WeakPolarHBondContact CA-O 2.96Å; V563-M607 HydrophobicContact CB-CB 4.36Å; V563-M607 HydrophobicContact CB-CE 4.4Å; V563-M607 HydrophobicContact CG1-CE 4.12Å; V563-M607 PolarHBondContact N-O 3.4Å; V563-M607 PolarHBondContact O-N 2.8Å; F577-M607 HydrophobicContact CD2-CE 4.08Å; F577-M607 HydrophobicContact CE2-CE 3.73Å; F577-M607 HydrophobicContact CE2-CG 3.96Å; F577-M607 HydrophobicContact CE2-SD 4.42Å; F577-M607 HydrophobicContact CZ-CE 4.45Å; F577-M607 HydrophobicContact CZ-CG 3.74Å; V581-M607 HydrophobicContact CG2-CG 3.63Å; V581-M607 HydrophobicContact CG2-SD 3.63Å; L584-M607 HydrophobicContact CD1-SD 4.46Å; M595-M607 HydrophobicContact CE-CB 4.14Å; M595-M607 HydrophobicContact CE-CG 3.89Å; M595-M607 HydrophobicContact CE-SD 3.44Å; M595-M607 WeakPolarHBondContact CE-SD 3.29Å; V598-M607 HydrophobicContact CG1-CG 4.24Å; M607-F609 HydrophobicContact CB-CD2 4.23Å; M607-F609 HydrophobicContact CB-CE2 3.47Å; M607-F609 VanDerWaalsContact CB-CE2 3.47Å; M607-F609 HydrophobicContact CB-CZ 4.06Å; M607-F609 HydrophobicContact CG-CE2 4.46Å; M607-F609 HydrophobicContact SD-CE2 4.33Å; M607-F609 HydrophobicContact SD-CZ 4.14Å
608	I	94.6	Very high	85.1	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	119.5	-177.2	-58.8	82.9	0	0	0	108	I524 I529 L548 V560 M595 L596 G597	I524-I608 HydrophobicContact CB-CD1 4.44Å; I524-I608 HydrophobicContact CD1-CB 4.1Å; I524-I608 HydrophobicContact CD1-CD1 4.23Å; I524-I608 HydrophobicContact CD1-CG1 4.22Å; I524-I608 HydrophobicContact CD1-CG2 4.32Å; I529-I608 HydrophobicContact CD1-CD1 3.82Å; I529-I608 HydrophobicContact CD1-CG1 3.84Å; L548-I608 HydrophobicContact CD2-CG2 4.42Å; V560-I608 HydrophobicContact CB-CG2 3.75Å; V560-I608 HydrophobicContact CG1-CG2 3.86Å; V560-I608 HydrophobicContact CG2-CG2 4.02Å; M595-I608 CarbonylContact C-O 3.55Å; L596-I608 HydrophobicContact CB-CG2 4.35Å; L596-I608 HydrophobicContact CD1-CG2 4.4Å; L596-I608 PolarHBondContact N-O 3.38Å; G597-I608 PolarHBondContact N-O 3.26Å; G597-I608 PolarHBondContact O-N 3.25Å
609	F	94.8	Very high	84.1	Confident	30 Å²	30	66 Å²	66	13%	0.132	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	159.2	178.8	-62.7	-91	0	0	0	110.4	V560 A561 V563 L584 V593 D594 M595 M607	V560-F609 CarbonylContact C-O 3.48Å; V560-F609 VanDerWaalsContact CA-O 3.29Å; V560-F609 WeakPolarHBondContact CA-O 3.5Å; V560-F609 WeakPolarHBondContact CB-O 3.46Å; A561-F609 HydrophobicContact CB-CB 4.35Å; A561-F609 PolarHBondContact N-O 3.01Å; A561-F609 PolarHBondContact O-N 2.8Å; V563-F609 HydrophobicContact CB-CE2 4.35Å; V563-F609 HydrophobicContact CG2-CD2 3.92Å; V563-F609 HydrophobicContact CG2-CE2 3.79Å; L584-F609 HydrophobicContact CD1-CE1 4.26Å; L584-F609 HydrophobicContact CD1-CZ 3.92Å; V593-F609 HydrophobicContact CG1-CB 4.13Å; V593-F609 HydrophobicContact CG1-CD1 4.36Å; D594-F609 VanDerWaalsContact O-CA 3.31Å; D594-F609 WeakPolarHBondContact O-CA 3.41Å; M595-F609 HydrophobicContact CB-CD1 4.02Å; M595-F609 HydrophobicContact CB-CE1 3.84Å; M595-F609 HydrophobicContact CE-CE1 3.7Å; M595-F609 HydrophobicContact CE-CE2 4.28Å; M595-F609 HydrophobicContact CE-CZ 3.4Å; M595-F609 VanDerWaalsContact CE-CZ 3.4Å; M595-F609 HydrophobicContact CG-CE1 4.23Å; M607-F609 HydrophobicContact CB-CD2 4.23Å; M607-F609 HydrophobicContact CB-CE2 3.47Å; M607-F609 VanDerWaalsContact CB-CE2 3.47Å; M607-F609 HydrophobicContact CB-CZ 4.06Å; M607-F609 HydrophobicContact CG-CE2 4.46Å; M607-F609 HydrophobicContact SD-CE2 4.33Å; M607-F609 HydrophobicContact SD-CZ 4.14Å
610	E	92.5	Very high	83.5	Confident	77 Å²	77	67.9 Å²	67.9	36%	0.36	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	147.1	165.7	67.8	-178.6	155.5	0	0	111.3	V593 D594	V593-E610 VanDerWaalsContact CA-OE1 3.3Å; V593-E610 WeakPolarHBondContact CA-OE1 3.46Å; V593-E610 HydrophobicContact CG1-CG 3.72Å; D594-E610 PolarHBondContact N-OE1 3.3Å; D594-E610 PolarHBondContact O-N 3.47Å; D594-E610 VanDerWaalsContact O-N 3.13Å
611	F	93.8	Very high	83.3	Confident	44 Å²	44	65.5 Å²	65.5	19%	0.193	35%	0.354	C	S	.	.			trans	-87.9	122.3	179.4	-179.7	-112.1	0	0	0	111.9	L535 K545 Q559 V613	L535-F611 HydrophobicContact CD1-CD2 4.2Å; L535-F611 HydrophobicContact CD1-CE2 3.76Å; L535-F611 HydrophobicContact CD2-CE2 4.32Å; K545-F611 HydrophobicContact CD-CE1 4.41Å; K545-F611 HydrophobicContact CD-CE2 4.2Å; K545-F611 HydrophobicContact CD-CZ 4.01Å; K545-F611 HydrophobicContact CG-CD2 4.28Å; K545-F611 HydrophobicContact CG-CE2 4.1Å; K545-F611 HydrophobicContact CG-CZ 4.37Å; Q559-F611 HydrophobicContact CB-CB 3.86Å; Q559-F611 HydrophobicContact CB-CD1 4.02Å; Q559-F611 HydrophobicContact CB-CG 4.24Å; Q559-F611 WeakPolarHBondContact O-CB 3.34Å; Q559-F611 PolarHBondContact O-N 2.92Å; Q559-F611 VanDerWaalsContact OE1-CD1 3.32Å; F611-V613 HydrophobicContact CD1-CB 4.48Å; F611-V613 HydrophobicContact CD1-CG1 3.73Å; F611-V613 HydrophobicContact CE1-CB 4.32Å; F611-V613 HydrophobicContact CE1-CG1 3.94Å; F611-V613 PolarHBondContact O-N 2.63Å; F611-V613 VanDerWaalsContact O-N 3.15Å
612	M	90.4	Very high	83.4	Confident	94 Å²	94	67.2 Å²	67.2	46%	0.463	36%	0.358	S	S	.	.			trans	-81.5	91.1	175.1	-61.7	-61.9	-71.7	0	0	110.6	V593 H614 G615	V593-M612 HydrophobicContact CG1-CG 4.48Å; V593-M612 HydrophobicContact CG2-CE 4.43Å; V593-M612 HydrophobicContact CG2-CG 3.98Å; V593-M612 HydrophobicContact CG2-SD 3.84Å; M612-H614 PolarHBondContact O-N 3.3Å; M612-G615 PolarHBondContact O-N 3.37Å
613	V	84	Confident	83.6	Confident	91 Å²	91	67.8 Å²	67.8	55%	0.552	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-22.1	-175.2	-64.9	0	0	0	0	115.1	F611	F611-V613 HydrophobicContact CD1-CB 4.48Å; F611-V613 HydrophobicContact CD1-CG1 3.73Å; F611-V613 HydrophobicContact CE1-CB 4.32Å; F611-V613 HydrophobicContact CE1-CG1 3.94Å; F611-V613 PolarHBondContact O-N 2.63Å; F611-V613 VanDerWaalsContact O-N 3.15Å
614	H	80.3	Confident	83.8	Confident	129 Å²	129	61.5 Å²	61.5	60%	0.597	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.3	10.8	-179.1	-61	-45.5	0	0	0	114	M612 F620	M612-H614 PolarHBondContact O-N 3.3Å; H614-F620 HydrophobicContact CB-CD2 3.65Å; H614-F620 HydrophobicContact CB-CE2 3.8Å; H614-F620 AromaticContact CG-CE2 3.99Å
615	G	82.6	Confident	83.2	Confident	35 Å²	35	61.3 Å²	61.3	36%	0.361	32%	0.318	S	S	.	.			trans	77.3	-162	-176.7	0	0	0	0	0	112.6	M612	M612-G615 PolarHBondContact O-N 3.37Å
616	D	83.8	Confident	81.7	Confident	88 Å²	88	62.5 Å²	62.5	47%	0.471	33%	0.325	S	S	.	.			trans	-76.4	155.4	177.6	72.9	78.3	0	0	0	112	H618 E619 F620	D616-H618 PolarHBondContact O-N 3.05Å; D616-H618 WeakPolarHBondContact OD1-CA 3.5Å; D616-H618 VanDerWaalsContact OD1-CB 3.25Å; D616-H618 WeakPolarHBondContact OD1-CB 3.42Å; D616-H618 PolarHBondContact OD1-N 2.87Å; D616-E619 PolarHBondContact O-N 3.25Å; D616-E619 PolarHBondContact OD1-N 3.01Å; D616-F620 WeakPolarHBondContact O-CB 3.44Å; D616-F620 PolarHBondContact O-N 3.23Å
617	L	83	Confident	80	Confident	82 Å²	82	71.9 Å²	71.9	43%	0.429	36%	0.362	S	S	.	.	H	α-helix	trans	-61.1	-32.7	-176.2	-176.8	60.9	0	0	0	112.6	L621 V648 V652	L617-L621 HydrophobicContact CD1-CD1 4.09Å; L617-L621 HydrophobicContact CD1-CD2 4.42Å; L617-L621 HydrophobicContact CD1-CG 4.03Å; L617-L621 HydrophobicContact CG-CD1 3.92Å; L617-L621 HydrophobicContact CG-CG 4.3Å; L617-L621 WeakPolarHBondContact O-CB 3.48Å; L617-L621 WeakPolarHBondContact O-CG 3.1Å; L617-L621 PolarHBondContact O-N 2.86Å; L617-V648 HydrophobicContact CD1-CG1 3.9Å; L617-V648 HydrophobicContact CD2-CG1 4.25Å; L617-V652 HydrophobicContact CD2-CG2 3.53Å
618	H	79.3	Confident	77.8	Confident	132 Å²	132	72.9 Å²	72.9	61%	0.611	37%	0.369	S	S	*	.	H	α-helix	trans	-68.9	-49.8	-177.4	178.9	72.4	0	0	0	110.9	D616 F620 L621 L622	D616-H618 PolarHBondContact O-N 3.05Å; D616-H618 WeakPolarHBondContact OD1-CA 3.5Å; D616-H618 VanDerWaalsContact OD1-CB 3.25Å; D616-H618 WeakPolarHBondContact OD1-CB 3.42Å; D616-H618 PolarHBondContact OD1-N 2.87Å; H618-F620 VanDerWaalsContact C-N 3.32Å; H618-F620 PolarHBondContact O-N 3.42Å; H618-L621 PolarHBondContact O-N 3.28Å; H618-L622 VanDerWaalsContact NE2-CD1 3.35Å; H618-L622 WeakPolarHBondContact NE2-CD1 3.03Å; H618-L622 WeakPolarHBondContact O-CG 3.36Å; H618-L622 PolarHBondContact O-N 3.46Å
619	E	73.1	Confident	75.6	Confident	110 Å²	110	81.1 Å²	81.1	51%	0.514	41%	0.408	S	S	.	.	H	α-helix	trans	-63	-40.6	175.8	-174.1	163.1	-148.2	0	0	111.3	D616 L621 L622 L623	D616-E619 PolarHBondContact O-N 3.25Å; D616-E619 PolarHBondContact OD1-N 3.01Å; E619-L621 PolarHBondContact O-N 3.12Å; E619-L622 PolarHBondContact O-N 3.29Å; E619-L623 HydrophobicContact CG-CD1 3.78Å; E619-L623 HydrophobicContact CG-CG 4.2Å; E619-L623 WeakPolarHBondContact O-CB 3.44Å; E619-L623 VanDerWaalsContact O-CG 3.28Å; E619-L623 WeakPolarHBondContact O-CG 3.43Å; E619-L623 PolarHBondContact O-N 2.97Å
620	F	78.6	Confident	73.2	Confident	42 Å²	42	82.1 Å²	82.1	18%	0.184	42%	0.418	C	S	.	.	H	α-helix	trans	-56.6	-47.1	176.7	-174.8	-95.5	0	0	0	112.9	H614 D616 H618 R624 L640	H614-F620 HydrophobicContact CB-CD2 3.65Å; H614-F620 HydrophobicContact CB-CE2 3.8Å; H614-F620 AromaticContact CG-CE2 3.99Å; D616-F620 WeakPolarHBondContact O-CB 3.44Å; D616-F620 PolarHBondContact O-N 3.23Å; H618-F620 VanDerWaalsContact C-N 3.32Å; H618-F620 PolarHBondContact O-N 3.42Å; F620-R624 PolarHBondContact O-N 2.8Å; F620-L640 HydrophobicContact CD1-CD1 4.37Å; F620-L640 HydrophobicContact CE1-CD1 3.98Å
621	L	80.2	Confident	70.8	Confident	41 Å²	41	82.1 Å²	82.1	22%	0.215	44%	0.439	C	S	.	.	H	α-helix	trans	-68.9	-41.7	179.5	-68.6	174.1	0	0	0	111.9	L617 H618 E619 L623 R624 A625 L640 F645 V648	L617-L621 HydrophobicContact CD1-CD1 4.09Å; L617-L621 HydrophobicContact CD1-CD2 4.42Å; L617-L621 HydrophobicContact CD1-CG 4.03Å; L617-L621 HydrophobicContact CG-CD1 3.92Å; L617-L621 HydrophobicContact CG-CG 4.3Å; L617-L621 WeakPolarHBondContact O-CB 3.48Å; L617-L621 WeakPolarHBondContact O-CG 3.1Å; L617-L621 PolarHBondContact O-N 2.86Å; H618-L621 PolarHBondContact O-N 3.28Å; E619-L621 PolarHBondContact O-N 3.12Å; L621-L623 VanDerWaalsContact C-N 3.32Å; L621-L623 PolarHBondContact O-N 3.37Å; L621-R624 PolarHBondContact O-N 3.42Å; L621-A625 PolarHBondContact O-N 3.32Å; L621-L640 HydrophobicContact CD2-CD1 3.82Å; L621-F645 HydrophobicContact CB-CE1 4.14Å; L621-F645 HydrophobicContact CD2-CD1 3.9Å; L621-F645 HydrophobicContact CD2-CE1 3.58Å; L621-F645 HydrophobicContact CD2-CZ 4.47Å; L621-F645 HydrophobicContact CG-CE1 4.35Å; L621-V648 HydrophobicContact CD1-CG1 4.39Å; L621-V648 HydrophobicContact CD2-CG1 4.16Å
622	L	71.3	Confident	68.4	Low	97 Å²	97	84.6 Å²	84.6	51%	0.508	46%	0.457	S	S	.	.	H	α-helix	trans	-62.8	-38.8	177.2	-76.7	179.1	0	0	0	112.4	H618 E619 R624 S628	H618-L622 VanDerWaalsContact NE2-CD1 3.35Å; H618-L622 WeakPolarHBondContact NE2-CD1 3.03Å; H618-L622 WeakPolarHBondContact O-CG 3.36Å; H618-L622 PolarHBondContact O-N 3.46Å; E619-L622 PolarHBondContact O-N 3.29Å; L622-R624 VanDerWaalsContact C-N 3.27Å; L622-R624 PolarHBondContact O-N 3.43Å; L622-S628 WeakPolarHBondContact O-CB 3.06Å; L622-S628 PolarHBondContact O-OG 2.89Å
623	L	66.4	Low	66.1	Low	61 Å²	61	86.5 Å²	86.5	32%	0.319	47%	0.474	S	S	.	.	H	α-helix	trans	-73.7	-16.9	-179.9	-70.1	174.7	0	0	0	113.2	E619 L621 R637	E619-L623 HydrophobicContact CG-CD1 3.78Å; E619-L623 HydrophobicContact CG-CG 4.2Å; E619-L623 WeakPolarHBondContact O-CB 3.44Å; E619-L623 VanDerWaalsContact O-CG 3.28Å; E619-L623 WeakPolarHBondContact O-CG 3.43Å; E619-L623 PolarHBondContact O-N 2.97Å; L621-L623 VanDerWaalsContact C-N 3.32Å; L621-L623 PolarHBondContact O-N 3.37Å; L623-R637 VanDerWaalsContact O-CZ 3.23Å; L623-R637 PolarHBondContact O-NE 3.04Å; L623-R637 PolarHBondContact O-NH2 3.12Å
624	R	72.4	Confident	64.2	Low	56 Å²	56	87 Å²	87	21%	0.211	47%	0.474	C	S	.	.	H	α-helix	trans	-120.7	2.8	-175.5	-64.8	174.4	171.3	69.3	1.9	114.6	F620 L621 L622 I638 L640	F620-R624 PolarHBondContact O-N 2.8Å; L621-R624 PolarHBondContact O-N 3.42Å; L622-R624 VanDerWaalsContact C-N 3.27Å; L622-R624 PolarHBondContact O-N 3.43Å; R624-I638 WeakPolarHBondContact CD-O 3.16Å; R624-I638 WeakPolarHBondContact CG-O 3.27Å; R624-L640 HydrophobicContact CB-CB 4.46Å; R624-L640 HydrophobicContact CB-CD1 3.87Å; R624-L640 HydrophobicContact CB-CG 3.79Å; R624-L640 PolarHBondContact O-N 3.36Å
625	A	69.4	Low	62.6	Low	27 Å²	27	90.6 Å²	90.6	22%	0.223	49%	0.487	C	S	.	.	S	Bend	trans	-59.5	141.7	170.3	0	0	0	0	0	110.5	L621 Y627 S628 F645	L621-A625 PolarHBondContact O-N 3.32Å; A625-Y627 PolarHBondContact O-N 3.44Å; A625-S628 VanDerWaalsContact O-CB 3.28Å; A625-S628 WeakPolarHBondContact O-CB 3.28Å; A625-S628 PolarHBondContact O-N 2.95Å; A625-F645 HydrophobicContact CB-CZ 4.08Å
626	P	58.5	Low	61.1	Low	67 Å²	67	96.8 Å²	96.8	44%	0.435	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-18.5	-175.8	-26.7	31.5	0	0	0	115
627	Y	56.6	Low	59.8	Low	201 Å²	201	95.6 Å²	95.6	79%	0.788	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.4	15	-175.4	-49.2	-65.2	0	0	0	113.5	A625 Q629	A625-Y627 PolarHBondContact O-N 3.44Å; Y627-Q629 PolarHBondContact O-N 2.9Å; Y627-Q629 VanDerWaalsContact O-N 3.12Å
628	S	48.8	Very low	58.9	Low	27 Å²	27	97.5 Å²	97.5	19%	0.189	51%	0.505	C	S	.	.			trans	-66.8	106.1	178.7	-177.2	0	0	0	0	111.4	L622 A625 S630 R637	L622-S628 WeakPolarHBondContact O-CB 3.06Å; L622-S628 PolarHBondContact O-OG 2.89Å; A625-S628 VanDerWaalsContact O-CB 3.28Å; A625-S628 WeakPolarHBondContact O-CB 3.28Å; A625-S628 PolarHBondContact O-N 2.95Å; S628-S630 PolarHBondContact O-N 2.82Å; S628-R637 PolarHBondContact O-NH2 3.2Å; S628-R637 PolarHBondContact OG-NH2 3.41Å
629	Q	47.1	Very low	58.5	Low	173 Å²	173	95.1 Å²	95.1	81%	0.808	50%	0.495	S	S	*	.			trans	-72.9	15.7	-179.3	-63.3	-170.5	3.3	0	0	114.6	Y627 G631	Y627-Q629 PolarHBondContact O-N 2.9Å; Y627-Q629 VanDerWaalsContact O-N 3.12Å; Q629-G631 PolarHBondContact O-N 2.97Å
630	S	45.1	Very low	58.4	Low	51 Å²	51	90.8 Å²	90.8	36%	0.357	48%	0.476	S	S	.	.			trans	-66.3	107.9	175.3	-98.4	0	0	0	0	110	S628 V632 R637	S628-S630 PolarHBondContact O-N 2.82Å; S630-V632 PolarHBondContact O-N 3.47Å; S630-R637 PolarHBondContact O-NH1 3.42Å
631	G	43	Very low	58.3	Low	76 Å²	76	92.8 Å²	92.8	78%	0.784	49%	0.488	S	S	*	.			trans	-70.6	19.1	179.8	0	0	0	0	0	115.4	Q629 V633	Q629-G631 PolarHBondContact O-N 2.97Å; G631-V633 PolarHBondContact O-N 3.14Å
632	V	43.2	Very low	58	Low	97 Å²	97	98.2 Å²	98.2	59%	0.588	51%	0.512	S	S	*	.			trans	-83.6	97.5	168.6	-174	0	0	0	0	106.4	S630 D634	S630-V632 PolarHBondContact O-N 3.47Å; V632-D634 PolarHBondContact O-N 3.25Å
633	V	41.6	Very low	58.1	Low	133 Å²	133	97 Å²	97	81%	0.806	51%	0.512	S	S	*	.			trans	-73.8	75.4	170.6	-175.4	0	0	0	0	107.1	G631	G631-V633 PolarHBondContact O-N 3.14Å
634	D	43.7	Very low	58.9	Low	102 Å²	102	96.9 Å²	96.9	55%	0.545	51%	0.512	S	S	.	.			trans	-78.4	122.5	166.4	-150	-17.1	0	0	0	107.7	V632 E636 R637	V632-D634 PolarHBondContact O-N 3.25Å; D634-E636 PolarHBondContact O-N 2.78Å; D634-E636 VanDerWaalsContact O-N 3.13Å; D634-R637 HydrophobicContact CB-CB 4.44Å; D634-R637 VanDerWaalsContact O-CB 3.25Å; D634-R637 WeakPolarHBondContact O-CB 3.24Å; D634-R637 PolarHBondContact O-N 2.03Å; D634-R637 VanDerWaalsContact O-N 3.09Å
635	K	46.6	Very low	59.1	Low	204 Å²	204	97.1 Å²	97.1	89%	0.887	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-15.1	-175.1	-78.5	-176.8	174.9	-180	0	112.5
636	E	51	Low	59.5	Low	165 Å²	165	101.1 Å²	101.1	77%	0.771	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	13.7	177.6	-66.7	-179.8	167.6	0	0	113.1	D634 I638	D634-E636 PolarHBondContact O-N 2.78Å; D634-E636 VanDerWaalsContact O-N 3.13Å; E636-I638 PolarHBondContact O-N 3.41Å
637	R	56.6	Low	60.6	Low	63 Å²	63	103.1 Å²	103.1	24%	0.238	54%	0.535	C	S	.	.			trans	-70.9	95	-178.4	-166.8	179.9	-169.6	-174.2	1.7	111.6	L623 S628 S630 D634 M639	L623-R637 VanDerWaalsContact O-CZ 3.23Å; L623-R637 PolarHBondContact O-NE 3.04Å; L623-R637 PolarHBondContact O-NH2 3.12Å; S628-R637 PolarHBondContact O-NH2 3.2Å; S628-R637 PolarHBondContact OG-NH2 3.41Å; S630-R637 PolarHBondContact O-NH1 3.42Å; D634-R637 HydrophobicContact CB-CB 4.44Å; D634-R637 VanDerWaalsContact O-CB 3.25Å; D634-R637 WeakPolarHBondContact O-CB 3.24Å; D634-R637 PolarHBondContact O-N 2.03Å; D634-R637 VanDerWaalsContact O-N 3.09Å; R637-M639 PolarHBondContact O-N 3.27Å
638	I	64.9	Low	61.9	Low	122 Å²	122	94.9 Å²	94.9	63%	0.626	51%	0.505	S	S	*	.			trans	-71.1	111.3	168.1	-55.8	171.7	0	0	0	107.9	R624 E636	R624-I638 WeakPolarHBondContact CD-O 3.16Å; R624-I638 WeakPolarHBondContact CG-O 3.27Å; E636-I638 PolarHBondContact O-N 3.41Å
639	M	69.7	Low	63.4	Low	83 Å²	83	95.2 Å²	95.2	41%	0.409	51%	0.51	S	S	.	.			trans	-74.2	134.2	168	-72.8	-66.1	-173.1	0	0	108.6	R637	R637-M639 PolarHBondContact O-N 3.27Å
640	L	72.1	Confident	65	Low	19 Å²	19	90.6 Å²	90.6	10%	0.099	49%	0.493	C	S	.	.			trans	-82.4	128.1	176.6	-63.9	170.8	0	0	0	108.5	F620 L621 R624 D644 F645	F620-L640 HydrophobicContact CD1-CD1 4.37Å; F620-L640 HydrophobicContact CE1-CD1 3.98Å; L621-L640 HydrophobicContact CD2-CD1 3.82Å; R624-L640 HydrophobicContact CB-CB 4.46Å; R624-L640 HydrophobicContact CB-CD1 3.87Å; R624-L640 HydrophobicContact CB-CG 3.79Å; R624-L640 PolarHBondContact O-N 3.36Å; L640-D644 WeakPolarHBondContact CA-OD2 3.38Å; L640-D644 HydrophobicContact CB-CB 3.91Å; L640-D644 HydrophobicContact CD2-CB 3.75Å; L640-D644 HydrophobicContact CG-CB 4.36Å; L640-F645 HydrophobicContact CB-CD2 3.97Å; L640-F645 HydrophobicContact CB-CE2 3.5Å; L640-F645 HydrophobicContact CB-CZ 3.97Å; L640-F645 HydrophobicContact CD1-CE1 4.45Å; L640-F645 HydrophobicContact CD1-CZ 4.18Å; L640-F645 WeakPolarHBondContact O-CE2 3.39Å
641	D	77.3	Confident	66.9	Low	83 Å²	83	91.5 Å²	91.5	44%	0.444	49%	0.492	S	S	.	.			trans	-83.8	176.1	172.4	78	16.9	0	0	0	111.1	S643 D644 F645	D641-S643 PolarHBondContact O-N 3.25Å; D641-S643 VanDerWaalsContact OD1-CA 3.29Å; D641-S643 WeakPolarHBondContact OD1-CA 3.36Å; D641-S643 VanDerWaalsContact OD1-CB 3.26Å; D641-S643 WeakPolarHBondContact OD1-CB 3.47Å; D641-S643 PolarHBondContact OD1-N 3.49Å; D641-S643 PolarHBondContact OD1-OG 3.24Å; D641-S643 PolarHBondContact OD2-OG 3.41Å; D641-D644 PolarHBondContact N-OD2 2.87Å; D641-D644 WeakPolarHBondContact O-CB 3.24Å; D641-D644 PolarHBondContact O-N 2.88Å; D641-D644 PolarHBondContact OD1-N 3.34Å; D641-F645 WeakPolarHBondContact O-CD2 3.05Å; D641-F645 PolarHBondContact O-N 2.76Å; D641-F645 VanDerWaalsContact O-N 3.1Å
642	Q	72.1	Confident	68.8	Low	155 Å²	155	90.3 Å²	90.3	72%	0.724	47%	0.469	S	S	*	.	H	α-helix	trans	-60.7	-29.5	-179.1	-170.3	174.8	3.8	0	0	113	L646	Q642-L646 WeakPolarHBondContact O-CB 3.35Å; Q642-L646 PolarHBondContact O-N 3.15Å; Q642-L646 VanDerWaalsContact O-N 3.09Å
643	S	75	Confident	70.5	Confident	73 Å²	73	87.6 Å²	87.6	51%	0.51	45%	0.451	S	S	.	.	H	α-helix	trans	-72.5	-38.6	178.1	79.8	0	0	0	0	111.5	D641 L646 H647	D641-S643 PolarHBondContact O-N 3.25Å; D641-S643 VanDerWaalsContact OD1-CA 3.29Å; D641-S643 WeakPolarHBondContact OD1-CA 3.36Å; D641-S643 VanDerWaalsContact OD1-CB 3.26Å; D641-S643 WeakPolarHBondContact OD1-CB 3.47Å; D641-S643 PolarHBondContact OD1-N 3.49Å; D641-S643 PolarHBondContact OD1-OG 3.24Å; D641-S643 PolarHBondContact OD2-OG 3.41Å; S643-L646 PolarHBondContact O-N 3.38Å; S643-H647 WeakPolarHBondContact O-CB 3.42Å; S643-H647 PolarHBondContact O-N 2.84Å
644	D	81.8	Confident	72.4	Confident	58 Å²	58	82.8 Å²	82.8	31%	0.31	43%	0.426	S	S	.	.	H	α-helix	trans	-62.4	-46.1	173.6	-63.2	-41.4	0	0	0	111.1	L640 D641 L646 H647 V648	L640-D644 WeakPolarHBondContact CA-OD2 3.38Å; L640-D644 HydrophobicContact CB-CB 3.91Å; L640-D644 HydrophobicContact CD2-CB 3.75Å; L640-D644 HydrophobicContact CG-CB 4.36Å; D641-D644 PolarHBondContact N-OD2 2.87Å; D641-D644 WeakPolarHBondContact O-CB 3.24Å; D641-D644 PolarHBondContact O-N 2.88Å; D641-D644 PolarHBondContact OD1-N 3.34Å; D644-L646 VanDerWaalsContact C-N 3.32Å; D644-L646 PolarHBondContact O-N 2.67Å; D644-H647 WeakPolarHBondContact O-CB 3.22Å; D644-H647 PolarHBondContact O-N 2.79Å; D644-H647 VanDerWaalsContact O-N 3.15Å; D644-V648 WeakPolarHBondContact O-CG2 3.09Å; D644-V648 PolarHBondContact O-N 3.22Å
645	F	76.8	Confident	74.1	Confident	61 Å²	61	78.8 Å²	78.8	27%	0.268	41%	0.405	S	S	.	.	H	α-helix	trans	-60.2	-41.6	176.6	-83	-75.5	0	0	0	112.3	L621 A625 L640 D641 H647 V648 A649	L621-F645 HydrophobicContact CB-CE1 4.14Å; L621-F645 HydrophobicContact CD2-CD1 3.9Å; L621-F645 HydrophobicContact CD2-CE1 3.58Å; L621-F645 HydrophobicContact CD2-CZ 4.47Å; L621-F645 HydrophobicContact CG-CE1 4.35Å; A625-F645 HydrophobicContact CB-CZ 4.08Å; L640-F645 HydrophobicContact CB-CD2 3.97Å; L640-F645 HydrophobicContact CB-CE2 3.5Å; L640-F645 HydrophobicContact CB-CZ 3.97Å; L640-F645 HydrophobicContact CD1-CE1 4.45Å; L640-F645 HydrophobicContact CD1-CZ 4.18Å; L640-F645 WeakPolarHBondContact O-CE2 3.39Å; D641-F645 WeakPolarHBondContact O-CD2 3.05Å; D641-F645 PolarHBondContact O-N 2.76Å; D641-F645 VanDerWaalsContact O-N 3.1Å; F645-H647 VanDerWaalsContact C-N 3.32Å; F645-V648 PolarHBondContact O-N 2.97Å; F645-A649 WeakPolarHBondContact O-CB 3.41Å; F645-A649 PolarHBondContact O-N 3.05Å
646	L	78	Confident	75.7	Confident	110 Å²	110	73.5 Å²	73.5	58%	0.576	39%	0.386	S	S	*	.	H	α-helix	trans	-65.2	-39.1	176.3	-175.8	64.2	0	0	0	111.3	Q642 S643 D644 A649 T650	Q642-L646 WeakPolarHBondContact O-CB 3.35Å; Q642-L646 PolarHBondContact O-N 3.15Å; Q642-L646 VanDerWaalsContact O-N 3.09Å; S643-L646 PolarHBondContact O-N 3.38Å; D644-L646 VanDerWaalsContact C-N 3.32Å; D644-L646 PolarHBondContact O-N 2.67Å; L646-A649 PolarHBondContact O-N 2.98Å; L646-T650 PolarHBondContact O-N 3.25Å; L646-T650 PolarHBondContact O-OG1 3.09Å
647	H	81.8	Confident	76.8	Confident	110 Å²	110	69.4 Å²	69.4	51%	0.509	37%	0.367	S	S	.	.	H	α-helix	trans	-64.3	-46.6	176.8	-170.4	36.3	0	0	0	111.6	S643 D644 F645 A649 T650 Q651	S643-H647 WeakPolarHBondContact O-CB 3.42Å; S643-H647 PolarHBondContact O-N 2.84Å; D644-H647 WeakPolarHBondContact O-CB 3.22Å; D644-H647 PolarHBondContact O-N 2.79Å; D644-H647 VanDerWaalsContact O-N 3.15Å; F645-H647 VanDerWaalsContact C-N 3.32Å; H647-A649 PolarHBondContact O-N 3.32Å; H647-T650 WeakPolarHBondContact O-CB 3.19Å; H647-T650 PolarHBondContact O-N 2.72Å; H647-Q651 PolarHBondContact CE1-NE2 3.08Å; H647-Q651 PolarHBondContact NE2-NE2 2.74Å; H647-Q651 WeakPolarHBondContact O-CG 2.91Å; H647-Q651 PolarHBondContact O-N 3.33Å
648	V	83.5	Confident	77.7	Confident	27 Å²	27	68.4 Å²	68.4	16%	0.164	37%	0.366	C	S	.	.	H	α-helix	trans	-58.6	-46.5	174.1	172.3	0	0	0	0	111	L617 L621 D644 F645 T650 Q651 V652	L617-V648 HydrophobicContact CD1-CG1 3.9Å; L617-V648 HydrophobicContact CD2-CG1 4.25Å; L621-V648 HydrophobicContact CD1-CG1 4.39Å; L621-V648 HydrophobicContact CD2-CG1 4.16Å; D644-V648 WeakPolarHBondContact O-CG2 3.09Å; D644-V648 PolarHBondContact O-N 3.22Å; F645-V648 PolarHBondContact O-N 2.97Å; V648-T650 VanDerWaalsContact C-N 3.27Å; V648-T650 PolarHBondContact O-N 3.43Å; V648-Q651 PolarHBondContact O-N 3.31Å; V648-Q651 VanDerWaalsContact O-N 3.14Å; V648-V652 HydrophobicContact CG1-CG2 4.37Å; V648-V652 WeakPolarHBondContact O-CG2 3.36Å; V648-V652 PolarHBondContact O-N 3.36Å
649	A	80.8	Confident	78	Confident	34 Å²	34	67.1 Å²	67.1	28%	0.281	36%	0.356	S	S	.	.	H	α-helix	trans	-58.3	-41.1	177.9	0	0	0	0	0	111.9	F645 L646 H647 Q651 V652 I653	F645-A649 WeakPolarHBondContact O-CB 3.41Å; F645-A649 PolarHBondContact O-N 3.05Å; L646-A649 PolarHBondContact O-N 2.98Å; H647-A649 PolarHBondContact O-N 3.32Å; A649-Q651 PolarHBondContact O-N 2.85Å; A649-V652 PolarHBondContact O-N 3.4Å; A649-I653 VanDerWaalsContact O-CG1 3.31Å; A649-I653 WeakPolarHBondContact O-CG1 3.29Å; A649-I653 PolarHBondContact O-N 2.96Å
650	T	80.9	Confident	78.4	Confident	76 Å²	76	66.7 Å²	66.7	47%	0.466	36%	0.358	S	S	.	.	H	α-helix	trans	-62.3	-43.1	176.6	-54.2	0	0	0	0	111.5	L646 H647 V648 I653 A654	L646-T650 PolarHBondContact O-N 3.25Å; L646-T650 PolarHBondContact O-OG1 3.09Å; H647-T650 WeakPolarHBondContact O-CB 3.19Å; H647-T650 PolarHBondContact O-N 2.72Å; V648-T650 VanDerWaalsContact C-N 3.27Å; V648-T650 PolarHBondContact O-N 3.43Å; T650-I653 PolarHBondContact O-N 2.93Å; T650-A654 PolarHBondContact O-N 3.46Å; T650-A654 VanDerWaalsContact O-N 3.08Å
651	Q	84.1	Confident	78.3	Confident	70 Å²	70	70 Å²	70	33%	0.327	38%	0.375	S	S	.	.	H	α-helix	trans	-65	-39.9	177.2	-68.6	-179.8	10.5	0	0	112.6	N591 H647 V648 A649 I653 A654 S655	N591-Q651 PolarHBondContact ND2-OE1 2.9Å; H647-Q651 PolarHBondContact CE1-NE2 3.08Å; H647-Q651 PolarHBondContact NE2-NE2 2.74Å; H647-Q651 WeakPolarHBondContact O-CG 2.91Å; H647-Q651 PolarHBondContact O-N 3.33Å; V648-Q651 PolarHBondContact O-N 3.31Å; V648-Q651 VanDerWaalsContact O-N 3.14Å; A649-Q651 PolarHBondContact O-N 2.85Å; Q651-I653 VanDerWaalsContact C-N 3.34Å; Q651-A654 PolarHBondContact O-N 3.37Å; Q651-S655 PolarHBondContact O-N 3.2Å; Q651-S655 VanDerWaalsContact O-N 3.15Å
652	V	82.5	Confident	78	Confident	51 Å²	51	67.1 Å²	67.1	31%	0.309	36%	0.361	S	S	.	.	H	α-helix	trans	-64.3	-39.2	175.7	172.8	0	0	0	0	111.3	L617 V648 A649 S655 I656	L617-V652 HydrophobicContact CD2-CG2 3.53Å; V648-V652 HydrophobicContact CG1-CG2 4.37Å; V648-V652 WeakPolarHBondContact O-CG2 3.36Å; V648-V652 PolarHBondContact O-N 3.36Å; A649-V652 PolarHBondContact O-N 3.4Å; V652-S655 PolarHBondContact O-N 2.88Å; V652-S655 PolarHBondContact O-OG 2.9Å; V652-I656 HydrophobicContact CG1-CD1 4Å; V652-I656 WeakPolarHBondContact O-CG1 3.49Å; V652-I656 PolarHBondContact O-N 2.85Å; V652-I656 VanDerWaalsContact O-N 3.11Å
653	I	80.5	Confident	77.7	Confident	41 Å²	41	64.8 Å²	64.8	21%	0.21	35%	0.353	C	S	.	.	H	α-helix	trans	-64.1	-44.2	176.3	-69.6	164.7	0	0	0	110.5	M493 A649 T650 Q651 S655 I656 H657	M493-I653 HydrophobicContact CE-CD1 4.19Å; M493-I653 HydrophobicContact CG-CD1 4.29Å; M493-I653 HydrophobicContact SD-CD1 4.2Å; A649-I653 VanDerWaalsContact O-CG1 3.31Å; A649-I653 WeakPolarHBondContact O-CG1 3.29Å; A649-I653 PolarHBondContact O-N 2.96Å; T650-I653 PolarHBondContact O-N 2.93Å; Q651-I653 VanDerWaalsContact C-N 3.34Å; I653-S655 VanDerWaalsContact C-N 3.27Å; I653-S655 PolarHBondContact O-N 3.44Å; I653-I656 PolarHBondContact O-N 2.03Å; I653-H657 PolarHBondContact O-CD2 3.43Å; I653-H657 PolarHBondContact O-N 3.45Å; I653-H657 VanDerWaalsContact O-N 3.1Å
654	A	80.4	Confident	77.4	Confident	32 Å²	32	64.9 Å²	64.9	26%	0.264	35%	0.347	S	S	.	.	H	α-helix	trans	-57.9	-39.5	177.8	0	0	0	0	0	112.2	T650 Q651 H657 L658	T650-A654 PolarHBondContact O-N 3.46Å; T650-A654 VanDerWaalsContact O-N 3.08Å; Q651-A654 PolarHBondContact O-N 3.37Å; A654-H657 PolarHBondContact O-N 3.28Å; A654-L658 PolarHBondContact O-N 2.97Å
655	S	80.6	Confident	76.5	Confident	17 Å²	17	67.5 Å²	67.5	12%	0.119	36%	0.361	C	S	.	.	H	α-helix	trans	-70.5	-37.6	176.9	65.6	0	0	0	0	113.5	N591 Q651 V652 I653 H657 L658 F659	N591-S655 WeakPolarHBondContact O-CB 2.95Å; Q651-S655 PolarHBondContact O-N 3.2Å; Q651-S655 VanDerWaalsContact O-N 3.15Å; V652-S655 PolarHBondContact O-N 2.88Å; V652-S655 PolarHBondContact O-OG 2.9Å; I653-S655 VanDerWaalsContact C-N 3.27Å; I653-S655 PolarHBondContact O-N 3.44Å; S655-H657 VanDerWaalsContact C-N 3.3Å; S655-H657 PolarHBondContact O-N 3.45Å; S655-L658 PolarHBondContact O-N 3.16Å; S655-F659 PolarHBondContact O-N 2.68Å
656	I	78.8	Confident	75.9	Confident	93 Å²	93	68.5 Å²	68.5	48%	0.477	37%	0.365	S	S	.	.	H	α-helix	trans	-61.7	-39.2	175.4	-68.2	166.6	0	0	0	111.1	V652 I653 L658 F659 V660	V652-I656 HydrophobicContact CG1-CD1 4Å; V652-I656 WeakPolarHBondContact O-CG1 3.49Å; V652-I656 PolarHBondContact O-N 2.85Å; V652-I656 VanDerWaalsContact O-N 3.11Å; I653-I656 PolarHBondContact O-N 2.03Å; I656-L658 VanDerWaalsContact C-N 3.32Å; I656-L658 PolarHBondContact O-N 3.35Å; I656-F659 WeakPolarHBondContact O-CB 3.45Å; I656-F659 PolarHBondContact O-N 3.33Å; I656-F659 VanDerWaalsContact O-N 3.13Å; I656-V660 HydrophobicContact CG2-CG2 4.26Å; I656-V660 WeakPolarHBondContact O-CG2 3.43Å; I656-V660 PolarHBondContact O-N 3.35Å
657	H	74.8	Confident	75.3	Confident	79 Å²	79	67.2 Å²	67.2	37%	0.366	36%	0.358	S	S	.	.	H	α-helix	trans	-59	-41.8	176.2	-88.9	-78.7	0	0	0	112.6	L497 I653 A654 S655 F659 N661	L497-H657 WeakPolarHBondContact CD2-NE2 3.3Å; I653-H657 PolarHBondContact O-CD2 3.43Å; I653-H657 PolarHBondContact O-N 3.45Å; I653-H657 VanDerWaalsContact O-N 3.1Å; A654-H657 PolarHBondContact O-N 3.28Å; S655-H657 VanDerWaalsContact C-N 3.3Å; S655-H657 PolarHBondContact O-N 3.45Å; H657-F659 VanDerWaalsContact C-N 3.34Å; H657-N661 WeakPolarHBondContact O-CB 3.26Å; H657-N661 VanDerWaalsContact O-CG 3.25Å; H657-N661 PolarHBondContact O-N 3.38Å; H657-N661 PolarHBondContact O-ND2 3.01Å
658	L	75.3	Confident	74.3	Confident	42 Å²	42	68 Å²	68	22%	0.22	36%	0.36	C	S	.	.	H	α-helix	trans	-60.5	-47.2	173.8	-179.1	69.7	0	0	0	110.8	R588 H589 A654 S655 I656 V660 N661 V662	R588-L658 WeakPolarHBondContact O-CD2 3.08Å; H589-L658 HydrophobicContact CB-CD2 3.52Å; A654-L658 PolarHBondContact O-N 2.97Å; S655-L658 PolarHBondContact O-N 3.16Å; I656-L658 VanDerWaalsContact C-N 3.32Å; I656-L658 PolarHBondContact O-N 3.35Å; L658-V660 PolarHBondContact O-N 3.31Å; L658-N661 PolarHBondContact O-N 3.29Å; L658-V662 HydrophobicContact CD1-CG2 4.03Å; L658-V662 HydrophobicContact CG-CG2 4.2Å; L658-V662 WeakPolarHBondContact O-CG2 3.06Å; L658-V662 PolarHBondContact O-N 2.99Å
659	F	72	Confident	73.2	Confident	96 Å²	96	70.3 Å²	70.3	42%	0.421	37%	0.374	S	S	.	.	H	α-helix	trans	-57.1	-48	-179.1	-118.9	-81.5	0	0	0	112.1	L587 S655 I656 H657 N661 V662 L663	L587-F659 HydrophobicContact CD1-CD1 4.31Å; L587-F659 HydrophobicContact CD1-CD2 4.21Å; L587-F659 HydrophobicContact CD1-CE1 3.66Å; L587-F659 HydrophobicContact CD1-CE2 3.55Å; L587-F659 HydrophobicContact CD1-CZ 3.24Å; L587-F659 HydrophobicContact CD2-CD2 4.34Å; L587-F659 HydrophobicContact CD2-CE2 4.47Å; L587-F659 HydrophobicContact CD2-CG 4.38Å; S655-F659 PolarHBondContact O-N 2.68Å; I656-F659 WeakPolarHBondContact O-CB 3.45Å; I656-F659 PolarHBondContact O-N 3.33Å; I656-F659 VanDerWaalsContact O-N 3.13Å; H657-F659 VanDerWaalsContact C-N 3.34Å; F659-N661 PolarHBondContact O-N 3.05Å; F659-V662 PolarHBondContact O-N 2.04Å; F659-L663 VanDerWaalsContact O-CB 3.3Å; F659-L663 WeakPolarHBondContact O-CB 3.21Å; F659-L663 PolarHBondContact O-N 2.93Å
660	V	76.6	Confident	72	Confident	73 Å²	73	73.6 Å²	73.6	44%	0.442	39%	0.387	S	S	.	.	H	α-helix	trans	-62.3	-43.6	178.2	173.8	0	0	0	0	111	I656 L658 L663 L664	I656-V660 HydrophobicContact CG2-CG2 4.26Å; I656-V660 WeakPolarHBondContact O-CG2 3.43Å; I656-V660 PolarHBondContact O-N 3.35Å; L658-V660 PolarHBondContact O-N 3.31Å; V660-L663 PolarHBondContact O-N 3.21Å; V660-L664 HydrophobicContact CG1-CD1 3.94Å; V660-L664 HydrophobicContact CG1-CG 4.41Å; V660-L664 WeakPolarHBondContact O-CB 3.46Å; V660-L664 VanDerWaalsContact O-CG 3.29Å; V660-L664 WeakPolarHBondContact O-CG 3.14Å; V660-L664 PolarHBondContact O-N 2.96Å
661	N	70.8	Confident	70.9	Confident	89 Å²	89	75.7 Å²	75.7	48%	0.476	39%	0.393	S	S	.	.	H	α-helix	trans	-65	-43.2	179.9	-73.9	-24.1	0	0	0	112.4	H657 L658 F659 L664 L665	H657-N661 WeakPolarHBondContact O-CB 3.26Å; H657-N661 VanDerWaalsContact O-CG 3.25Å; H657-N661 PolarHBondContact O-N 3.38Å; H657-N661 PolarHBondContact O-ND2 3.01Å; L658-N661 PolarHBondContact O-N 3.29Å; F659-N661 PolarHBondContact O-N 3.05Å; N661-L664 PolarHBondContact O-N 2.89Å; N661-L665 PolarHBondContact O-N 3.35Å
662	V	70.2	Confident	69.2	Low	22 Å²	22	79.3 Å²	79.3	13%	0.133	41%	0.408	C	S	.	.	H	α-helix	trans	-66.5	-41.5	176.7	173.9	0	0	0	0	110.7	P586 L587 L658 F659 L664 L665 F666	P586-V662 HydrophobicContact CG-CG1 4.2Å; L587-V662 HydrophobicContact CD2-CB 3.83Å; L587-V662 HydrophobicContact CD2-CG1 3.82Å; L587-V662 HydrophobicContact CD2-CG2 3.95Å; L658-V662 HydrophobicContact CD1-CG2 4.03Å; L658-V662 HydrophobicContact CG-CG2 4.2Å; L658-V662 WeakPolarHBondContact O-CG2 3.06Å; L658-V662 PolarHBondContact O-N 2.99Å; F659-V662 PolarHBondContact O-N 2.04Å; V662-L664 PolarHBondContact O-N 3.26Å; V662-L665 WeakPolarHBondContact O-CB 3.46Å; V662-L665 PolarHBondContact O-N 3.33Å; V662-F666 HydrophobicContact CG1-CD2 3.95Å; V662-F666 HydrophobicContact CG1-CE2 4.06Å; V662-F666 WeakPolarHBondContact O-CD2 3.21Å; V662-F666 PolarHBondContact O-N 3.45Å
663	L	67.4	Low	67.6	Low	106 Å²	106	82.6 Å²	82.6	56%	0.555	42%	0.421	S	S	*	.	H	α-helix	trans	-62	-43.9	176.4	-159.4	88.5	0	0	0	111.6	F659 V660 F666 I667	F659-L663 VanDerWaalsContact O-CB 3.3Å; F659-L663 WeakPolarHBondContact O-CB 3.21Å; F659-L663 PolarHBondContact O-N 2.93Å; V660-L663 PolarHBondContact O-N 3.21Å; L663-F666 PolarHBondContact O-N 3.43Å; L663-I667 HydrophobicContact CD2-CD1 4.25Å; L663-I667 HydrophobicContact CG-CD1 4.29Å; L663-I667 VanDerWaalsContact O-CG1 3.3Å; L663-I667 WeakPolarHBondContact O-CG1 3.04Å; L663-I667 PolarHBondContact O-N 2.98Å
664	L	67.9	Low	66	Low	76 Å²	76	83.6 Å²	83.6	40%	0.398	43%	0.432	S	S	.	.	H	α-helix	trans	-60.8	-45.1	175.4	-75.1	170.4	0	0	0	111.2	V660 N661 V662 F666 I667 F668	V660-L664 HydrophobicContact CG1-CD1 3.94Å; V660-L664 HydrophobicContact CG1-CG 4.41Å; V660-L664 WeakPolarHBondContact O-CB 3.46Å; V660-L664 VanDerWaalsContact O-CG 3.29Å; V660-L664 WeakPolarHBondContact O-CG 3.14Å; V660-L664 PolarHBondContact O-N 2.96Å; N661-L664 PolarHBondContact O-N 2.89Å; V662-L664 PolarHBondContact O-N 3.26Å; L664-F666 VanDerWaalsContact C-N 3.31Å; L664-F666 PolarHBondContact O-N 3.1Å; L664-I667 PolarHBondContact O-N 2.72Å; L664-I667 VanDerWaalsContact O-N 3.16Å; L664-F668 HydrophobicContact CB-CD2 4.38Å; L664-F668 HydrophobicContact CB-CE2 4.42Å; L664-F668 HydrophobicContact CD2-CE2 4.39Å; L664-F668 WeakPolarHBondContact O-CB 3.29Å; L664-F668 WeakPolarHBondContact O-CD2 3.45Å; L664-F668 PolarHBondContact O-N 3.46Å
665	L	63.5	Low	64.5	Low	113 Å²	113	85.9 Å²	85.9	59%	0.592	45%	0.446	S	S	*	.	H	α-helix	trans	-58	-41.6	174.8	-82.9	157.8	0	0	0	112.4	N661 V662 F668 T669	N661-L665 PolarHBondContact O-N 3.35Å; V662-L665 WeakPolarHBondContact O-CB 3.46Å; V662-L665 PolarHBondContact O-N 3.33Å; L665-F668 PolarHBondContact O-N 3.36Å; L665-T669 WeakPolarHBondContact O-CB 3.18Å; L665-T669 VanDerWaalsContact O-CG2 3.3Å; L665-T669 WeakPolarHBondContact O-CG2 3.17Å; L665-T669 PolarHBondContact O-N 3.48Å; L665-T669 PolarHBondContact O-OG1 3.16Å
666	F	63.9	Low	62.6	Low	82 Å²	82	91.2 Å²	91.2	36%	0.36	47%	0.473	S	S	.	.	H	α-helix	trans	-64.7	-41.2	174.5	-96.8	-80.8	0	0	0	112.7	P586 V662 L663 L664 T669 N670	P586-F666 HydrophobicContact CG-CE2 3.87Å; P586-F666 HydrophobicContact CG-CZ 4.35Å; V662-F666 HydrophobicContact CG1-CD2 3.95Å; V662-F666 HydrophobicContact CG1-CE2 4.06Å; V662-F666 WeakPolarHBondContact O-CD2 3.21Å; V662-F666 PolarHBondContact O-N 3.45Å; L663-F666 PolarHBondContact O-N 3.43Å; L664-F666 VanDerWaalsContact C-N 3.31Å; L664-F666 PolarHBondContact O-N 3.1Å; F666-T669 WeakPolarHBondContact CA-OG1 3.39Å; F666-T669 PolarHBondContact O-OG1 3.16Å; F666-T669 VanDerWaalsContact O-OG1 3.12Å; F666-N670 WeakPolarHBondContact O-CB 2.93Å; F666-N670 PolarHBondContact O-N 3.38Å; F666-N670 VanDerWaalsContact O-N 3.08Å; F666-N670 PolarHBondContact O-ND2 3.43Å
667	I	65.7	Low	61	Low	82 Å²	82	94.1 Å²	94.1	42%	0.421	49%	0.488	S	S	.	.	H	α-helix	trans	-65.4	-47.1	177.5	-67.2	163.8	0	0	0	109.7	L663 L664 N670 M671	L663-I667 HydrophobicContact CD2-CD1 4.25Å; L663-I667 HydrophobicContact CG-CD1 4.29Å; L663-I667 VanDerWaalsContact O-CG1 3.3Å; L663-I667 WeakPolarHBondContact O-CG1 3.04Å; L663-I667 PolarHBondContact O-N 2.98Å; L664-I667 PolarHBondContact O-N 2.72Å; L664-I667 VanDerWaalsContact O-N 3.16Å; I667-N670 PolarHBondContact O-N 3Å; I667-M671 HydrophobicContact CG2-CG 4.38Å; I667-M671 HydrophobicContact CG2-SD 4.05Å; I667-M671 WeakPolarHBondContact O-CB 3.45Å; I667-M671 WeakPolarHBondContact O-CG 3.06Å; I667-M671 PolarHBondContact O-N 3.38Å
668	F	60.4	Low	59.3	Low	127 Å²	127	103 Å²	103	56%	0.557	52%	0.518	S	S	*	.	H	α-helix	trans	-63.4	-45.2	-180	-82.1	-67.2	0	0	0	112.4	L664 L665 M671 F672	L664-F668 HydrophobicContact CB-CD2 4.38Å; L664-F668 HydrophobicContact CB-CE2 4.42Å; L664-F668 HydrophobicContact CD2-CE2 4.39Å; L664-F668 WeakPolarHBondContact O-CB 3.29Å; L664-F668 WeakPolarHBondContact O-CD2 3.45Å; L664-F668 PolarHBondContact O-N 3.46Å; L665-F668 PolarHBondContact O-N 3.36Å; F668-M671 PolarHBondContact O-N 3.41Å; F668-F672 WeakPolarHBondContact O-CB 2.98Å; F668-F672 PolarHBondContact O-N 3.4Å
669	T	60	Low	58.5	Low	76 Å²	76	106 Å²	106	47%	0.466	53%	0.533	S	S	.	.	H	α-helix	trans	-64.9	-42	178.7	49.2	0	0	0	0	112.1	L665 F666 F672 M673	L665-T669 WeakPolarHBondContact O-CB 3.18Å; L665-T669 VanDerWaalsContact O-CG2 3.3Å; L665-T669 WeakPolarHBondContact O-CG2 3.17Å; L665-T669 PolarHBondContact O-N 3.48Å; L665-T669 PolarHBondContact O-OG1 3.16Å; F666-T669 WeakPolarHBondContact CA-OG1 3.39Å; F666-T669 PolarHBondContact O-OG1 3.16Å; F666-T669 VanDerWaalsContact O-OG1 3.12Å; T669-F672 PolarHBondContact O-N 3.35Å; T669-M673 WeakPolarHBondContact O-CB 3.1Å; T669-M673 WeakPolarHBondContact O-CG 3.27Å; T669-M673 PolarHBondContact O-N 3.18Å
670	N	56.2	Low	57.8	Low	102 Å²	102	106.5 Å²	106.5	55%	0.545	54%	0.539	S	S	.	.	H	α-helix	trans	-67.3	-38.7	175.5	-80.1	-64.5	0	0	0	112.6	F666 I667 S674	F666-N670 WeakPolarHBondContact O-CB 2.93Å; F666-N670 PolarHBondContact O-N 3.38Å; F666-N670 VanDerWaalsContact O-N 3.08Å; F666-N670 PolarHBondContact O-ND2 3.43Å; I667-N670 PolarHBondContact O-N 3Å; N670-S674 VanDerWaalsContact O-CB 3.25Å; N670-S674 WeakPolarHBondContact O-CB 2.97Å; N670-S674 PolarHBondContact O-N 3.15Å
671	M	56.9	Low	56.7	Low	120 Å²	120	108.4 Å²	108.4	59%	0.591	55%	0.545	S	S	*	.	H	α-helix	trans	-65.5	-40.7	174.2	-78	-171.6	65.2	0	0	112.3	I667 F668 S674 S675	I667-M671 HydrophobicContact CG2-CG 4.38Å; I667-M671 HydrophobicContact CG2-SD 4.05Å; I667-M671 WeakPolarHBondContact O-CB 3.45Å; I667-M671 WeakPolarHBondContact O-CG 3.06Å; I667-M671 PolarHBondContact O-N 3.38Å; F668-M671 PolarHBondContact O-N 3.41Å; M671-S674 PolarHBondContact O-N 2.91Å; M671-S675 WeakPolarHBondContact O-CB 3.26Å; M671-S675 PolarHBondContact O-N 3.22Å; M671-S675 PolarHBondContact O-OG 2.96Å
672	F	49.8	Very low	55.9	Low	146 Å²	146	109.5 Å²	109.5	64%	0.64	55%	0.549	S	S	*	.	H	α-helix	trans	-66.9	-45.2	177	-120.7	-89.2	0	0	0	111.6	F668 T669 S674 S675 L676	F668-F672 WeakPolarHBondContact O-CB 2.98Å; F668-F672 PolarHBondContact O-N 3.4Å; T669-F672 PolarHBondContact O-N 3.35Å; F672-S674 VanDerWaalsContact C-N 3.34Å; F672-S674 PolarHBondContact O-N 3.29Å; F672-S675 CarbonylContact O-C 3.49Å; F672-S675 PolarHBondContact O-N 3.19Å; F672-S675 VanDerWaalsContact O-N 3.13Å; F672-L676 HydrophobicContact CD1-CD1 4.13Å; F672-L676 PolarHBondContact O-N 3.24Å
673	M	47.2	Very low	55	Low	121 Å²	121	115 Å²	115	60%	0.596	57%	0.574	S	S	*	*	H	α-helix	trans	-62.2	-41.1	175.9	-77.1	-66.1	-160.7	0	0	111.8	T669 S675 L676 L677	T669-M673 WeakPolarHBondContact O-CB 3.1Å; T669-M673 WeakPolarHBondContact O-CG 3.27Å; T669-M673 PolarHBondContact O-N 3.18Å; M673-S675 VanDerWaalsContact C-N 3.27Å; M673-S675 PolarHBondContact O-N 2.91Å; M673-L676 PolarHBondContact O-N 3Å; M673-L677 WeakPolarHBondContact O-CB 3.28Å; M673-L677 WeakPolarHBondContact O-CG 3.45Å; M673-L677 PolarHBondContact O-N 2.97Å
674	S	47.5	Very low	54.2	Low	62 Å²	62	115.6 Å²	115.6	43%	0.434	58%	0.576	S	S	.	*	H	α-helix	trans	-65	-31.3	175.1	-165.5	0	0	0	0	112.5	N670 M671 F672 R678	N670-S674 VanDerWaalsContact O-CB 3.25Å; N670-S674 WeakPolarHBondContact O-CB 2.97Å; N670-S674 PolarHBondContact O-N 3.15Å; M671-S674 PolarHBondContact O-N 2.91Å; F672-S674 VanDerWaalsContact C-N 3.34Å; F672-S674 PolarHBondContact O-N 3.29Å; S674-R678 WeakPolarHBondContact O-CG 3.39Å; S674-R678 PolarHBondContact O-N 2.85Å
675	S	49.4	Very low	53.2	Low	80 Å²	80	118.4 Å²	118.4	56%	0.559	59%	0.588	S	S	*	*	H	α-helix	trans	-80.9	-23.1	175.6	-56.9	0	0	0	0	113.8	M671 F672 M673 R678	M671-S675 WeakPolarHBondContact O-CB 3.26Å; M671-S675 PolarHBondContact O-N 3.22Å; M671-S675 PolarHBondContact O-OG 2.96Å; F672-S675 CarbonylContact O-C 3.49Å; F672-S675 PolarHBondContact O-N 3.19Å; F672-S675 VanDerWaalsContact O-N 3.13Å; M673-S675 VanDerWaalsContact C-N 3.27Å; M673-S675 PolarHBondContact O-N 2.91Å; S675-R678 VanDerWaalsContact O-OXT 3.09Å
676	L	40.8	Very low	52.4	Low	129 Å²	129	118.8 Å²	118.8	68%	0.675	59%	0.588	S	S	*	*	H	α-helix	trans	-84.1	-28.4	173.6	-91.8	154.6	0	0	0	112.6	F672 M673	F672-L676 HydrophobicContact CD1-CD1 4.13Å; F672-L676 PolarHBondContact O-N 3.24Å; M673-L676 PolarHBondContact O-N 3Å
677	L	45.3	Very low	51.5	Low	154 Å²	154	121.9 Å²	121.9	81%	0.806	61%	0.607	S	S	*	*			trans	-82.6	-14	174.9	-79.4	160.5	0	0	0	113.1	M673	M673-L677 WeakPolarHBondContact O-CB 3.28Å; M673-L677 WeakPolarHBondContact O-CG 3.45Å; M673-L677 PolarHBondContact O-N 2.97Å
678	R	38.6	Very low	50.2	Low	264 Å²	264	125.5 Å²	125.5	100%	0.996	62%	0.624	S	S	*	*			trans	-93	0	167.4	-79.5	-177.2	179.6	-167.8	0.9	110	S674 S675	S674-R678 WeakPolarHBondContact O-CG 3.39Å; S674-R678 PolarHBondContact O-N 2.85Å; S675-R678 VanDerWaalsContact O-OXT 3.09Å

Retrieved 678 of 678 residues in 1505.4 ms (Link to these results)

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