A0A077YZS5_TRITR Loading...

PAS 11 and HLH and PAS domain containing protein

AlphaFold DB , UniProt , Accession A0A077YZS5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 409 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	55.4	Low	62.3	Low	217 Å²	217	124.9 Å²	124.9	100%	1.069	65%	0.652	S	S	*	*				0	-33.6	0	-140.7	178.6	-95.5	0	0	113.3	A3	M1-A3 PolarHBondContact O-N 3.39Å
2	L	56.6	Low	63.1	Low	142 Å²	142	119.2 Å²	119.2	74%	0.743	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-65.3	-27.5	179.6	-81.8	150.9	0	0	0	116.4	L4 L5	L2-L4 VanDerWaalsContact C-N 3.29Å; L2-L4 PolarHBondContact O-N 3.47Å; L2-L5 PolarHBondContact O-N 3.4Å
3	A	56.4	Low	63.4	Low	76 Å²	76	117.2 Å²	117.2	63%	0.628	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-66.5	-27.6	-178.5	0	0	0	0	0	113.9	M1 L5 W6	M1-A3 PolarHBondContact O-N 3.39Å; A3-L5 VanDerWaalsContact C-N 3.3Å; A3-L5 PolarHBondContact O-N 3.42Å; A3-W6 PolarHBondContact O-N 3.34Å
4	L	57.1	Low	63.7	Low	127 Å²	127	117 Å²	117	67%	0.665	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-72.8	-21.6	-177.5	-73.8	167.6	0	0	0	113.1	L2 L7 P8	L2-L4 VanDerWaalsContact C-N 3.29Å; L2-L4 PolarHBondContact O-N 3.47Å; L4-L7 HydrophobicContact CD2-CD1 4.46Å; L4-P8 WeakPolarHBondContact O-CD 3.43Å
5	L	58.6	Low	64	Low	129 Å²	129	117.1 Å²	117.1	68%	0.675	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-78.4	-20.5	179.3	-73.8	164.1	0	0	0	113.4	L2 A3	L2-L5 PolarHBondContact O-N 3.4Å; A3-L5 VanDerWaalsContact C-N 3.3Å; A3-L5 PolarHBondContact O-N 3.42Å
6	W	56.8	Low	64.2	Low	198 Å²	198	113 Å²	113	75%	0.75	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-22.5	-178	-79.3	79.3	0	0	0	114.3	A3 N9 L10	A3-W6 PolarHBondContact O-N 3.34Å; W6-N9 PolarHBondContact O-N 3.04Å; W6-L10 PolarHBondContact O-N 3.37Å; W6-L10 VanDerWaalsContact O-N 3.13Å
7	L	64.7	Low	64	Low	89 Å²	89	116 Å²	116	47%	0.466	60%	0.604	S	S	.	*	H	α-helix	trans	-60.3	-46.2	-177.2	-96.4	144.1	0	0	0	114.3	L4 N9 L10 I11	L4-L7 HydrophobicContact CD2-CD1 4.46Å; L7-N9 PolarHBondContact O-N 2.94Å; L7-L10 PolarHBondContact O-N 3.5Å; L7-I11 HydrophobicContact CD2-CD1 4.45Å; L7-I11 WeakPolarHBondContact O-CG1 3.45Å; L7-I11 PolarHBondContact O-N 3.47Å
8	P	68	Low	64.1	Low	81 Å²	81	116.7 Å²	116.7	53%	0.526	60%	0.604	S	S	.	*	H	α-helix	trans	-62.9	-40.9	-179.7	-22.1	33	0	0	0	112.8	L4 L10 I11 A12	L4-P8 WeakPolarHBondContact O-CD 3.43Å; P8-L10 PolarHBondContact O-N 3.42Å; P8-I11 PolarHBondContact O-N 3.13Å; P8-A12 WeakPolarHBondContact O-CB 3.34Å; P8-A12 PolarHBondContact O-N 3.27Å
9	N	69.9	Low	64.2	Low	113 Å²	113	114.9 Å²	114.9	60%	0.604	60%	0.595	S	S	*	*	H	α-helix	trans	-67.4	-35.4	178.1	-79.6	-27.9	0	0	0	112.3	W6 L7 N13	W6-N9 PolarHBondContact O-N 3.04Å; L7-N9 PolarHBondContact O-N 2.94Å; N9-N13 WeakPolarHBondContact O-CB 3.32Å; N9-N13 PolarHBondContact O-N 3.46Å
10	L	69.8	Low	64.1	Low	110 Å²	110	114.8 Å²	114.8	58%	0.576	60%	0.595	S	S	*	*	H	α-helix	trans	-67.6	-42.1	175.4	-169.2	69.7	0	0	0	111.6	W6 L7 P8 N13 Q14	W6-L10 PolarHBondContact O-N 3.37Å; W6-L10 VanDerWaalsContact O-N 3.13Å; L7-L10 PolarHBondContact O-N 3.5Å; P8-L10 PolarHBondContact O-N 3.42Å; L10-N13 PolarHBondContact O-N 2.96Å; L10-Q14 VanDerWaalsContact O-CG 3.32Å; L10-Q14 WeakPolarHBondContact O-CG 3.43Å; L10-Q14 PolarHBondContact O-N 3.01Å
11	I	72.1	Confident	64.1	Low	92 Å²	92	116.7 Å²	116.7	47%	0.472	60%	0.599	S	S	.	*	H	α-helix	trans	-66.2	-43.8	178.2	-67	165.5	0	0	0	110.7	L7 P8 N13 Q14 L15	L7-I11 HydrophobicContact CD2-CD1 4.45Å; L7-I11 WeakPolarHBondContact O-CG1 3.45Å; L7-I11 PolarHBondContact O-N 3.47Å; P8-I11 PolarHBondContact O-N 3.13Å; I11-N13 PolarHBondContact O-N 3.22Å; I11-Q14 PolarHBondContact O-N 3.35Å; I11-L15 HydrophobicContact CG2-CD1 3.78Å; I11-L15 PolarHBondContact O-N 3.18Å
12	A	71.4	Confident	64.5	Low	56 Å²	56	109 Å²	109	46%	0.463	56%	0.564	S	S	.	*	H	α-helix	trans	-61.7	-41.1	175.8	0	0	0	0	0	112.4	P8 Q14 L15 S16	P8-A12 WeakPolarHBondContact O-CB 3.34Å; P8-A12 PolarHBondContact O-N 3.27Å; A12-Q14 VanDerWaalsContact C-N 3.35Å; A12-L15 PolarHBondContact O-N 3.44Å; A12-S16 PolarHBondContact O-N 3.41Å; A12-S16 PolarHBondContact O-OG 3.05Å
13	N	67.7	Low	64.8	Low	93 Å²	93	110.5 Å²	110.5	50%	0.497	56%	0.56	S	S	.	*	H	α-helix	trans	-68.1	-31.2	174.6	-105.3	-19.3	0	0	0	113.2	N9 L10 I11 S16 R17	N9-N13 WeakPolarHBondContact O-CB 3.32Å; N9-N13 PolarHBondContact O-N 3.46Å; L10-N13 PolarHBondContact O-N 2.96Å; I11-N13 PolarHBondContact O-N 3.22Å; N13-S16 PolarHBondContact O-OG 3.17Å; N13-R17 WeakPolarHBondContact O-CB 3.34Å; N13-R17 WeakPolarHBondContact O-CD 3.15Å; N13-R17 WeakPolarHBondContact O-CG 3.4Å; N13-R17 PolarHBondContact O-N 3.01Å
14	Q	67.5	Low	65.5	Low	115 Å²	115	111 Å²	111	54%	0.537	56%	0.555	S	S	.	*	H	α-helix	trans	-71.3	-42.4	174.1	-75.3	-72.8	-0.5	0	0	111.7	L10 I11 A12 R17 H18	L10-Q14 VanDerWaalsContact O-CG 3.32Å; L10-Q14 WeakPolarHBondContact O-CG 3.43Å; L10-Q14 PolarHBondContact O-N 3.01Å; I11-Q14 PolarHBondContact O-N 3.35Å; A12-Q14 VanDerWaalsContact C-N 3.35Å; Q14-R17 PolarHBondContact O-N 3.45Å; Q14-H18 WeakPolarHBondContact O-CB 3.5Å; Q14-H18 PolarHBondContact O-N 2.87Å
15	L	67.3	Low	66.2	Low	118 Å²	118	108 Å²	108	62%	0.618	54%	0.544	S	S	*	.	H	α-helix	trans	-64.5	-43.8	177	-90.1	146.2	0	0	0	112.6	I11 A12 H18 D19	I11-L15 HydrophobicContact CG2-CD1 3.78Å; I11-L15 PolarHBondContact O-N 3.18Å; A12-L15 PolarHBondContact O-N 3.44Å; L15-H18 WeakPolarHBondContact O-CB 3.47Å; L15-H18 PolarHBondContact O-N 2.93Å; L15-D19 PolarHBondContact O-N 3.18Å
16	S	67.6	Low	67.3	Low	52 Å²	52	105 Å²	105	36%	0.364	53%	0.529	S	S	.	.	H	α-helix	trans	-64.7	-40.6	176.9	68.7	0	0	0	0	112.1	A12 N13 H18 D19 L20	A12-S16 PolarHBondContact O-N 3.41Å; A12-S16 PolarHBondContact O-OG 3.05Å; N13-S16 PolarHBondContact O-OG 3.17Å; S16-H18 VanDerWaalsContact C-N 3.3Å; S16-H18 PolarHBondContact O-N 3.45Å; S16-D19 PolarHBondContact O-N 3.05Å; S16-L20 WeakPolarHBondContact O-CB 3.48Å; S16-L20 WeakPolarHBondContact O-CD1 3.31Å; S16-L20 PolarHBondContact O-N 3.4Å
17	R	61.7	Low	68.5	Low	164 Å²	164	101.9 Å²	101.9	62%	0.619	52%	0.523	S	S	*	.	H	α-helix	trans	-62.2	-37.5	172.6	-76.3	175.2	-179	-167.4	0.3	112	N13 Q14 K21	N13-R17 WeakPolarHBondContact O-CB 3.34Å; N13-R17 WeakPolarHBondContact O-CD 3.15Å; N13-R17 WeakPolarHBondContact O-CG 3.4Å; N13-R17 PolarHBondContact O-N 3.01Å; Q14-R17 PolarHBondContact O-N 3.45Å; R17-K21 VanDerWaalsContact O-CB 3.31Å; R17-K21 WeakPolarHBondContact O-CB 3.45Å; R17-K21 PolarHBondContact O-N 2.93Å
18	H	65.8	Low	69.5	Low	129 Å²	129	100.9 Å²	100.9	60%	0.597	52%	0.523	S	S	*	.	H	α-helix	trans	-67.1	-44.8	177.5	-159.2	-87.2	0	0	0	111.6	Q14 L15 S16 K21 V22	Q14-H18 WeakPolarHBondContact O-CB 3.5Å; Q14-H18 PolarHBondContact O-N 2.87Å; L15-H18 WeakPolarHBondContact O-CB 3.47Å; L15-H18 PolarHBondContact O-N 2.93Å; S16-H18 VanDerWaalsContact C-N 3.3Å; S16-H18 PolarHBondContact O-N 3.45Å; H18-K21 WeakPolarHBondContact O-CB 3.42Å; H18-K21 PolarHBondContact O-N 3.25Å; H18-V22 WeakPolarHBondContact O-CG2 3.34Å; H18-V22 PolarHBondContact O-N 3.44Å
19	D	64.9	Low	70.4	Confident	83 Å²	83	103.3 Å²	103.3	44%	0.444	52%	0.522	S	S	.	.	H	α-helix	trans	-69.2	-38	-179.2	-158.8	25.8	0	0	0	112.6	L15 S16 K21 V22 R23	L15-D19 PolarHBondContact O-N 3.18Å; S16-D19 PolarHBondContact O-N 3.05Å; D19-K21 VanDerWaalsContact C-N 3.32Å; D19-K21 PolarHBondContact O-N 2.88Å; D19-V22 PolarHBondContact O-N 3.18Å; D19-R23 WeakPolarHBondContact O-CG 3.46Å; D19-R23 PolarHBondContact O-N 3.05Å; D19-R23 IonicContact OD2-NE 3.64Å
20	L	62.1	Low	71.2	Confident	112 Å²	112	103 Å²	103	59%	0.586	52%	0.519	S	S	*	.	H	α-helix	trans	-60.9	-39.6	169.5	-82.3	155	0	0	0	112	S16 R23 T24	S16-L20 WeakPolarHBondContact O-CB 3.48Å; S16-L20 WeakPolarHBondContact O-CD1 3.31Å; S16-L20 PolarHBondContact O-N 3.4Å; L20-R23 PolarHBondContact O-N 2.93Å; L20-T24 WeakPolarHBondContact O-CB 3.27Å; L20-T24 VanDerWaalsContact O-CG2 3.27Å; L20-T24 WeakPolarHBondContact O-CG2 3.37Å; L20-T24 PolarHBondContact O-N 2.84Å; L20-T24 PolarHBondContact O-OG1 2.73Å
21	K	64.8	Low	72.1	Confident	155 Å²	155	100.3 Å²	100.3	67%	0.674	50%	0.504	S	S	*	.	H	α-helix	trans	-67.9	-36.9	176.2	-160.7	172.9	-176.3	-178.5	0	111.7	R17 H18 D19 T24 S25	R17-K21 VanDerWaalsContact O-CB 3.31Å; R17-K21 WeakPolarHBondContact O-CB 3.45Å; R17-K21 PolarHBondContact O-N 2.93Å; H18-K21 WeakPolarHBondContact O-CB 3.42Å; H18-K21 PolarHBondContact O-N 3.25Å; D19-K21 VanDerWaalsContact C-N 3.32Å; D19-K21 PolarHBondContact O-N 2.88Å; K21-T24 WeakPolarHBondContact CA-OG1 3.42Å; K21-T24 PolarHBondContact O-OG1 3.46Å; K21-T24 VanDerWaalsContact O-OG1 3.05Å; K21-S25 VanDerWaalsContact O-CB 3.23Å; K21-S25 WeakPolarHBondContact O-CB 3.23Å; K21-S25 PolarHBondContact O-N 3.25Å; K21-S25 PolarHBondContact O-OG 3.45Å
22	V	64.2	Low	73	Confident	56 Å²	56	101.8 Å²	101.8	34%	0.339	51%	0.507	S	S	.	.	H	α-helix	trans	-67.2	-46	174.2	173.7	0	0	0	0	111	H18 D19 S25 N26	H18-V22 WeakPolarHBondContact O-CG2 3.34Å; H18-V22 PolarHBondContact O-N 3.44Å; D19-V22 PolarHBondContact O-N 3.18Å; V22-S25 PolarHBondContact O-N 2.91Å; V22-S25 PolarHBondContact O-OG 3.46Å; V22-N26 PolarHBondContact O-N 3.05Å; V22-N26 PolarHBondContact O-ND2 2.92Å
23	R	62.8	Low	74	Confident	173 Å²	173	106 Å²	106	65%	0.653	51%	0.511	S	S	*	.	H	α-helix	trans	-62.5	-44.8	177.1	-71.6	-178.5	-177.9	-163.2	-1	112.6	D19 L20 S25 N26 H27	D19-R23 WeakPolarHBondContact O-CG 3.46Å; D19-R23 PolarHBondContact O-N 3.05Å; D19-R23 IonicContact OD2-NE 3.64Å; L20-R23 PolarHBondContact O-N 2.93Å; R23-S25 VanDerWaalsContact C-N 3.33Å; R23-S25 PolarHBondContact O-N 3.47Å; R23-N26 PolarHBondContact O-N 3.02Å; R23-H27 PolarHBondContact O-N 3.35Å
24	T	70.5	Confident	75.2	Confident	85 Å²	85	107.9 Å²	107.9	52%	0.521	51%	0.511	S	S	.	.	H	α-helix	trans	-66.2	-34.6	175.8	53.6	0	0	0	0	111.7	L20 K21 H27 S28	L20-T24 WeakPolarHBondContact O-CB 3.27Å; L20-T24 VanDerWaalsContact O-CG2 3.27Å; L20-T24 WeakPolarHBondContact O-CG2 3.37Å; L20-T24 PolarHBondContact O-N 2.84Å; L20-T24 PolarHBondContact O-OG1 2.73Å; K21-T24 WeakPolarHBondContact CA-OG1 3.42Å; K21-T24 PolarHBondContact O-OG1 3.46Å; K21-T24 VanDerWaalsContact O-OG1 3.05Å; T24-H27 PolarHBondContact O-N 3.47Å; T24-S28 VanDerWaalsContact O-CB 3.25Å; T24-S28 WeakPolarHBondContact O-CB 3.44Å; T24-S28 PolarHBondContact O-N 3.48Å
25	S	71.7	Confident	76.4	Confident	64 Å²	64	108.2 Å²	108.2	45%	0.448	51%	0.507	S	S	.	.	H	α-helix	trans	-66	-39.8	174.8	80.1	0	0	0	0	112.9	K21 V22 R23 S28 R29	K21-S25 VanDerWaalsContact O-CB 3.23Å; K21-S25 WeakPolarHBondContact O-CB 3.23Å; K21-S25 PolarHBondContact O-N 3.25Å; K21-S25 PolarHBondContact O-OG 3.45Å; V22-S25 PolarHBondContact O-N 2.91Å; V22-S25 PolarHBondContact O-OG 3.46Å; R23-S25 VanDerWaalsContact C-N 3.33Å; R23-S25 PolarHBondContact O-N 3.47Å; S25-S28 PolarHBondContact O-N 3Å; S25-R29 WeakPolarHBondContact O-CB 3.25Å; S25-R29 PolarHBondContact O-N 2.84Å
26	N	80.9	Confident	77.7	Confident	68 Å²	68	106.6 Å²	106.6	36%	0.364	50%	0.499	S	S	.	.	H	α-helix	trans	-66.5	-45.6	175.3	-85.9	-48.1	0	0	0	111.3	V22 R23 S28 R29 I30	V22-N26 PolarHBondContact O-N 3.05Å; V22-N26 PolarHBondContact O-ND2 2.92Å; R23-N26 PolarHBondContact O-N 3.02Å; N26-S28 PolarHBondContact O-N 2.99Å; N26-R29 PolarHBondContact O-N 3.49Å; N26-I30 WeakPolarHBondContact O-CG1 3.32Å; N26-I30 PolarHBondContact O-N 3.21Å
27	H	83.2	Confident	78.9	Confident	132 Å²	132	110.1 Å²	110.1	61%	0.611	51%	0.507	S	S	*	.	H	α-helix	trans	-59.3	-46.7	174.8	-177.2	69.7	0	0	0	111.5	R23 T24 R29 I30 E31	R23-H27 PolarHBondContact O-N 3.35Å; T24-H27 PolarHBondContact O-N 3.47Å; H27-R29 VanDerWaalsContact C-N 3.29Å; H27-R29 PolarHBondContact O-N 2.93Å; H27-I30 PolarHBondContact O-N 2.68Å; H27-E31 WeakPolarHBondContact O-CB 3.38Å; H27-E31 PolarHBondContact O-N 3.24Å
28	S	86.4	Confident	80.3	Confident	67 Å²	67	105.9 Å²	105.9	47%	0.469	50%	0.497	S	S	.	.	H	α-helix	trans	-60.9	-36.2	176.3	-176.8	0	0	0	0	112.6	T24 S25 N26 K32	T24-S28 VanDerWaalsContact O-CB 3.25Å; T24-S28 WeakPolarHBondContact O-CB 3.44Å; T24-S28 PolarHBondContact O-N 3.48Å; S25-S28 PolarHBondContact O-N 3Å; N26-S28 PolarHBondContact O-N 2.99Å; S28-K32 WeakPolarHBondContact O-CB 3.34Å; S28-K32 PolarHBondContact O-N 3.26Å
29	R	85.4	Confident	81.5	Confident	132 Å²	132	102.3 Å²	102.3	50%	0.498	48%	0.482	S	S	.	.	H	α-helix	trans	-71	-40.3	178	-167.9	177.2	73.8	172.7	1	111.9	S25 N26 H27 K32 R33	S25-R29 WeakPolarHBondContact O-CB 3.25Å; S25-R29 PolarHBondContact O-N 2.84Å; N26-R29 PolarHBondContact O-N 3.49Å; H27-R29 VanDerWaalsContact C-N 3.29Å; H27-R29 PolarHBondContact O-N 2.93Å; R29-K32 PolarHBondContact O-N 3.34Å; R29-R33 WeakPolarHBondContact O-CG 3.43Å; R29-R33 PolarHBondContact O-N 2.93Å
30	I	86.8	Confident	82.8	Confident	107 Å²	107	101.1 Å²	101.1	55%	0.549	48%	0.484	S	S	.	.	H	α-helix	trans	-63.6	-46.7	175.3	-67.1	165.6	0	0	0	109.9	N26 H27 K32 R33 R34	N26-I30 WeakPolarHBondContact O-CG1 3.32Å; N26-I30 PolarHBondContact O-N 3.21Å; H27-I30 PolarHBondContact O-N 2.68Å; I30-K32 VanDerWaalsContact C-N 3.32Å; I30-K32 PolarHBondContact O-N 2.79Å; I30-R33 PolarHBondContact O-N 3.4Å; I30-R34 PolarHBondContact O-N 2.96Å
31	E	89.4	Confident	84.2	Confident	54 Å²	54	101.4 Å²	101.4	25%	0.252	48%	0.478	S	S	.	.	H	α-helix	trans	-64.6	-35.8	178	179.1	53.1	-154.2	0	0	112.3	H27 R34 R35	H27-E31 WeakPolarHBondContact O-CB 3.38Å; H27-E31 PolarHBondContact O-N 3.24Å; E31-R34 PolarHBondContact O-N 3.42Å; E31-R34 IonicContact OE1-CZ 2.66Å; E31-R34 IonicContact OE1-NE 2.87Å; E31-R34 PolarHBondContact OE1-NE 3.42Å; E31-R34 IonicContact OE1-NH2 3.55Å; E31-R34 PolarHBondContact OE1-NH2 3.13Å; E31-R34 IonicContact OE2-CZ 2.75Å; E31-R34 IonicContact OE2-NE 3.74Å; E31-R34 PolarHBondContact OE2-NE 3.05Å; E31-R34 IonicContact OE2-NH2 3.98Å; E31-R35 WeakPolarHBondContact O-CG 3.49Å; E31-R35 PolarHBondContact O-N 3.01Å; E31-R35 WeakPolarHBondContact OE1-CG 3.47Å; E31-R35 IonicContact OE1-NE 3.65Å
32	K	91.6	Very high	85.4	Confident	123 Å²	123	95.1 Å²	95.1	54%	0.535	45%	0.451	S	S	.	.	H	α-helix	trans	-61.1	-50.5	171.7	-172.4	176.4	178.4	-178.6	0	111.6	S28 R29 I30 R34 R35 D36	S28-K32 WeakPolarHBondContact O-CB 3.34Å; S28-K32 PolarHBondContact O-N 3.26Å; R29-K32 PolarHBondContact O-N 3.34Å; I30-K32 VanDerWaalsContact C-N 3.32Å; I30-K32 PolarHBondContact O-N 2.79Å; K32-R34 VanDerWaalsContact C-N 3.29Å; K32-R34 PolarHBondContact O-N 2.9Å; K32-R35 PolarHBondContact O-N 2.97Å; K32-R35 VanDerWaalsContact O-N 3.13Å; K32-D36 VanDerWaalsContact O-CG 3.23Å; K32-D36 PolarHBondContact O-N 3.44Å
33	R	91.9	Very high	86.5	Confident	145 Å²	145	96.2 Å²	96.2	55%	0.547	46%	0.459	S	S	.	.	H	α-helix	trans	-58.8	-39.7	176.8	-70.5	178.9	-170.7	163	-1.3	112.6	R29 I30 D36 K37	R29-R33 WeakPolarHBondContact O-CG 3.43Å; R29-R33 PolarHBondContact O-N 2.93Å; I30-R33 PolarHBondContact O-N 3.4Å; R33-D36 PolarHBondContact O-N 2.68Å; R33-K37 WeakPolarHBondContact O-CB 3.47Å; R33-K37 PolarHBondContact O-N 3.19Å
34	R	93.6	Very high	87.8	Confident	132 Å²	132	93.2 Å²	93.2	50%	0.498	45%	0.452	S	S	.	.	H	α-helix	trans	-61.8	-44.6	176	-167.9	-166.1	69.5	78.1	0.8	111.5	I30 E31 K32 L38	I30-R34 PolarHBondContact O-N 2.96Å; E31-R34 PolarHBondContact O-N 3.42Å; E31-R34 IonicContact OE1-CZ 2.66Å; E31-R34 IonicContact OE1-NE 2.87Å; E31-R34 PolarHBondContact OE1-NE 3.42Å; E31-R34 IonicContact OE1-NH2 3.55Å; E31-R34 PolarHBondContact OE1-NH2 3.13Å; E31-R34 IonicContact OE2-CZ 2.75Å; E31-R34 IonicContact OE2-NE 3.74Å; E31-R34 PolarHBondContact OE2-NE 3.05Å; E31-R34 IonicContact OE2-NH2 3.98Å; K32-R34 VanDerWaalsContact C-N 3.29Å; K32-R34 PolarHBondContact O-N 2.9Å; R34-L38 WeakPolarHBondContact O-CB 3.39Å; R34-L38 PolarHBondContact O-N 3.46Å
35	R	92.5	Very high	88.6	Confident	122 Å²	122	91.8 Å²	91.8	46%	0.46	44%	0.441	S	S	.	.	H	α-helix	trans	-66	-42.2	176.7	-73	-175.1	-65.7	-165.2	-1.1	112.4	E31 K32 L38 N39	E31-R35 WeakPolarHBondContact O-CG 3.49Å; E31-R35 PolarHBondContact O-N 3.01Å; E31-R35 WeakPolarHBondContact OE1-CG 3.47Å; E31-R35 IonicContact OE1-NE 3.65Å; K32-R35 PolarHBondContact O-N 2.97Å; K32-R35 VanDerWaalsContact O-N 3.13Å; R35-L38 PolarHBondContact O-N 3.33Å; R35-N39 WeakPolarHBondContact O-CB 3.39Å; R35-N39 PolarHBondContact O-N 3.43Å; R35-N39 PolarHBondContact O-ND2 2.9Å; R35-N39 PolarHBondContact O-OD1 2.96Å
36	D	93	Very high	89.3	Confident	83 Å²	83	89.9 Å²	89.9	44%	0.444	43%	0.427	S	S	.	.	H	α-helix	trans	-64	-42.5	178.2	-63.1	-21.8	0	0	0	110.8	K32 R33 N39 A40	K32-D36 VanDerWaalsContact O-CG 3.23Å; K32-D36 PolarHBondContact O-N 3.44Å; R33-D36 PolarHBondContact O-N 2.68Å; D36-N39 PolarHBondContact O-N 3.2Å; D36-A40 PolarHBondContact O-N 3.27Å
37	K	93.4	Very high	89.6	Confident	126 Å²	126	91.4 Å²	91.4	55%	0.548	44%	0.435	S	S	.	.	H	α-helix	trans	-63.3	-42.7	174.1	-173	172.9	-179	177.7	0	112.5	R33 N39 A40 Y41	R33-K37 WeakPolarHBondContact O-CB 3.47Å; R33-K37 PolarHBondContact O-N 3.19Å; K37-N39 VanDerWaalsContact C-N 3.35Å; K37-A40 WeakPolarHBondContact O-CB 3.41Å; K37-A40 PolarHBondContact O-N 3.46Å; K37-Y41 HydrophobicContact CD-CE2 4.24Å; K37-Y41 WeakPolarHBondContact CE-OH 3.35Å; K37-Y41 HydrophobicContact CG-CD2 4.32Å; K37-Y41 HydrophobicContact CG-CE2 3.75Å; K37-Y41 WeakPolarHBondContact O-CD2 3.43Å; K37-Y41 PolarHBondContact O-N 2.87Å; K37-Y41 VanDerWaalsContact O-N 3.13Å
38	L	91.7	Very high	89.6	Confident	76 Å²	76	91.2 Å²	91.2	40%	0.398	44%	0.438	S	S	.	.	H	α-helix	trans	-63.2	-41.6	175	-178	146.9	0	0	0	111.4	R34 R35 A40 Y41 I42	R34-L38 WeakPolarHBondContact O-CB 3.39Å; R34-L38 PolarHBondContact O-N 3.46Å; R35-L38 PolarHBondContact O-N 3.33Å; L38-A40 VanDerWaalsContact C-N 3.32Å; L38-A40 PolarHBondContact O-N 3.32Å; L38-Y41 PolarHBondContact O-N 2.92Å; L38-I42 HydrophobicContact CD2-CG1 4.04Å; L38-I42 WeakPolarHBondContact O-CG1 3.23Å; L38-I42 PolarHBondContact O-N 3.49Å
39	N	91.2	Very high	89.5	Confident	53 Å²	53	88.5 Å²	88.5	28%	0.283	42%	0.419	S	S	.	.	H	α-helix	trans	-63.2	-39.6	177.1	-65.7	-24.6	0	0	0	111.5	R35 D36 K37 I42 T43 K61	R35-N39 WeakPolarHBondContact O-CB 3.39Å; R35-N39 PolarHBondContact O-N 3.43Å; R35-N39 PolarHBondContact O-ND2 2.9Å; R35-N39 PolarHBondContact O-OD1 2.96Å; D36-N39 PolarHBondContact O-N 3.2Å; K37-N39 VanDerWaalsContact C-N 3.35Å; N39-I42 PolarHBondContact O-N 3.23Å; N39-T43 PolarHBondContact O-N 3.18Å; N39-T43 PolarHBondContact O-OG1 3.02Å; N39-K61 WeakPolarHBondContact OD1-CE 3.35Å; N39-K61 PolarHBondContact OD1-NZ 2.99Å
40	A	91	Very high	89.2	Confident	59 Å²	59	86.3 Å²	86.3	49%	0.488	42%	0.421	S	S	.	.	H	α-helix	trans	-59.4	-45.6	174.3	0	0	0	0	0	111.8	D36 K37 L38 I42 T43 E44	D36-A40 PolarHBondContact O-N 3.27Å; K37-A40 WeakPolarHBondContact O-CB 3.41Å; K37-A40 PolarHBondContact O-N 3.46Å; L38-A40 VanDerWaalsContact C-N 3.32Å; L38-A40 PolarHBondContact O-N 3.32Å; A40-I42 VanDerWaalsContact C-N 3.34Å; A40-I42 PolarHBondContact O-N 3.34Å; A40-T43 PolarHBondContact O-N 2.98Å; A40-E44 PolarHBondContact O-N 3.3Å
41	Y	92.6	Very high	88.5	Confident	118 Å²	118	84.2 Å²	84.2	46%	0.463	43%	0.427	S	S	.	.	H	α-helix	trans	-63.7	-36.1	175.2	-66.8	-41.4	0	0	0	113.3	K37 L38 T43 E44 I45	K37-Y41 HydrophobicContact CD-CE2 4.24Å; K37-Y41 WeakPolarHBondContact CE-OH 3.35Å; K37-Y41 HydrophobicContact CG-CD2 4.32Å; K37-Y41 HydrophobicContact CG-CE2 3.75Å; K37-Y41 WeakPolarHBondContact O-CD2 3.43Å; K37-Y41 PolarHBondContact O-N 2.87Å; K37-Y41 VanDerWaalsContact O-N 3.13Å; L38-Y41 PolarHBondContact O-N 2.92Å; Y41-T43 VanDerWaalsContact C-N 3.33Å; Y41-E44 PolarHBondContact O-N 3.13Å; Y41-I45 WeakPolarHBondContact O-CB 3.27Å; Y41-I45 WeakPolarHBondContact O-CD1 3.35Å; Y41-I45 WeakPolarHBondContact O-CG1 3.33Å; Y41-I45 PolarHBondContact O-N 3.38Å
42	I	89.6	Confident	87.5	Confident	22 Å²	22	82.2 Å²	82.2	11%	0.113	42%	0.418	C	S	.	.	H	α-helix	trans	-66	-38.5	175.9	-65.8	-67.2	0	0	0	111	L38 N39 A40 S46 K61 V64 L65	L38-I42 HydrophobicContact CD2-CG1 4.04Å; L38-I42 WeakPolarHBondContact O-CG1 3.23Å; L38-I42 PolarHBondContact O-N 3.49Å; N39-I42 PolarHBondContact O-N 3.23Å; A40-I42 VanDerWaalsContact C-N 3.34Å; A40-I42 PolarHBondContact O-N 3.34Å; I42-S46 WeakPolarHBondContact O-CB 3.37Å; I42-S46 PolarHBondContact O-N 3.19Å; I42-K61 HydrophobicContact CG2-CG 4.35Å; I42-V64 HydrophobicContact CG2-CB 4.31Å; I42-V64 HydrophobicContact CG2-CG1 4.19Å; I42-L65 HydrophobicContact CD1-CD1 4.12Å; I42-L65 HydrophobicContact CD1-CD2 3.67Å; I42-L65 HydrophobicContact CD1-CG 3.83Å
43	T	87.5	Confident	86.1	Confident	80 Å²	80	79.1 Å²	79.1	49%	0.491	41%	0.412	S	S	.	.	H	α-helix	trans	-64.8	-46	174.3	-57.8	0	0	0	0	111.3	N39 A40 Y41 I45 S46 D47	N39-T43 PolarHBondContact O-N 3.18Å; N39-T43 PolarHBondContact O-OG1 3.02Å; A40-T43 PolarHBondContact O-N 2.98Å; Y41-T43 VanDerWaalsContact C-N 3.33Å; T43-I45 PolarHBondContact O-N 2.88Å; T43-S46 WeakPolarHBondContact CA-OG 3.34Å; T43-S46 WeakPolarHBondContact O-CA 3.49Å; T43-S46 WeakPolarHBondContact O-CB 3.4Å; T43-S46 PolarHBondContact O-N 3.02Å; T43-S46 PolarHBondContact O-OG 3.18Å; T43-D47 PolarHBondContact O-N 3.49Å
44	E	89.3	Confident	84.5	Confident	109 Å²	109	76.2 Å²	76.2	51%	0.509	41%	0.411	S	S	.	.	H	α-helix	trans	-59.1	-44.3	176.1	-171.8	179.8	-176.8	0	0	112	A40 Y41 S46 D47 L48	A40-E44 PolarHBondContact O-N 3.3Å; Y41-E44 PolarHBondContact O-N 3.13Å; E44-S46 VanDerWaalsContact C-N 3.31Å; E44-S46 PolarHBondContact O-N 2.9Å; E44-D47 PolarHBondContact O-N 3.4Å; E44-L48 WeakPolarHBondContact O-CG 2.93Å; E44-L48 PolarHBondContact O-N 2.87Å
45	I	88.8	Confident	82.8	Confident	56 Å²	56	78.4 Å²	78.4	29%	0.287	43%	0.426	S	S	.	.	H	α-helix	trans	-62.4	-39.7	174.1	-68	164.9	0	0	0	111	Y41 T43 D47 L48 V49 V64 A68	Y41-I45 WeakPolarHBondContact O-CB 3.27Å; Y41-I45 WeakPolarHBondContact O-CD1 3.35Å; Y41-I45 WeakPolarHBondContact O-CG1 3.33Å; Y41-I45 PolarHBondContact O-N 3.38Å; T43-I45 PolarHBondContact O-N 2.88Å; I45-D47 PolarHBondContact O-N 2.89Å; I45-L48 PolarHBondContact O-N 2.85Å; I45-V49 HydrophobicContact CG2-CG2 3.95Å; I45-V49 VanDerWaalsContact O-CG2 3.24Å; I45-V49 WeakPolarHBondContact O-CG2 3.48Å; I45-V49 PolarHBondContact O-N 3.49Å; I45-V49 VanDerWaalsContact O-N 3.1Å; I45-V64 HydrophobicContact CB-CG1 4.46Å; I45-V64 HydrophobicContact CG2-CG1 3.99Å; I45-A68 HydrophobicContact CG2-CB 3.64Å
46	S	86.3	Confident	81.1	Confident	23 Å²	23	75 Å²	75	16%	0.161	42%	0.422	C	S	.	.	H	α-helix	trans	-64.2	-29.8	178.3	73.6	0	0	0	0	112.6	I42 T43 E44 C52 S53	I42-S46 WeakPolarHBondContact O-CB 3.37Å; I42-S46 PolarHBondContact O-N 3.19Å; T43-S46 WeakPolarHBondContact CA-OG 3.34Å; T43-S46 WeakPolarHBondContact O-CA 3.49Å; T43-S46 WeakPolarHBondContact O-CB 3.4Å; T43-S46 PolarHBondContact O-N 3.02Å; T43-S46 PolarHBondContact O-OG 3.18Å; E44-S46 VanDerWaalsContact C-N 3.31Å; E44-S46 PolarHBondContact O-N 2.9Å; S46-C52 WeakPolarHBondContact O-CB 3.49Å; S46-S53 WeakPolarHBondContact O-CB 3.39Å
47	D	85.2	Confident	79.7	Confident	100 Å²	100	76.6 Å²	76.6	54%	0.535	44%	0.437	S	S	.	.	H	α-helix	trans	-73.6	-35.6	176.8	-64.5	-24.3	0	0	0	111.9	T43 E44 I45 S53	T43-D47 PolarHBondContact O-N 3.49Å; E44-D47 PolarHBondContact O-N 3.4Å; I45-D47 PolarHBondContact O-N 2.89Å; D47-S53 WeakPolarHBondContact O-CB 3.43Å; D47-S53 PolarHBondContact O-OG 2.97Å
48	L	85.3	Confident	78.4	Confident	129 Å²	129	82.7 Å²	82.7	68%	0.675	46%	0.456	S	S	*	.	H	α-helix	trans	-80.9	-24.7	-177.8	-65.1	173.6	0	0	0	114.6	E44 I45	E44-L48 WeakPolarHBondContact O-CG 2.93Å; E44-L48 PolarHBondContact O-N 2.87Å; I45-L48 PolarHBondContact O-N 2.85Å
49	V	83.5	Confident	77.5	Confident	9 Å²	9	81.8 Å²	81.8	6%	0.055	45%	0.451	C	S	.	.	S	Bend	trans	-88.2	122.3	-174.6	176	0	0	0	0	110.7	I45 G51 C52 L67 A68 H71	I45-V49 HydrophobicContact CG2-CG2 3.95Å; I45-V49 VanDerWaalsContact O-CG2 3.24Å; I45-V49 WeakPolarHBondContact O-CG2 3.48Å; I45-V49 PolarHBondContact O-N 3.49Å; I45-V49 VanDerWaalsContact O-N 3.1Å; V49-G51 PolarHBondContact O-N 3.23Å; V49-C52 PolarHBondContact O-N 3.44Å; V49-C52 VanDerWaalsContact O-N 3.17Å; V49-L67 HydrophobicContact CG1-CB 4Å; V49-A68 HydrophobicContact CG2-CB 3.72Å; V49-H71 HydrophobicContact CG1-CB 4.24Å
50	P	78.1	Confident	77.1	Confident	86 Å²	86	83.9 Å²	83.9	56%	0.558	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	128.7	175.1	-22.2	31.7	0	0	0	111	H71	P50-H71 WeakPolarHBondContact CD-CE1 3.39Å; P50-H71 WeakPolarHBondContact CD-NE2 3.31Å; P50-H71 VanDerWaalsContact CG-NE2 3.31Å; P50-H71 WeakPolarHBondContact CG-NE2 3.36Å
51	G	72.6	Confident	76.8	Confident	64 Å²	64	85.9 Å²	85.9	66%	0.66	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.5	-13.4	-179.3	0	0	0	0	0	115.2	V49	V49-G51 PolarHBondContact O-N 3.23Å
52	C	69.6	Low	76.6	Confident	11 Å²	11	85.2 Å²	85.2	7%	0.074	46%	0.464	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.2	-32.4	178	-71	0	0	0	0	113.5	S46 V49 L59 L67	S46-C52 WeakPolarHBondContact O-CB 3.49Å; V49-C52 PolarHBondContact O-N 3.44Å; V49-C52 VanDerWaalsContact O-N 3.17Å; C52-L59 HydrophobicContact CB-CD1 3.94Å; C52-L67 WeakPolarHBondContact SG-CD1 3.24Å
53	S	61.5	Low	76.5	Confident	58 Å²	58	86.6 Å²	86.6	41%	0.406	47%	0.473	S	S	.	.	S	Bend	trans	-99.1	2.3	-154.6	56.3	0	0	0	0	118.6	S46 D47	S46-S53 WeakPolarHBondContact O-CB 3.39Å; D47-S53 WeakPolarHBondContact O-CB 3.43Å; D47-S53 PolarHBondContact O-OG 2.97Å
54	T	57.7	Low	76.5	Confident	85 Å²	85	83 Å²	83	52%	0.521	45%	0.451	S	S	.	.	S	Bend	trans	-127	-9.5	-167.7	40.7	0	0	0	0	119	K260	T54-K260 PolarHBondContact OG1-NZ 2.92Å
55	Q	58.4	Low	76.6	Confident	177 Å²	177	81.7 Å²	81.7	83%	0.827	45%	0.447	S	S	*	.	S	Bend	trans	-174.4	10.2	177.7	-107	147.7	34.1	0	0	115.8
56	S	57.2	Low	76.6	Confident	51 Å²	51	87 Å²	87	36%	0.357	46%	0.464	S	S	.	.			trans	-94.2	141.7	-175.6	70.6	0	0	0	0	112.1	R58 L59	S56-R58 PolarHBondContact O-N 3.4Å; S56-L59 WeakPolarHBondContact OG-CG 3.21Å
57	P	62.4	Low	76.7	Confident	117 Å²	117	88.3 Å²	88.3	76%	0.76	47%	0.469	S	S	*	.	S	Bend	trans	-57	139.3	170.8	23.8	-31.8	0	0	0	109.1	L59	P57-L59 PolarHBondContact O-N 2.92Å
58	R	66.4	Low	76.9	Confident	253 Å²	253	84.1 Å²	84.1	96%	0.955	45%	0.448	S	S	*	.			trans	-28.4	99.8	-176.3	-73.6	-178.7	176.3	153.6	-0.1	111.7	S56	S56-R58 PolarHBondContact O-N 3.4Å
59	L	73.1	Confident	77	Confident	58 Å²	58	82.4 Å²	82.4	30%	0.304	44%	0.439	S	S	.	.			trans	-62	143.8	-177.3	-71	168.8	0	0	0	109.8	C52 S56 P57 T63 V64 L67	C52-L59 HydrophobicContact CB-CD1 3.94Å; S56-L59 WeakPolarHBondContact OG-CG 3.21Å; P57-L59 PolarHBondContact O-N 2.92Å; L59-T63 HydrophobicContact CD2-CG2 4.34Å; L59-V64 HydrophobicContact CB-CG2 3.76Å; L59-V64 HydrophobicContact CD1-CG2 4.48Å; L59-L67 HydrophobicContact CD1-CD1 4.37Å
60	D	82.6	Confident	77.2	Confident	96 Å²	96	87.8 Å²	87.8	51%	0.513	46%	0.464	S	S	.	.			trans	-60.2	143.7	173	-178.2	32.4	0	0	0	110.1	L62 T63 V64	D60-L62 PolarHBondContact O-N 3.04Å; D60-T63 WeakPolarHBondContact O-CA 3.47Å; D60-T63 WeakPolarHBondContact O-CB 3.45Å; D60-T63 PolarHBondContact O-N 3.42Å; D60-V64 PolarHBondContact O-N 3.03Å
61	K	85.5	Confident	77.4	Confident	102 Å²	102	86.2 Å²	86.2	44%	0.443	45%	0.449	S	S	.	.	H	α-helix	trans	-58.4	-36.3	-175.8	-60.9	-176.8	-172.5	177.5	0	111.4	N39 I42 T63 L65	N39-K61 WeakPolarHBondContact OD1-CE 3.35Å; N39-K61 PolarHBondContact OD1-NZ 2.99Å; I42-K61 HydrophobicContact CG2-CG 4.35Å; K61-T63 VanDerWaalsContact C-N 3.34Å; K61-L65 WeakPolarHBondContact O-CG 3.29Å; K61-L65 PolarHBondContact O-N 2.66Å
62	L	88.1	Confident	78	Confident	103 Å²	103	87.7 Å²	87.7	54%	0.539	44%	0.441	S	S	.	.	H	α-helix	trans	-66.8	-36.5	175.5	-70.5	176.4	0	0	0	111.9	D60 L65 R66	D60-L62 PolarHBondContact O-N 3.04Å; L62-L65 PolarHBondContact O-N 2.83Å; L62-R66 WeakPolarHBondContact O-CB 3.48Å; L62-R66 VanDerWaalsContact O-CG 3.23Å; L62-R66 WeakPolarHBondContact O-CG 3.49Å; L62-R66 PolarHBondContact O-N 3.42Å
63	T	87.4	Confident	78.6	Confident	51 Å²	51	92.9 Å²	92.9	31%	0.313	46%	0.462	S	S	.	.	H	α-helix	trans	-68.1	-44.3	177.8	-55.5	0	0	0	0	111.3	L59 D60 K61 L65 R66 L67	L59-T63 HydrophobicContact CD2-CG2 4.34Å; D60-T63 WeakPolarHBondContact O-CA 3.47Å; D60-T63 WeakPolarHBondContact O-CB 3.45Å; D60-T63 PolarHBondContact O-N 3.42Å; K61-T63 VanDerWaalsContact C-N 3.34Å; T63-L65 VanDerWaalsContact C-N 3.32Å; T63-L65 PolarHBondContact O-N 3.46Å; T63-R66 PolarHBondContact O-N 3.1Å; T63-L67 HydrophobicContact CG2-CD1 4.06Å; T63-L67 HydrophobicContact CG2-CG 4.4Å; T63-L67 WeakPolarHBondContact O-CG 3.44Å; T63-L67 PolarHBondContact O-N 2.79Å
64	V	87.9	Confident	79.2	Confident	4 Å²	4	96.3 Å²	96.3	2%	0.024	47%	0.469	C	S	.	.	H	α-helix	trans	-56.8	-47.1	174.8	176.4	0	0	0	0	110.8	I42 I45 L59 D60 R66 L67 A68	I42-V64 HydrophobicContact CG2-CB 4.31Å; I42-V64 HydrophobicContact CG2-CG1 4.19Å; I45-V64 HydrophobicContact CB-CG1 4.46Å; I45-V64 HydrophobicContact CG2-CG1 3.99Å; L59-V64 HydrophobicContact CB-CG2 3.76Å; L59-V64 HydrophobicContact CD1-CG2 4.48Å; D60-V64 PolarHBondContact O-N 3.03Å; V64-R66 PolarHBondContact O-N 3.26Å; V64-L67 PolarHBondContact O-N 2.85Å; V64-A68 WeakPolarHBondContact O-CB 3.43Å; V64-A68 PolarHBondContact O-N 3.25Å
65	L	90.7	Very high	79.7	Confident	82 Å²	82	96.8 Å²	96.8	43%	0.429	46%	0.464	S	S	.	.	H	α-helix	trans	-65.6	-37.6	178.1	-70.5	173.8	0	0	0	112.9	I42 K61 L62 T63 L69	I42-L65 HydrophobicContact CD1-CD1 4.12Å; I42-L65 HydrophobicContact CD1-CD2 3.67Å; I42-L65 HydrophobicContact CD1-CG 3.83Å; K61-L65 WeakPolarHBondContact O-CG 3.29Å; K61-L65 PolarHBondContact O-N 2.66Å; L62-L65 PolarHBondContact O-N 2.83Å; T63-L65 VanDerWaalsContact C-N 3.32Å; T63-L65 PolarHBondContact O-N 3.46Å; L65-L69 VanDerWaalsContact O-CB 3.27Å; L65-L69 WeakPolarHBondContact O-CB 3Å; L65-L69 PolarHBondContact O-N 3.35Å
66	R	89.1	Confident	80.2	Confident	167 Å²	167	94.9 Å²	94.9	63%	0.63	46%	0.459	S	S	*	.	H	α-helix	trans	-63.8	-46	175.1	-78.1	171.9	178.5	179.6	0.5	111.5	L62 T63 V64 L69 Q70	L62-R66 WeakPolarHBondContact O-CB 3.48Å; L62-R66 VanDerWaalsContact O-CG 3.23Å; L62-R66 WeakPolarHBondContact O-CG 3.49Å; L62-R66 PolarHBondContact O-N 3.42Å; T63-R66 PolarHBondContact O-N 3.1Å; V64-R66 PolarHBondContact O-N 3.26Å; R66-L69 PolarHBondContact O-N 3.38Å; R66-Q70 WeakPolarHBondContact O-CB 3.25Å; R66-Q70 WeakPolarHBondContact O-CG 3.45Å; R66-Q70 PolarHBondContact O-N 3.35Å
67	L	88.1	Confident	80.5	Confident	52 Å²	52	98 Å²	98	27%	0.272	48%	0.476	S	S	.	.	H	α-helix	trans	-65.2	-42.3	177.4	-70.3	172.7	0	0	0	111.2	V49 C52 L59 T63 V64 L69 Q70 H71	V49-L67 HydrophobicContact CG1-CB 4Å; C52-L67 WeakPolarHBondContact SG-CD1 3.24Å; L59-L67 HydrophobicContact CD1-CD1 4.37Å; T63-L67 HydrophobicContact CG2-CD1 4.06Å; T63-L67 HydrophobicContact CG2-CG 4.4Å; T63-L67 WeakPolarHBondContact O-CG 3.44Å; T63-L67 PolarHBondContact O-N 2.79Å; V64-L67 PolarHBondContact O-N 2.85Å; L67-L69 PolarHBondContact O-N 2.83Å; L67-Q70 PolarHBondContact O-N 3.2Å; L67-H71 WeakPolarHBondContact O-CB 3.2Å; L67-H71 PolarHBondContact O-N 2.82Å
68	A	89.9	Confident	80.2	Confident	11 Å²	11	95 Å²	95	9%	0.091	46%	0.462	C	S	.	.	H	α-helix	trans	-59.8	-44.8	174	0	0	0	0	0	111.9	I45 V49 V64 H71 I72	I45-A68 HydrophobicContact CG2-CB 3.64Å; V49-A68 HydrophobicContact CG2-CB 3.72Å; V64-A68 WeakPolarHBondContact O-CB 3.43Å; V64-A68 PolarHBondContact O-N 3.25Å; A68-H71 WeakPolarHBondContact O-CB 3.44Å; A68-H71 PolarHBondContact O-N 2.76Å; A68-I72 VanDerWaalsContact O-CG1 3.29Å; A68-I72 WeakPolarHBondContact O-CG1 3.39Å; A68-I72 PolarHBondContact O-N 3.28Å
69	L	88.2	Confident	79.6	Confident	94 Å²	94	86.1 Å²	86.1	49%	0.492	43%	0.433	S	S	.	.	H	α-helix	trans	-67	-37.3	178	-176.3	133.6	0	0	0	111.9	L65 R66 L67 K73	L65-L69 VanDerWaalsContact O-CB 3.27Å; L65-L69 WeakPolarHBondContact O-CB 3Å; L65-L69 PolarHBondContact O-N 3.35Å; R66-L69 PolarHBondContact O-N 3.38Å; L67-L69 PolarHBondContact O-N 2.83Å; L69-K73 HydrophobicContact CD2-CD 3.77Å; L69-K73 HydrophobicContact CD2-CG 4.37Å; L69-K73 HydrophobicContact CG-CD 4.5Å; L69-K73 WeakPolarHBondContact O-CB 3.45Å; L69-K73 VanDerWaalsContact O-CG 3.25Å; L69-K73 WeakPolarHBondContact O-CG 3.39Å; L69-K73 PolarHBondContact O-N 3.42Å
70	Q	86.1	Confident	78.5	Confident	122 Å²	122	94.1 Å²	94.1	57%	0.57	46%	0.459	S	S	*	.	H	α-helix	trans	-64.2	-42.1	171.5	-76.4	176.6	-17.1	0	0	111.6	R66 L67 K73 K74	R66-Q70 WeakPolarHBondContact O-CB 3.25Å; R66-Q70 WeakPolarHBondContact O-CG 3.45Å; R66-Q70 PolarHBondContact O-N 3.35Å; L67-Q70 PolarHBondContact O-N 3.2Å; Q70-K73 PolarHBondContact O-N 3.2Å; Q70-K74 WeakPolarHBondContact O-CB 3.34Å; Q70-K74 PolarHBondContact O-N 3.1Å
71	H	82.7	Confident	77.1	Confident	53 Å²	53	91.9 Å²	91.9	25%	0.245	45%	0.445	C	S	.	.	H	α-helix	trans	-61.8	-49.4	176.4	-172	-127	0	0	0	111.4	V49 P50 L67 A68 K74 F75	V49-H71 HydrophobicContact CG1-CB 4.24Å; P50-H71 WeakPolarHBondContact CD-CE1 3.39Å; P50-H71 WeakPolarHBondContact CD-NE2 3.31Å; P50-H71 VanDerWaalsContact CG-NE2 3.31Å; P50-H71 WeakPolarHBondContact CG-NE2 3.36Å; L67-H71 WeakPolarHBondContact O-CB 3.2Å; L67-H71 PolarHBondContact O-N 2.82Å; A68-H71 WeakPolarHBondContact O-CB 3.44Å; A68-H71 PolarHBondContact O-N 2.76Å; H71-K74 VanDerWaalsContact O-CB 3.3Å; H71-K74 WeakPolarHBondContact O-CB 3.07Å; H71-K74 PolarHBondContact O-N 3.34Å; H71-F75 AromaticContact CD2-CE2 3.67Å; H71-F75 AromaticContact CE1-CE2 3.39Å; H71-F75 WeakPolarHBondContact CE1-CE2 3.47Å; H71-F75 AromaticContact CE1-CZ 3.99Å; H71-F75 AromaticContact CG-CE2 3.92Å; H71-F75 AromaticContact ND1-CE2 3.74Å; H71-F75 AromaticContact NE2-CE2 3.31Å; H71-F75 VanDerWaalsContact NE2-CE2 3.31Å; H71-F75 WeakPolarHBondContact NE2-CE2 2.9Å; H71-F75 AromaticContact NE2-CZ 3.69Å; H71-F75 WeakPolarHBondContact O-CD2 3.36Å; H71-F75 PolarHBondContact O-N 3.43Å
72	I	85	Confident	75.4	Confident	95 Å²	95	92.9 Å²	92.9	49%	0.487	45%	0.447	S	S	.	.	H	α-helix	trans	-62.7	-45.7	175.8	-66.6	164.4	0	0	0	110.9	A68 K74 F75 L76	A68-I72 VanDerWaalsContact O-CG1 3.29Å; A68-I72 WeakPolarHBondContact O-CG1 3.39Å; A68-I72 PolarHBondContact O-N 3.28Å; I72-K74 VanDerWaalsContact C-N 3.25Å; I72-K74 PolarHBondContact O-N 3.17Å; I72-F75 PolarHBondContact O-N 3.23Å; I72-F75 VanDerWaalsContact O-N 3.1Å; I72-L76 HydrophobicContact CG2-CD1 3.68Å; I72-L76 HydrophobicContact CG2-CG 4.15Å; I72-L76 WeakPolarHBondContact O-CG 3.41Å; I72-L76 PolarHBondContact O-N 3.44Å
73	K	82	Confident	73.5	Confident	120 Å²	120	95.6 Å²	95.6	52%	0.522	45%	0.454	S	S	.	.	H	α-helix	trans	-57	-42.5	175.4	-83.3	-176.9	174.6	-179.2	0	110.8	L69 Q70 F75 L76 T77	L69-K73 HydrophobicContact CD2-CD 3.77Å; L69-K73 HydrophobicContact CD2-CG 4.37Å; L69-K73 HydrophobicContact CG-CD 4.5Å; L69-K73 WeakPolarHBondContact O-CB 3.45Å; L69-K73 VanDerWaalsContact O-CG 3.25Å; L69-K73 WeakPolarHBondContact O-CG 3.39Å; L69-K73 PolarHBondContact O-N 3.42Å; Q70-K73 PolarHBondContact O-N 3.2Å; K73-F75 VanDerWaalsContact C-N 3.32Å; K73-F75 PolarHBondContact O-N 2.91Å; K73-L76 CarbonylContact O-C 3.58Å; K73-L76 PolarHBondContact O-N 2.84Å; K73-L76 VanDerWaalsContact O-N 3.09Å; K73-T77 WeakPolarHBondContact O-CB 3.3Å; K73-T77 PolarHBondContact O-N 3.09Å; K73-T77 PolarHBondContact O-OG1 3.28Å
74	K	75.2	Confident	71.7	Confident	129 Å²	129	97.2 Å²	97.2	56%	0.561	47%	0.467	S	S	*	.	H	α-helix	trans	-54.6	-47.9	175.7	-170.6	-179.5	178	-177.7	0	110.6	Q70 H71 I72 A78	Q70-K74 WeakPolarHBondContact O-CB 3.34Å; Q70-K74 PolarHBondContact O-N 3.1Å; H71-K74 VanDerWaalsContact O-CB 3.3Å; H71-K74 WeakPolarHBondContact O-CB 3.07Å; H71-K74 PolarHBondContact O-N 3.34Å; I72-K74 VanDerWaalsContact C-N 3.25Å; I72-K74 PolarHBondContact O-N 3.17Å; K74-A78 WeakPolarHBondContact O-CA 3.16Å; K74-A78 WeakPolarHBondContact O-CB 3.31Å; K74-A78 PolarHBondContact O-N 2.98Å
75	F	67.3	Low	70	Confident	95 Å²	95	100.7 Å²	100.7	42%	0.417	49%	0.486	S	S	.	.	H	α-helix	trans	-65.8	-38	175.2	-67.2	-75.3	0	0	0	113.8	H71 I72 K73 W82	H71-F75 AromaticContact CD2-CE2 3.67Å; H71-F75 AromaticContact CE1-CE2 3.39Å; H71-F75 WeakPolarHBondContact CE1-CE2 3.47Å; H71-F75 AromaticContact CE1-CZ 3.99Å; H71-F75 AromaticContact CG-CE2 3.92Å; H71-F75 AromaticContact ND1-CE2 3.74Å; H71-F75 AromaticContact NE2-CE2 3.31Å; H71-F75 VanDerWaalsContact NE2-CE2 3.31Å; H71-F75 WeakPolarHBondContact NE2-CE2 2.9Å; H71-F75 AromaticContact NE2-CZ 3.69Å; H71-F75 WeakPolarHBondContact O-CD2 3.36Å; H71-F75 PolarHBondContact O-N 3.43Å; I72-F75 PolarHBondContact O-N 3.23Å; I72-F75 VanDerWaalsContact O-N 3.1Å; K73-F75 VanDerWaalsContact C-N 3.32Å; K73-F75 PolarHBondContact O-N 2.91Å; F75-W82 HydrophobicContact CD1-CH2 4.49Å; F75-W82 HydrophobicContact CD1-CZ2 4.18Å; F75-W82 HydrophobicContact CE1-CZ2 4.46Å
76	L	69.8	Low	68.1	Low	137 Å²	137	101.1 Å²	101.1	72%	0.717	50%	0.495	S	S	*	.	H	α-helix	trans	-72.2	-32.4	-179.9	-67.7	173.1	0	0	0	113.2	I72 K73	I72-L76 HydrophobicContact CG2-CD1 3.68Å; I72-L76 HydrophobicContact CG2-CG 4.15Å; I72-L76 WeakPolarHBondContact O-CG 3.41Å; I72-L76 PolarHBondContact O-N 3.44Å; K73-L76 CarbonylContact O-C 3.58Å; K73-L76 PolarHBondContact O-N 2.84Å; K73-L76 VanDerWaalsContact O-N 3.09Å
77	T	62.7	Low	66.5	Low	117 Å²	117	99.7 Å²	99.7	72%	0.718	50%	0.5	S	S	*	.	H	α-helix	trans	-94.5	-23	-179.7	55.4	0	0	0	0	113.3	K73 D79	K73-T77 WeakPolarHBondContact O-CB 3.3Å; K73-T77 PolarHBondContact O-N 3.09Å; K73-T77 PolarHBondContact O-OG1 3.28Å; T77-D79 PolarHBondContact O-N 3.2Å
78	A	56.6	Low	65.2	Low	55 Å²	55	100.9 Å²	100.9	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-71.7	-23.1	-172.2	0	0	0	0	0	114.1	K74	K74-A78 WeakPolarHBondContact O-CA 3.16Å; K74-A78 WeakPolarHBondContact O-CB 3.31Å; K74-A78 PolarHBondContact O-N 2.98Å
79	D	53.2	Low	63.9	Low	65 Å²	65	104 Å²	104	35%	0.348	53%	0.526	S	S	.	.			trans	-162.3	122.4	-172.1	-105.7	-31.3	0	0	0	114.6	T77 E81 W82	T77-D79 PolarHBondContact O-N 3.2Å; D79-E81 HydrophobicContact CB-CB 3.72Å; D79-E81 HydrophobicContact CB-CG 4.08Å; D79-E81 VanDerWaalsContact CG-CG 3.5Å; D79-E81 PolarHBondContact O-N 3.07Å; D79-E81 VanDerWaalsContact O-N 3.09Å; D79-E81 WeakPolarHBondContact OD1-CG 3.46Å; D79-W82 HydrophobicContact CB-CG 4.41Å; D79-W82 PolarHBondContact O-N 3.23Å
80	R	51.5	Low	62.8	Low	227 Å²	227	109 Å²	109	86%	0.857	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-55.7	-14	153.1	-70.4	-172.1	-175.7	-156.1	4	111.2	K83	R80-K83 WeakPolarHBondContact O-CB 3.19Å; R80-K83 PolarHBondContact O-N 2.8Å
81	E	53.1	Low	62	Low	48 Å²	48	109.8 Å²	109.8	22%	0.224	55%	0.545	C	S	.	.	G	3₁₀ helix	trans	-67.2	-31	175.8	-53.1	-165	132.1	0	0	113.6	D79 K83 S84 R208 Q251	D79-E81 HydrophobicContact CB-CB 3.72Å; D79-E81 HydrophobicContact CB-CG 4.08Å; D79-E81 VanDerWaalsContact CG-CG 3.5Å; D79-E81 PolarHBondContact O-N 3.07Å; D79-E81 VanDerWaalsContact O-N 3.09Å; D79-E81 WeakPolarHBondContact OD1-CG 3.46Å; E81-K83 VanDerWaalsContact C-N 3.3Å; E81-K83 PolarHBondContact O-N 3.09Å; E81-S84 PolarHBondContact O-N 3.33Å; E81-R208 VanDerWaalsContact CG-NH2 3.31Å; E81-R208 IonicContact OE1-CZ 2.68Å; E81-R208 IonicContact OE1-NE 2.75Å; E81-R208 PolarHBondContact OE1-NE 3.32Å; E81-R208 IonicContact OE1-NH2 3.6Å; E81-R208 PolarHBondContact OE1-NH2 3.14Å; E81-Q251 PolarHBondContact OE2-NE2 3.42Å
82	W	49.4	Very low	60.8	Low	124 Å²	124	110.4 Å²	110.4	47%	0.47	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-76.5	-15.7	175.7	-57.2	87.7	0	0	0	113.3	F75 D79 S84 L85 S86	F75-W82 HydrophobicContact CD1-CH2 4.49Å; F75-W82 HydrophobicContact CD1-CZ2 4.18Å; F75-W82 HydrophobicContact CE1-CZ2 4.46Å; D79-W82 HydrophobicContact CB-CG 4.41Å; D79-W82 PolarHBondContact O-N 3.23Å; W82-S84 PolarHBondContact O-N 3.23Å; W82-L85 HydrophobicContact CD2-CD1 3.98Å; W82-L85 HydrophobicContact CE3-CD1 3.32Å; W82-L85 HydrophobicContact CE3-CG 4.49Å; W82-L85 HydrophobicContact CZ3-CD1 3.63Å; W82-L85 CarbonylContact O-C 3.57Å; W82-L85 WeakPolarHBondContact O-CA 3.49Å; W82-L85 PolarHBondContact O-N 3.07Å; W82-S86 PolarHBondContact O-N 3.15Å
83	K	47.5	Very low	59.7	Low	159 Å²	159	110.3 Å²	110.3	69%	0.691	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-63.9	-19.7	170.6	-73.5	-171.2	174.5	-173.4	0	112.3	R80 E81 S86	R80-K83 WeakPolarHBondContact O-CB 3.19Å; R80-K83 PolarHBondContact O-N 2.8Å; E81-K83 VanDerWaalsContact C-N 3.3Å; E81-K83 PolarHBondContact O-N 3.09Å; K83-S86 PolarHBondContact O-OG 2.9Å
84	S	49	Very low	58.7	Low	85 Å²	85	112.3 Å²	112.3	59%	0.594	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-79.7	-23.5	169.9	-169.7	0	0	0	0	112.5	E81 W82	E81-S84 PolarHBondContact O-N 3.33Å; W82-S84 PolarHBondContact O-N 3.23Å
85	L	53.1	Low	58.3	Low	78 Å²	78	108.3 Å²	108.3	41%	0.408	56%	0.558	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.6	-12.3	180	-58.7	174.1	0	0	0	112.1	W82 D87 I88	W82-L85 HydrophobicContact CD2-CD1 3.98Å; W82-L85 HydrophobicContact CE3-CD1 3.32Å; W82-L85 HydrophobicContact CE3-CG 4.49Å; W82-L85 HydrophobicContact CZ3-CD1 3.63Å; W82-L85 CarbonylContact O-C 3.57Å; W82-L85 WeakPolarHBondContact O-CA 3.49Å; W82-L85 PolarHBondContact O-N 3.07Å; L85-D87 PolarHBondContact O-N 2.92Å; L85-I88 HydrophobicContact CB-CD1 3.97Å; L85-I88 HydrophobicContact CB-CG1 4.49Å; L85-I88 HydrophobicContact CD2-CD1 3.27Å; L85-I88 HydrophobicContact CD2-CG1 4.29Å; L85-I88 HydrophobicContact CG-CD1 4.18Å; L85-I88 VanDerWaalsContact O-CB 3.29Å; L85-I88 WeakPolarHBondContact O-CB 3.3Å; L85-I88 WeakPolarHBondContact O-CG1 3.45Å; L85-I88 PolarHBondContact O-N 3.18Å
86	S	51	Low	58.5	Low	90 Å²	90	108.2 Å²	108.2	63%	0.629	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-17	171.5	47.9	0	0	0	0	113.6	W82 K83 I88	W82-S86 PolarHBondContact O-N 3.15Å; K83-S86 PolarHBondContact O-OG 2.9Å; S86-I88 VanDerWaalsContact C-N 3.31Å
87	D	56	Low	58.4	Low	138 Å²	138	106 Å²	106	74%	0.738	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-7.5	171.9	-69.2	-20	0	0	0	112.8	L85 P89	L85-D87 PolarHBondContact O-N 2.92Å; D87-P89 WeakPolarHBondContact O-CD 3.21Å
88	I	61	Low	58.7	Low	76 Å²	76	103.6 Å²	103.6	39%	0.39	53%	0.531	S	S	.	.	S	Bend	trans	-72.2	120.5	176.8	-62.9	178.8	0	0	0	108.9	L85 S86 K90 F92	L85-I88 HydrophobicContact CB-CD1 3.97Å; L85-I88 HydrophobicContact CB-CG1 4.49Å; L85-I88 HydrophobicContact CD2-CD1 3.27Å; L85-I88 HydrophobicContact CD2-CG1 4.29Å; L85-I88 HydrophobicContact CG-CD1 4.18Å; L85-I88 VanDerWaalsContact O-CB 3.29Å; L85-I88 WeakPolarHBondContact O-CB 3.3Å; L85-I88 WeakPolarHBondContact O-CG1 3.45Å; L85-I88 PolarHBondContact O-N 3.18Å; S86-I88 VanDerWaalsContact C-N 3.31Å; I88-K90 PolarHBondContact O-N 3.04Å; I88-F92 HydrophobicContact CG2-CB 3.75Å; I88-F92 HydrophobicContact CG2-CD2 3.36Å; I88-F92 HydrophobicContact CG2-CE2 4.16Å; I88-F92 HydrophobicContact CG2-CG 3.76Å
89	P	61.3	Low	59.6	Low	78 Å²	78	106.2 Å²	106.2	51%	0.506	53%	0.534	S	S	.	.			trans	-50	131.3	173.9	-27.3	32.4	0	0	0	112.1	D87 F91 F92	D87-P89 WeakPolarHBondContact O-CD 3.21Å; P89-F91 PolarHBondContact O-N 2.88Å; P89-F92 HydrophobicContact CB-CD2 3.92Å; P89-F92 HydrophobicContact CB-CE2 4.13Å; P89-F92 HydrophobicContact CG-CD2 4.07Å; P89-F92 HydrophobicContact CG-CE2 3.82Å; P89-F92 WeakPolarHBondContact O-CB 3.29Å; P89-F92 VanDerWaalsContact O-CD2 3.3Å; P89-F92 WeakPolarHBondContact O-CD2 3.34Å; P89-F92 PolarHBondContact O-N 2.92Å
90	K	66.4	Low	60.5	Low	197 Å²	197	106.5 Å²	106.5	86%	0.857	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-56.3	-19.4	179.7	-63.7	-179.7	-178.5	176.8	0	113.9	I88 F92 A93	I88-K90 PolarHBondContact O-N 3.04Å; K90-F92 PolarHBondContact O-N 3.32Å; K90-A93 WeakPolarHBondContact O-CB 3.49Å; K90-A93 PolarHBondContact O-N 2.91Å; K90-A93 VanDerWaalsContact O-N 3.14Å
91	F	67.5	Low	61.5	Low	139 Å²	139	98.3 Å²	98.3	61%	0.61	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-58.8	-30	173.7	-177.1	-105.4	0	0	0	112.8	P89 A93 Q94 V95	P89-F91 PolarHBondContact O-N 2.88Å; F91-A93 PolarHBondContact O-N 2.75Å; F91-A93 VanDerWaalsContact O-N 3.14Å; F91-Q94 WeakPolarHBondContact O-CB 3.46Å; F91-Q94 PolarHBondContact O-N 3.02Å; F91-V95 HydrophobicContact CD1-CG2 3.81Å; F91-V95 HydrophobicContact CE1-CG2 3.36Å; F91-V95 HydrophobicContact CZ-CG2 3.82Å
92	F	59.1	Low	62.5	Low	66 Å²	66	97.5 Å²	97.5	29%	0.289	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-62.8	-19.4	176.3	-76.5	-76.7	0	0	0	113.7	I88 P89 K90 Q94 V95 L97 L100	I88-F92 HydrophobicContact CG2-CB 3.75Å; I88-F92 HydrophobicContact CG2-CD2 3.36Å; I88-F92 HydrophobicContact CG2-CE2 4.16Å; I88-F92 HydrophobicContact CG2-CG 3.76Å; P89-F92 HydrophobicContact CB-CD2 3.92Å; P89-F92 HydrophobicContact CB-CE2 4.13Å; P89-F92 HydrophobicContact CG-CD2 4.07Å; P89-F92 HydrophobicContact CG-CE2 3.82Å; P89-F92 WeakPolarHBondContact O-CB 3.29Å; P89-F92 VanDerWaalsContact O-CD2 3.3Å; P89-F92 WeakPolarHBondContact O-CD2 3.34Å; P89-F92 PolarHBondContact O-N 2.92Å; K90-F92 PolarHBondContact O-N 3.32Å; F92-Q94 PolarHBondContact O-N 3.14Å; F92-V95 PolarHBondContact O-N 2.95Å; F92-L97 HydrophobicContact CB-CD2 4.07Å; F92-L97 HydrophobicContact CD1-CD2 3.36Å; F92-L97 HydrophobicContact CD1-CG 4.48Å; F92-L97 HydrophobicContact CE1-CD2 4.04Å; F92-L97 HydrophobicContact CG-CD2 4.05Å; F92-L100 HydrophobicContact CD1-CD2 3.83Å; F92-L100 HydrophobicContact CE1-CD2 3.32Å; F92-L100 HydrophobicContact CZ-CD2 4.33Å
93	A	60.6	Low	63.8	Low	94 Å²	94	96.9 Å²	96.9	78%	0.777	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-68.6	-16.6	172.4	0	0	0	0	0	113.3	K90 F91	K90-A93 WeakPolarHBondContact O-CB 3.49Å; K90-A93 PolarHBondContact O-N 2.91Å; K90-A93 VanDerWaalsContact O-N 3.14Å; F91-A93 PolarHBondContact O-N 2.75Å; F91-A93 VanDerWaalsContact O-N 3.14Å
94	Q	62.2	Low	65.1	Low	162 Å²	162	93 Å²	93	76%	0.757	51%	0.512	S	S	*	.	G	3₁₀ helix	trans	-101.4	-7.1	179.2	-62.5	178.8	-7.2	0	0	112.9	F91 F92	F91-Q94 WeakPolarHBondContact O-CB 3.46Å; F91-Q94 PolarHBondContact O-N 3.02Å; F92-Q94 PolarHBondContact O-N 3.14Å
95	V	65.6	Low	66.3	Low	45 Å²	45	90.9 Å²	90.9	27%	0.273	50%	0.495	S	S	.	.	S	Bend	trans	-110.4	139.4	-175.2	-176	0	0	0	0	109.2	F91 F92 L97 L100	F91-V95 HydrophobicContact CD1-CG2 3.81Å; F91-V95 HydrophobicContact CE1-CG2 3.36Å; F91-V95 HydrophobicContact CZ-CG2 3.82Å; F92-V95 PolarHBondContact O-N 2.95Å; V95-L97 VanDerWaalsContact C-N 3.34Å; V95-L97 PolarHBondContact O-N 3.02Å; V95-L100 HydrophobicContact CG1-CB 4.09Å; V95-L100 HydrophobicContact CG1-CD2 3.99Å
96	N	71.4	Confident	67.8	Low	93 Å²	93	90.2 Å²	90.2	50%	0.497	49%	0.492	S	S	.	.			trans	-66.2	98.1	168.1	-172.6	-8	0	0	0	108.9	E98 Q99 L100	N96-E98 PolarHBondContact O-N 3.27Å; N96-E98 WeakPolarHBondContact OD1-CB 3.43Å; N96-E98 PolarHBondContact OD1-N 3.14Å; N96-Q99 HydrophobicContact CB-CB 4.24Å; N96-Q99 PolarHBondContact O-N 2.95Å; N96-L100 PolarHBondContact O-N 3.3Å
97	L	69.1	Low	69.5	Low	89 Å²	89	86 Å²	86	47%	0.466	46%	0.462	S	S	.	.	H	α-helix	trans	-56	-35	-179	-80.9	165.8	0	0	0	112.4	F92 V95 L100 C101	F92-L97 HydrophobicContact CB-CD2 4.07Å; F92-L97 HydrophobicContact CD1-CD2 3.36Å; F92-L97 HydrophobicContact CD1-CG 4.48Å; F92-L97 HydrophobicContact CE1-CD2 4.04Å; F92-L97 HydrophobicContact CG-CD2 4.05Å; V95-L97 VanDerWaalsContact C-N 3.34Å; V95-L97 PolarHBondContact O-N 3.02Å; L97-L100 PolarHBondContact O-N 3.31Å; L97-C101 VanDerWaalsContact O-CB 3.27Å; L97-C101 WeakPolarHBondContact O-CB 3.37Å; L97-C101 PolarHBondContact O-N 3.27Å; L97-C101 PolarHBondContact O-SG 2.74Å
98	E	68.6	Low	71	Confident	68 Å²	68	79.6 Å²	79.6	32%	0.318	43%	0.428	S	S	.	.	H	α-helix	trans	-60.7	-53.8	178.6	-168.9	173.3	-178.7	0	0	109.8	N96 L100 C101 E102 H121 K134	N96-E98 PolarHBondContact O-N 3.27Å; N96-E98 WeakPolarHBondContact OD1-CB 3.43Å; N96-E98 PolarHBondContact OD1-N 3.14Å; E98-L100 VanDerWaalsContact C-N 3.34Å; E98-L100 PolarHBondContact O-N 2.9Å; E98-C101 PolarHBondContact O-N 2.91Å; E98-E102 WeakPolarHBondContact O-CB 3.35Å; E98-E102 VanDerWaalsContact O-CG 3.25Å; E98-E102 WeakPolarHBondContact O-CG 3.29Å; E98-E102 PolarHBondContact O-N 3.37Å; E98-H121 IonicContact OE1-CE1 3.59Å; E98-H121 IonicContact OE1-NE2 2.65Å; E98-K134 IonicContact OE1-NZ 3.7Å
99	Q	74	Confident	72.3	Confident	110 Å²	110	77.7 Å²	77.7	51%	0.514	42%	0.421	S	S	.	.	H	α-helix	trans	-64.6	-36.9	-180	-168.5	177.5	8.2	0	0	112.7	N96 N103	N96-Q99 HydrophobicContact CB-CB 4.24Å; N96-Q99 PolarHBondContact O-N 2.95Å; Q99-N103 WeakPolarHBondContact O-CB 2.87Å; Q99-N103 PolarHBondContact O-N 3.48Å; Q99-N103 PolarHBondContact O-ND2 2.91Å
100	L	72.9	Confident	73.6	Confident	70 Å²	70	74.5 Å²	74.5	37%	0.366	40%	0.4	S	S	.	.	H	α-helix	trans	-67.8	-41.8	177	-177.5	60.4	0	0	0	111.6	F92 V95 N96 L97 E98 N103 A104	F92-L100 HydrophobicContact CD1-CD2 3.83Å; F92-L100 HydrophobicContact CE1-CD2 3.32Å; F92-L100 HydrophobicContact CZ-CD2 4.33Å; V95-L100 HydrophobicContact CG1-CB 4.09Å; V95-L100 HydrophobicContact CG1-CD2 3.99Å; N96-L100 PolarHBondContact O-N 3.3Å; L97-L100 PolarHBondContact O-N 3.31Å; E98-L100 VanDerWaalsContact C-N 3.34Å; E98-L100 PolarHBondContact O-N 2.9Å; L100-N103 PolarHBondContact O-N 3.47Å; L100-A104 VanDerWaalsContact O-CB 3.23Å; L100-A104 WeakPolarHBondContact O-CB 3.27Å; L100-A104 PolarHBondContact O-N 3.12Å
101	C	72.3	Confident	74.6	Confident	56 Å²	56	65.3 Å²	65.3	38%	0.378	36%	0.36	S	S	.	.	H	α-helix	trans	-64.6	-43.2	174.9	-74.4	0	0	0	0	111.6	L97 E98 N103 A104 V105	L97-C101 VanDerWaalsContact O-CB 3.27Å; L97-C101 WeakPolarHBondContact O-CB 3.37Å; L97-C101 PolarHBondContact O-N 3.27Å; L97-C101 PolarHBondContact O-SG 2.74Å; E98-C101 PolarHBondContact O-N 2.91Å; C101-N103 VanDerWaalsContact C-N 3.34Å; C101-N103 PolarHBondContact O-N 3.18Å; C101-A104 PolarHBondContact O-N 3Å; C101-V105 WeakPolarHBondContact O-CB 3.25Å; C101-V105 VanDerWaalsContact O-CG2 3.29Å; C101-V105 WeakPolarHBondContact O-CG2 3.49Å; C101-V105 PolarHBondContact O-N 3.26Å
102	E	74.8	Confident	75.5	Confident	31 Å²	31	58.7 Å²	58.7	15%	0.145	33%	0.331	C	S	.	.	H	α-helix	trans	-57.9	-45.8	176.1	-74	177.6	155.2	0	0	111.8	E98 S123 E124 A125	E98-E102 WeakPolarHBondContact O-CB 3.35Å; E98-E102 VanDerWaalsContact O-CG 3.25Å; E98-E102 WeakPolarHBondContact O-CG 3.29Å; E98-E102 PolarHBondContact O-N 3.37Å; E102-S123 WeakPolarHBondContact CG-OG 3.32Å; E102-S123 WeakPolarHBondContact OE1-CB 3.38Å; E102-S123 PolarHBondContact OE1-OG 3.44Å; E102-E124 PolarHBondContact OE1-N 3.23Å; E102-A125 HydrophobicContact CB-CB 4.04Å; E102-A125 HydrophobicContact CG-CB 3.68Å; E102-A125 PolarHBondContact OE1-N 3.26Å
103	N	75.7	Confident	76.8	Confident	111 Å²	111	57.2 Å²	57.2	59%	0.594	33%	0.326	S	S	*	.	H	α-helix	trans	-71.5	-29.7	179.2	-69.2	-20.1	0	0	0	113.5	Q99 L100 C101	Q99-N103 WeakPolarHBondContact O-CB 2.87Å; Q99-N103 PolarHBondContact O-N 3.48Å; Q99-N103 PolarHBondContact O-ND2 2.91Å; L100-N103 PolarHBondContact O-N 3.47Å; C101-N103 VanDerWaalsContact C-N 3.34Å; C101-N103 PolarHBondContact O-N 3.18Å
104	A	75.4	Confident	77.8	Confident	77 Å²	77	54.6 Å²	54.6	64%	0.636	30%	0.296	S	S	*	.	H	α-helix	trans	-84.3	-29	-176.1	0	0	0	0	0	113.1	L100 C101	L100-A104 VanDerWaalsContact O-CB 3.23Å; L100-A104 WeakPolarHBondContact O-CB 3.27Å; L100-A104 PolarHBondContact O-N 3.12Å; C101-A104 PolarHBondContact O-N 3Å
105	V	75.2	Confident	78.5	Confident	40 Å²	40	52.6 Å²	52.6	24%	0.242	29%	0.29	C	S	.	.	H	α-helix	trans	-97.6	-10.7	-171.1	-172.6	0	0	0	0	112.8	C101 G107 V278 R280	C101-V105 WeakPolarHBondContact O-CB 3.25Å; C101-V105 VanDerWaalsContact O-CG2 3.29Å; C101-V105 WeakPolarHBondContact O-CG2 3.49Å; C101-V105 PolarHBondContact O-N 3.26Å; V105-G107 VanDerWaalsContact C-N 3.27Å; V105-G107 PolarHBondContact O-N 3.16Å; V105-V278 HydrophobicContact CB-CG1 4.12Å; V105-V278 HydrophobicContact CG1-CB 4.38Å; V105-V278 HydrophobicContact CG1-CG1 3.38Å; V105-R280 HydrophobicContact CG1-CG 3.68Å; V105-R280 PolarHBondContact O-NE 3.32Å; V105-R280 PolarHBondContact O-NH2 3.32Å
106	D	83.7	Confident	79.3	Confident	64 Å²	64	59.4 Å²	59.4	34%	0.342	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.4	54.9	-172.1	-68.4	-35.8	0	0	0	110.9	Y129 P281 T284 Q288	D106-Y129 PolarHBondContact O-OH 3.38Å; D106-P281 WeakPolarHBondContact O-CD 3.44Å; D106-T284 HydrophobicContact CB-CG2 4.13Å; D106-Q288 PolarHBondContact OD2-NE2 2.77Å
107	G	86.1	Confident	79.9	Confident	1 Å²	1	55 Å²	55	1%	0.01	29%	0.288	C	S	.	.	S	Bend	trans	-169.4	-164.2	-174.2	0	0	0	0	0	111	V105 Y129 A279	V105-G107 VanDerWaalsContact C-N 3.27Å; V105-G107 PolarHBondContact O-N 3.16Å; G107-Y129 PolarHBondContact N-OH 3.07Å; G107-A279 CarbonylContact C-O 3.38Å; G107-A279 WeakPolarHBondContact CA-O 3.45Å
108	F	88.3	Confident	80.8	Confident	5 Å²	5	56 Å²	56	2%	0.022	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	150.3	177.1	64.7	-90.3	0	0	0	111.7	M110 I122 A125 A126 Y129 L130 F244 V278 A279	F108-M110 HydrophobicContact CE2-CE 3.72Å; F108-M110 HydrophobicContact CZ-CE 4.5Å; F108-I122 HydrophobicContact CD2-CD1 4.31Å; F108-I122 HydrophobicContact CD2-CG1 4.25Å; F108-I122 HydrophobicContact CE2-CD1 4.32Å; F108-A125 HydrophobicContact CB-CB 4.21Å; F108-A126 HydrophobicContact CB-CB 3.9Å; F108-A126 HydrophobicContact CD1-CB 4.35Å; F108-A126 HydrophobicContact CD2-CB 3.8Å; F108-A126 HydrophobicContact CE2-CB 4.4Å; F108-A126 HydrophobicContact CG-CB 3.76Å; F108-Y129 AromaticContact CD1-CD2 3.64Å; F108-Y129 HydrophobicContact CD1-CD2 3.64Å; F108-Y129 HydrophobicContact CD1-CE2 4.36Å; F108-Y129 HydrophobicContact CD1-CG 4.17Å; F108-Y129 HydrophobicContact CE1-CD2 4.39Å; F108-Y129 HydrophobicContact CE1-CG 4.5Å; F108-L130 HydrophobicContact CE1-CG 4.46Å; F108-L130 HydrophobicContact CE2-CD1 4.43Å; F108-L130 HydrophobicContact CZ-CD1 4.05Å; F108-L130 HydrophobicContact CZ-CG 4.37Å; F108-F244 HydrophobicContact CD1-CE1 4.44Å; F108-F244 AromaticContact CE1-CD1 3.9Å; F108-F244 HydrophobicContact CE1-CD1 3.9Å; F108-F244 AromaticContact CE1-CE1 3.63Å; F108-F244 HydrophobicContact CE1-CE1 3.63Å; F108-F244 HydrophobicContact CE1-CZ 4.2Å; F108-V278 WeakPolarHBondContact O-CA 3.07Å; F108-A279 HydrophobicContact CD1-CB 4.17Å; F108-A279 HydrophobicContact CD2-CB 4.23Å; F108-A279 HydrophobicContact CE1-CB 3.72Å; F108-A279 HydrophobicContact CE2-CB 3.76Å; F108-A279 HydrophobicContact CG-CB 4.43Å; F108-A279 HydrophobicContact CZ-CB 3.49Å; F108-A279 VanDerWaalsContact CZ-CB 3.49Å; F108-A279 PolarHBondContact N-O 2.84Å; F108-A279 PolarHBondContact O-N 2.93Å
109	C	88.4	Confident	81.8	Confident	35 Å²	35	52.8 Å²	52.8	24%	0.236	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	144.4	178.6	-58.6	0	0	0	0	110.6	I122 S123 F277	C109-I122 WeakPolarHBondContact O-CA 3.43Å; C109-S123 PolarHBondContact O-N 2.97Å; C109-F277 WeakPolarHBondContact CA-O 3.24Å
110	M	87.3	Confident	82.5	Confident	12 Å²	12	50 Å²	50	6%	0.059	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	144	177.1	-158.1	-162.2	-45.3	0	0	111.4	F108 V112 I119 H121 I122 I142 F277	F108-M110 HydrophobicContact CE2-CE 3.72Å; F108-M110 HydrophobicContact CZ-CE 4.5Å; M110-V112 HydrophobicContact CG-CG2 4.13Å; M110-V112 HydrophobicContact SD-CG2 3.53Å; M110-V112 VanDerWaalsContact SD-CG2 3.53Å; M110-I119 HydrophobicContact CG-CG2 4.03Å; M110-I119 HydrophobicContact SD-CD1 4.03Å; M110-I119 HydrophobicContact SD-CG1 3.88Å; M110-I119 HydrophobicContact SD-CG2 4.24Å; M110-H121 CarbonylContact C-O 3.51Å; M110-H121 WeakPolarHBondContact CA-O 2.99Å; M110-H121 WeakPolarHBondContact CG-O 3.06Å; M110-I122 HydrophobicContact CG-CB 4.24Å; M110-I122 HydrophobicContact CG-CD1 4.4Å; M110-I122 HydrophobicContact CG-CG1 4.15Å; M110-I142 HydrophobicContact CE-CD1 4.02Å; M110-I142 HydrophobicContact SD-CD1 3.76Å; M110-I142 HydrophobicContact SD-CG1 4.43Å; M110-F277 HydrophobicContact CB-CD1 4.38Å; M110-F277 HydrophobicContact CB-CE1 3.88Å; M110-F277 HydrophobicContact CB-CE2 4.1Å; M110-F277 HydrophobicContact CB-CZ 3.74Å; M110-F277 HydrophobicContact CE-CE1 4.27Å; M110-F277 HydrophobicContact CE-CE2 3.77Å; M110-F277 HydrophobicContact CE-CZ 3.3Å; M110-F277 HydrophobicContact CG-CE1 4.33Å; M110-F277 HydrophobicContact CG-CZ 4.21Å; M110-F277 PolarHBondContact N-O 3.34Å; M110-F277 PolarHBondContact O-N 3.17Å; M110-F277 HydrophobicContact SD-CE1 3.98Å; M110-F277 HydrophobicContact SD-CZ 3.58Å; M110-F277 VanDerWaalsContact SD-CZ 3.58Å
111	A	87.7	Confident	83.2	Confident	4 Å²	4	50.2 Å²	50.2	3%	0.033	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	127	171.5	0	0	0	0	0	110.6	V120 H121 L275 F276	A111-V120 PolarHBondContact O-N 2.9Å; A111-H121 HydrophobicContact CB-CB 3.99Å; A111-H121 PolarHBondContact N-O 2.93Å; A111-H121 PolarHBondContact O-N 3.41Å; A111-L275 CarbonylContact C-O 3.49Å; A111-L275 VanDerWaalsContact CA-O 3.3Å; A111-L275 WeakPolarHBondContact CA-O 3.23Å; A111-F276 HydrophobicContact CB-CD1 3.68Å; A111-F276 HydrophobicContact CB-CE1 3.62Å; A111-F276 HydrophobicContact CB-CZ 4.42Å
112	V	87.6	Confident	84	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	136.9	-173.3	177.9	0	0	0	0	111.1	M110 G117 R118 I119 I142 I158 Y274 L275 F277	M110-V112 HydrophobicContact CG-CG2 4.13Å; M110-V112 HydrophobicContact SD-CG2 3.53Å; M110-V112 VanDerWaalsContact SD-CG2 3.53Å; V112-G117 VanDerWaalsContact CG1-C 3.43Å; V112-R118 CarbonylContact C-O 3.57Å; V112-R118 WeakPolarHBondContact CA-O 3.02Å; V112-I119 HydrophobicContact CG2-CG1 4.3Å; V112-I142 HydrophobicContact CG1-CG2 4.04Å; V112-I142 HydrophobicContact CG2-CB 4.45Å; V112-I142 HydrophobicContact CG2-CD1 3.85Å; V112-I158 HydrophobicContact CG1-CD1 4.33Å; V112-Y274 CarbonylContact O-C 3.57Å; V112-Y274 VanDerWaalsContact O-CA 3.3Å; V112-Y274 WeakPolarHBondContact O-CA 3.43Å; V112-L275 PolarHBondContact N-O 3.08Å; V112-L275 PolarHBondContact O-N 3.12Å; V112-F277 HydrophobicContact CG2-CE1 3.81Å; V112-F277 HydrophobicContact CG2-CZ 4.48Å
113	L	86.1	Confident	84.6	Confident	34 Å²	34	46.1 Å²	46.1	18%	0.178	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	130.1	172.6	-81.4	158	0	0	0	111.7	D115 G117 R118 V120 Y274	L113-D115 PolarHBondContact O-N 3.04Å; L113-G117 VanDerWaalsContact O-CA 3.22Å; L113-G117 WeakPolarHBondContact O-CA 3.34Å; L113-G117 PolarHBondContact O-N 2.85Å; L113-R118 HydrophobicContact CB-CB 4.3Å; L113-R118 HydrophobicContact CD1-CB 4.04Å; L113-R118 HydrophobicContact CD1-CG 4.33Å; L113-R118 PolarHBondContact N-O 3.27Å; L113-V120 HydrophobicContact CB-CG2 4.49Å; L113-V120 HydrophobicContact CD1-CG2 3.39Å; L113-V120 HydrophobicContact CG-CG2 3.51Å; L113-Y274 HydrophobicContact CD2-CD1 3.88Å; L113-Y274 HydrophobicContact CD2-CE1 3.27Å; L113-Y274 HydrophobicContact CD2-CE2 4.35Å; L113-Y274 HydrophobicContact CG-CD1 4.13Å; L113-Y274 HydrophobicContact CG-CE1 3.74Å
114	R	81.6	Confident	85.2	Confident	39 Å²	39	47.5 Å²	47.5	15%	0.147	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-46.3	179	169.9	179.6	-100	-139.2	2.8	113.1	R116 I158 Y159 F160 V273	R114-R116 PolarHBondContact O-N 2.84Å; R114-I158 HydrophobicContact CB-CG2 4.05Å; R114-I158 HydrophobicContact CG-CG2 3.8Å; R114-I158 PolarHBondContact NE-O 3.23Å; R114-I158 PolarHBondContact NH2-O 3.38Å; R114-Y159 HydrophobicContact CG-CD1 4.03Å; R114-Y159 HydrophobicContact CG-CE1 3.98Å; R114-Y159 VanDerWaalsContact NH2-C 3.27Å; R114-Y159 WeakPolarHBondContact O-CE1 3.15Å; R114-Y159 PolarHBondContact O-OH 2.86Å; R114-F160 PolarHBondContact NH2-O 2.92Å; R114-V273 HydrophobicContact CB-CB 3.92Å; R114-V273 HydrophobicContact CB-CG1 4.2Å; R114-V273 WeakPolarHBondContact CB-O 3.3Å; R114-V273 PolarHBondContact N-O 3.4Å
115	D	77.4	Confident	85.7	Confident	120 Å²	120	44.3 Å²	44.3	64%	0.642	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-42.7	-168.5	-175.6	38.4	0	0	0	113.6	L113 Y159	L113-D115 PolarHBondContact O-N 3.04Å; D115-Y159 PolarHBondContact O-OH 3.18Å; D115-Y159 VanDerWaalsContact O-OH 3.1Å
116	R	80.5	Confident	86.3	Confident	188 Å²	188	42.4 Å²	42.4	71%	0.709	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-120.5	-3.2	-174.7	-61.7	-169	-177.3	-172.6	-0.7	114.5	R114 R118 Y143	R114-R116 PolarHBondContact O-N 2.84Å; R116-R118 PolarHBondContact O-N 2.83Å; R116-Y143 WeakPolarHBondContact O-CE2 3.46Å
117	G	84.1	Confident	86.4	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	21%	0.207	C	C	.	.			trans	65	23.4	-168.8	0	0	0	0	0	112.8	V112 L113 S141 I142	V112-G117 VanDerWaalsContact CG1-C 3.43Å; L113-G117 VanDerWaalsContact O-CA 3.22Å; L113-G117 WeakPolarHBondContact O-CA 3.34Å; L113-G117 PolarHBondContact O-N 2.85Å; G117-S141 WeakPolarHBondContact O-CA 3.14Å; G117-I142 VanDerWaalsContact O-CG2 3.3Å; G117-I142 WeakPolarHBondContact O-CG2 3.3Å; G117-I142 PolarHBondContact O-N 2.78Å
118	R	88.8	Confident	86.4	Confident	111 Å²	111	50.8 Å²	50.8	42%	0.419	24%	0.237	S	C	.	.	B	Isolated β-bridge	trans	-73.8	127.8	-178.2	178.4	178.8	176.6	175.4	3.4	110.5	V112 L113 R116 V120 N139 H140	V112-R118 CarbonylContact C-O 3.57Å; V112-R118 WeakPolarHBondContact CA-O 3.02Å; L113-R118 HydrophobicContact CB-CB 4.3Å; L113-R118 HydrophobicContact CD1-CB 4.04Å; L113-R118 HydrophobicContact CD1-CG 4.33Å; L113-R118 PolarHBondContact N-O 3.27Å; R116-R118 PolarHBondContact O-N 2.83Å; R118-V120 PolarHBondContact O-N 3.04Å; R118-N139 VanDerWaalsContact CZ-OD1 3.27Å; R118-N139 PolarHBondContact NE-OD1 2.84Å; R118-N139 PolarHBondContact NH2-OD1 2.73Å; R118-H140 WeakPolarHBondContact CA-O 3.03Å
119	I	89.4	Confident	86.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	119.4	175.3	-57.9	170.6	0	0	0	108.5	M110 V112 I122 N139 H140 I142 L145	M110-I119 HydrophobicContact CG-CG2 4.03Å; M110-I119 HydrophobicContact SD-CD1 4.03Å; M110-I119 HydrophobicContact SD-CG1 3.88Å; M110-I119 HydrophobicContact SD-CG2 4.24Å; V112-I119 HydrophobicContact CG2-CG1 4.3Å; I119-I122 HydrophobicContact CG2-CB 4.22Å; I119-N139 WeakPolarHBondContact O-CA 3.3Å; I119-N139 PolarHBondContact O-N 2.82Å; I119-H140 PolarHBondContact N-O 2.81Å; I119-I142 HydrophobicContact CD1-CB 4.48Å; I119-I142 HydrophobicContact CG1-CB 4.25Å; I119-L145 HydrophobicContact CD1-CD1 3.64Å
120	V	88.7	Confident	86.1	Confident	53 Å²	53	52 Å²	52	32%	0.321	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	-30.4	-179.9	178.5	0	0	0	0	111.4	A111 L113 R118 M138 Y274	A111-V120 PolarHBondContact O-N 2.9Å; L113-V120 HydrophobicContact CB-CG2 4.49Å; L113-V120 HydrophobicContact CD1-CG2 3.39Å; L113-V120 HydrophobicContact CG-CG2 3.51Å; R118-V120 PolarHBondContact O-N 3.04Å; V120-M138 WeakPolarHBondContact O-CE 3.4Å; V120-Y274 HydrophobicContact CG1-CE1 4.49Å; V120-Y274 HydrophobicContact CG2-CD1 4.41Å; V120-Y274 HydrophobicContact CG2-CE1 4.09Å
121	H	88.8	Confident	85.9	Confident	74 Å²	74	54.1 Å²	54.1	34%	0.343	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	142	176.3	179.7	77.4	0	0	0	109.4	E98 M110 A111	E98-H121 IonicContact OE1-CE1 3.59Å; E98-H121 IonicContact OE1-NE2 2.65Å; M110-H121 CarbonylContact C-O 3.51Å; M110-H121 WeakPolarHBondContact CA-O 2.99Å; M110-H121 WeakPolarHBondContact CG-O 3.06Å; A111-H121 HydrophobicContact CB-CB 3.99Å; A111-H121 PolarHBondContact N-O 2.93Å; A111-H121 PolarHBondContact O-N 3.41Å
122	I	88.4	Confident	85.7	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	139.1	170.9	-167.4	171.6	0	0	0	108.2	F108 C109 M110 I119 A126 K134 L137 M138	F108-I122 HydrophobicContact CD2-CD1 4.31Å; F108-I122 HydrophobicContact CD2-CG1 4.25Å; F108-I122 HydrophobicContact CE2-CD1 4.32Å; C109-I122 WeakPolarHBondContact O-CA 3.43Å; M110-I122 HydrophobicContact CG-CB 4.24Å; M110-I122 HydrophobicContact CG-CD1 4.4Å; M110-I122 HydrophobicContact CG-CG1 4.15Å; I119-I122 HydrophobicContact CG2-CB 4.22Å; I122-A126 HydrophobicContact CD1-CB 3.45Å; I122-A126 VanDerWaalsContact CD1-CB 3.45Å; I122-A126 HydrophobicContact CG1-CB 3.65Å; I122-K134 HydrophobicContact CG2-CB 4.25Å; I122-K134 HydrophobicContact CG2-CG 3.77Å; I122-K134 VanDerWaalsContact O-CD 3.28Å; I122-K134 WeakPolarHBondContact O-CD 3.46Å; I122-K134 WeakPolarHBondContact O-CE 3.37Å; I122-K134 PolarHBondContact O-NZ 2.88Å; I122-L137 HydrophobicContact CD1-CB 4.42Å; I122-L137 HydrophobicContact CD1-CD1 3.54Å; I122-L137 HydrophobicContact CG2-CB 4.33Å; I122-M138 HydrophobicContact CG2-SD 4.24Å
123	S	88.3	Confident	85.7	Confident	1 Å²	1	61.7 Å²	61.7	1%	0.007	28%	0.282	C	S	.	.			trans	-75.6	157.5	-179.9	105.5	0	0	0	0	111	E102 C109 A125 A126	E102-S123 WeakPolarHBondContact CG-OG 3.32Å; E102-S123 WeakPolarHBondContact OE1-CB 3.38Å; E102-S123 PolarHBondContact OE1-OG 3.44Å; C109-S123 PolarHBondContact O-N 2.97Å; S123-A125 PolarHBondContact O-N 3.21Å; S123-A126 WeakPolarHBondContact O-CB 3.22Å; S123-A126 PolarHBondContact O-N 3.38Å
124	E	86.8	Confident	85.8	Confident	139 Å²	139	62.7 Å²	62.7	65%	0.65	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-66.9	-28.3	-176	-69.5	-173.5	-179.1	0	0	112.3	E102 A126 Y127 K134	E102-E124 PolarHBondContact OE1-N 3.23Å; E124-A126 PolarHBondContact O-N 2.89Å; E124-Y127 WeakPolarHBondContact O-CB 3.42Å; E124-Y127 PolarHBondContact O-N 2.82Å; E124-Y127 VanDerWaalsContact O-N 3.12Å; E124-K134 HydrophobicContact CG-CD 4.02Å
125	A	87	Confident	86.1	Confident	10 Å²	10	66.2 Å²	66.2	8%	0.083	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-56.2	-22	174.7	0	0	0	0	0	114.1	E102 F108 S123 Y127 N128 Y129	E102-A125 HydrophobicContact CB-CB 4.04Å; E102-A125 HydrophobicContact CG-CB 3.68Å; E102-A125 PolarHBondContact OE1-N 3.26Å; F108-A125 HydrophobicContact CB-CB 4.21Å; S123-A125 PolarHBondContact O-N 3.21Å; A125-Y127 PolarHBondContact O-N 2.89Å; A125-Y127 VanDerWaalsContact O-N 3.14Å; A125-N128 WeakPolarHBondContact O-CB 3.47Å; A125-N128 PolarHBondContact O-N 3.24Å; A125-Y129 VanDerWaalsContact O-CD2 3.25Å; A125-Y129 WeakPolarHBondContact O-CD2 3.23Å
126	A	87	Confident	86.6	Confident	1 Å²	1	63.5 Å²	63.5	1%	0.008	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-57.7	-28.4	176.8	0	0	0	0	0	112.9	F108 I122 S123 E124 N128 Y129 L130	F108-A126 HydrophobicContact CB-CB 3.9Å; F108-A126 HydrophobicContact CD1-CB 4.35Å; F108-A126 HydrophobicContact CD2-CB 3.8Å; F108-A126 HydrophobicContact CE2-CB 4.4Å; F108-A126 HydrophobicContact CG-CB 3.76Å; I122-A126 HydrophobicContact CD1-CB 3.45Å; I122-A126 VanDerWaalsContact CD1-CB 3.45Å; I122-A126 HydrophobicContact CG1-CB 3.65Å; S123-A126 WeakPolarHBondContact O-CB 3.22Å; S123-A126 PolarHBondContact O-N 3.38Å; E124-A126 PolarHBondContact O-N 2.89Å; A126-N128 PolarHBondContact O-N 3.21Å; A126-Y129 PolarHBondContact O-N 3.25Å; A126-Y129 VanDerWaalsContact O-N 3.14Å; A126-L130 HydrophobicContact CB-CD1 4.46Å; A126-L130 PolarHBondContact O-N 2.82Å
127	Y	86.9	Confident	86.9	Confident	122 Å²	122	54.6 Å²	54.6	48%	0.478	26%	0.256	S	S	.	.	H	α-helix	trans	-60.6	-31.3	175.9	-176.2	-104	0	0	0	112.5	E124 A125 Y129 S131 R133	E124-Y127 WeakPolarHBondContact O-CB 3.42Å; E124-Y127 PolarHBondContact O-N 2.82Å; E124-Y127 VanDerWaalsContact O-N 3.12Å; A125-Y127 PolarHBondContact O-N 2.89Å; A125-Y127 VanDerWaalsContact O-N 3.14Å; Y127-Y129 PolarHBondContact O-N 3.5Å; Y127-S131 WeakPolarHBondContact O-CA 3.29Å; Y127-S131 PolarHBondContact O-N 2.8Å; Y127-S131 PolarHBondContact O-OG 3.25Å; Y127-R133 HydrophobicContact CD2-CG 4.35Å; Y127-R133 HydrophobicContact CE2-CG 4.22Å
128	N	85.8	Confident	87.1	Confident	119 Å²	119	57.1 Å²	57.1	64%	0.636	27%	0.269	S	S	*	.	H	α-helix	trans	-71.3	-20.4	179.8	-63.1	-26.2	0	0	0	113	A125 A126	A125-N128 WeakPolarHBondContact O-CB 3.47Å; A125-N128 PolarHBondContact O-N 3.24Å; A126-N128 PolarHBondContact O-N 3.21Å
129	Y	84.6	Confident	87	Confident	57 Å²	57	56.1 Å²	56.1	22%	0.224	27%	0.272	C	S	.	.	H	α-helix	trans	-110.1	-38.8	-173.3	-59.5	-74.6	0	0	0	113.1	D106 G107 F108 A125 A126 Y127 F244 P281	D106-Y129 PolarHBondContact O-OH 3.38Å; G107-Y129 PolarHBondContact N-OH 3.07Å; F108-Y129 AromaticContact CD1-CD2 3.64Å; F108-Y129 HydrophobicContact CD1-CD2 3.64Å; F108-Y129 HydrophobicContact CD1-CE2 4.36Å; F108-Y129 HydrophobicContact CD1-CG 4.17Å; F108-Y129 HydrophobicContact CE1-CD2 4.39Å; F108-Y129 HydrophobicContact CE1-CG 4.5Å; A125-Y129 VanDerWaalsContact O-CD2 3.25Å; A125-Y129 WeakPolarHBondContact O-CD2 3.23Å; A126-Y129 PolarHBondContact O-N 3.25Å; A126-Y129 VanDerWaalsContact O-N 3.14Å; Y127-Y129 PolarHBondContact O-N 3.5Å; Y129-F244 HydrophobicContact CD1-CE1 4.28Å; Y129-F244 HydrophobicContact CG-CE1 4.18Å; Y129-P281 HydrophobicContact CD1-CB 4.48Å; Y129-P281 HydrophobicContact CD1-CG 3.97Å; Y129-P281 HydrophobicContact CE1-CG 3.64Å
130	L	84.9	Confident	86.9	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.042	29%	0.288	C	S	.	.	H	α-helix	trans	-100.7	-19.8	-178.2	-55.3	177.7	0	0	0	112.3	F108 A126 I132 L137 S217 L218 F244	F108-L130 HydrophobicContact CE1-CG 4.46Å; F108-L130 HydrophobicContact CE2-CD1 4.43Å; F108-L130 HydrophobicContact CZ-CD1 4.05Å; F108-L130 HydrophobicContact CZ-CG 4.37Å; A126-L130 HydrophobicContact CB-CD1 4.46Å; A126-L130 PolarHBondContact O-N 2.82Å; L130-I132 PolarHBondContact O-N 2.96Å; L130-L137 HydrophobicContact CD1-CD1 3.9Å; L130-S217 VanDerWaalsContact CD2-OG 3.25Å; L130-S217 WeakPolarHBondContact CD2-OG 3.4Å; L130-L218 WeakPolarHBondContact CD2-O 3.42Å; L130-F244 HydrophobicContact CD2-CE2 4.21Å; L130-F244 HydrophobicContact CD2-CZ 4.27Å
131	S	83.3	Confident	86.9	Confident	56 Å²	56	58.5 Å²	58.5	39%	0.392	28%	0.282	S	S	.	.			trans	38	31.3	-163.2	-30.2	0	0	0	0	116.8	Y127 A220	Y127-S131 WeakPolarHBondContact O-CA 3.29Å; Y127-S131 PolarHBondContact O-N 2.8Å; Y127-S131 PolarHBondContact O-OG 3.25Å; S131-A220 WeakPolarHBondContact OG-CB 3.43Å
132	I	84.2	Confident	86.9	Confident	14 Å²	14	55.1 Å²	55.1	7%	0.072	27%	0.267	C	S	.	.			trans	-99	135.7	162.8	-55.4	167.1	0	0	0	106.8	L130 E136 L137 L145 L229	L130-I132 PolarHBondContact O-N 2.96Å; I132-E136 HydrophobicContact CG2-CB 3.81Å; I132-E136 HydrophobicContact CG2-CG 3.83Å; I132-L137 HydrophobicContact CB-CD1 4.04Å; I132-L137 HydrophobicContact CB-CD2 3.98Å; I132-L137 HydrophobicContact CB-CG 3.96Å; I132-L137 HydrophobicContact CD1-CD2 3.94Å; I132-L137 HydrophobicContact CG2-CD1 4.21Å; I132-L137 HydrophobicContact CG2-CD2 3.59Å; I132-L137 HydrophobicContact CG2-CG 3.57Å; I132-L145 HydrophobicContact CD1-CD2 4.08Å; I132-L229 HydrophobicContact CD1-CD1 4.3Å
133	R	87	Confident	86.9	Confident	150 Å²	150	56.8 Å²	56.8	57%	0.566	27%	0.273	S	S	*	.			trans	-67.4	146.4	179.2	-70.3	174.6	54.4	84.3	7.2	110.1	Y127 D135 E136 L137	Y127-R133 HydrophobicContact CD2-CG 4.35Å; Y127-R133 HydrophobicContact CE2-CG 4.22Å; R133-D135 IonicContact CZ-OD2 3.95Å; R133-D135 IonicContact NE-OD2 2.85Å; R133-D135 IonicContact NH2-OD2 3.5Å; R133-D135 PolarHBondContact NH2-OD2 2.85Å; R133-D135 PolarHBondContact O-N 2.77Å; R133-E136 PolarHBondContact O-N 2.87Å; R133-L137 PolarHBondContact O-N 2.78Å
134	K	87.9	Confident	86.8	Confident	54 Å²	54	61 Å²	61	24%	0.235	30%	0.296	C	S	.	.	H	α-helix	trans	-46.1	-48.4	172.6	175.5	167.4	179	169.2	0	111.8	E98 I122 E124 E136 L137 M138	E98-K134 IonicContact OE1-NZ 3.7Å; I122-K134 HydrophobicContact CG2-CB 4.25Å; I122-K134 HydrophobicContact CG2-CG 3.77Å; I122-K134 VanDerWaalsContact O-CD 3.28Å; I122-K134 WeakPolarHBondContact O-CD 3.46Å; I122-K134 WeakPolarHBondContact O-CE 3.37Å; I122-K134 PolarHBondContact O-NZ 2.88Å; E124-K134 HydrophobicContact CG-CD 4.02Å; K134-E136 PolarHBondContact O-N 3.34Å; K134-L137 PolarHBondContact O-N 2.85Å; K134-M138 HydrophobicContact CG-CG 4.17Å; K134-M138 WeakPolarHBondContact O-CG 3.49Å; K134-M138 PolarHBondContact O-N 3.4Å
135	D	88	Confident	86.8	Confident	114 Å²	114	54.8 Å²	54.8	61%	0.61	27%	0.267	S	S	*	.	H	α-helix	trans	-58.6	-31.3	-178.7	-52.1	-43.3	0	0	0	114.3	R133	R133-D135 IonicContact CZ-OD2 3.95Å; R133-D135 IonicContact NE-OD2 2.85Å; R133-D135 IonicContact NH2-OD2 3.5Å; R133-D135 PolarHBondContact NH2-OD2 2.85Å; R133-D135 PolarHBondContact O-N 2.77Å
136	E	87.7	Confident	86.8	Confident	63 Å²	63	55 Å²	55	29%	0.294	27%	0.267	S	S	.	.	H	α-helix	trans	-84.3	-23.5	179.8	-176.1	177.7	-178.2	0	0	111.9	I132 R133 K134 H140	I132-E136 HydrophobicContact CG2-CB 3.81Å; I132-E136 HydrophobicContact CG2-CG 3.83Å; R133-E136 PolarHBondContact O-N 2.87Å; K134-E136 PolarHBondContact O-N 3.34Å; E136-H140 PolarHBondContact O-CD2 2.89Å
137	L	86.6	Confident	86.6	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-87.9	-25.4	176.5	-65.7	177.1	0	0	0	112.8	I122 L130 I132 R133 K134 N139 H140 L145	I122-L137 HydrophobicContact CD1-CB 4.42Å; I122-L137 HydrophobicContact CD1-CD1 3.54Å; I122-L137 HydrophobicContact CG2-CB 4.33Å; L130-L137 HydrophobicContact CD1-CD1 3.9Å; I132-L137 HydrophobicContact CB-CD1 4.04Å; I132-L137 HydrophobicContact CB-CD2 3.98Å; I132-L137 HydrophobicContact CB-CG 3.96Å; I132-L137 HydrophobicContact CD1-CD2 3.94Å; I132-L137 HydrophobicContact CG2-CD1 4.21Å; I132-L137 HydrophobicContact CG2-CD2 3.59Å; I132-L137 HydrophobicContact CG2-CG 3.57Å; R133-L137 PolarHBondContact O-N 2.78Å; K134-L137 PolarHBondContact O-N 2.85Å; L137-N139 PolarHBondContact O-N 2.9Å; L137-H140 PolarHBondContact O-N 3.38Å; L137-L145 HydrophobicContact CD2-CD1 3.78Å; L137-L145 HydrophobicContact CD2-CD2 3.62Å; L137-L145 HydrophobicContact CD2-CG 4.31Å
138	M	88.3	Confident	86.5	Confident	53 Å²	53	55.9 Å²	55.9	26%	0.261	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	132.5	179.5	-72.8	-69	-68.7	0	0	110.5	V120 I122 K134 H140	V120-M138 WeakPolarHBondContact O-CE 3.4Å; I122-M138 HydrophobicContact CG2-SD 4.24Å; K134-M138 HydrophobicContact CG-CG 4.17Å; K134-M138 WeakPolarHBondContact O-CG 3.49Å; K134-M138 PolarHBondContact O-N 3.4Å; M138-H140 PolarHBondContact O-N 3.04Å
139	N	86.4	Confident	86.4	Confident	90 Å²	90	57.7 Å²	57.7	48%	0.481	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	67	0.9	-177.7	-52.8	-54.8	0	0	0	116.5	R118 I119 L137	R118-N139 VanDerWaalsContact CZ-OD1 3.27Å; R118-N139 PolarHBondContact NE-OD1 2.84Å; R118-N139 PolarHBondContact NH2-OD1 2.73Å; I119-N139 WeakPolarHBondContact O-CA 3.3Å; I119-N139 PolarHBondContact O-N 2.82Å; L137-N139 PolarHBondContact O-N 2.9Å
140	H	87.9	Confident	86.4	Confident	74 Å²	74	55.1 Å²	55.1	34%	0.343	28%	0.275	S	S	.	.	S	Bend	trans	-77.3	161.8	169.6	-87.4	-84.9	0	0	0	112.2	R118 I119 E136 L137 M138 L229	R118-H140 WeakPolarHBondContact CA-O 3.03Å; I119-H140 PolarHBondContact N-O 2.81Å; E136-H140 PolarHBondContact O-CD2 2.89Å; L137-H140 PolarHBondContact O-N 3.38Å; M138-H140 PolarHBondContact O-N 3.04Å; H140-L229 WeakPolarHBondContact CE1-CD2 3.4Å; H140-L229 VanDerWaalsContact ND1-CD2 3.25Å; H140-L229 WeakPolarHBondContact ND1-CD2 3.24Å
141	S	89.3	Confident	86.5	Confident	28 Å²	28	56 Å²	56	20%	0.196	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-80	127	173.4	157.5	0	0	0	0	109.1	G117 Y143 D144	G117-S141 WeakPolarHBondContact O-CA 3.14Å; S141-Y143 PolarHBondContact O-N 3.45Å; S141-Y143 VanDerWaalsContact O-N 3.16Å; S141-Y143 WeakPolarHBondContact OG-CB 3.43Å; S141-Y143 VanDerWaalsContact OG-CD2 3.32Å; S141-Y143 WeakPolarHBondContact OG-CD2 3.28Å; S141-Y143 PolarHBondContact OG-N 3.04Å; S141-D144 WeakPolarHBondContact CB-OD2 3.44Å; S141-D144 WeakPolarHBondContact O-CB 3.19Å; S141-D144 PolarHBondContact O-N 2.89Å; S141-D144 VanDerWaalsContact O-N 3.08Å
142	I	88.8	Confident	86.5	Confident	4 Å²	4	60 Å²	60	2%	0.021	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-57.6	-28.3	173.3	-170.7	165.2	0	0	0	112.2	M110 V112 G117 I119 D144 L145 L146 F154 F277	M110-I142 HydrophobicContact CE-CD1 4.02Å; M110-I142 HydrophobicContact SD-CD1 3.76Å; M110-I142 HydrophobicContact SD-CG1 4.43Å; V112-I142 HydrophobicContact CG1-CG2 4.04Å; V112-I142 HydrophobicContact CG2-CB 4.45Å; V112-I142 HydrophobicContact CG2-CD1 3.85Å; G117-I142 VanDerWaalsContact O-CG2 3.3Å; G117-I142 WeakPolarHBondContact O-CG2 3.3Å; G117-I142 PolarHBondContact O-N 2.78Å; I119-I142 HydrophobicContact CD1-CB 4.48Å; I119-I142 HydrophobicContact CG1-CB 4.25Å; I142-D144 PolarHBondContact O-N 2.99Å; I142-D144 VanDerWaalsContact O-N 3.16Å; I142-L145 PolarHBondContact O-N 3.28Å; I142-L146 HydrophobicContact CG1-CD1 4.36Å; I142-L146 HydrophobicContact CG1-CG 4.35Å; I142-L146 WeakPolarHBondContact O-CG 3.39Å; I142-L146 PolarHBondContact O-N 3.48Å; I142-F154 HydrophobicContact CD1-CE1 3.79Å; I142-F154 HydrophobicContact CD1-CE2 4.13Å; I142-F154 HydrophobicContact CD1-CZ 3.41Å; I142-F154 VanDerWaalsContact CD1-CZ 3.41Å; I142-F154 HydrophobicContact CG1-CE1 4.32Å; I142-F154 HydrophobicContact CG1-CZ 4.36Å; I142-F154 HydrophobicContact CG2-CD1 4.35Å; I142-F154 HydrophobicContact CG2-CE1 3.64Å; I142-F154 HydrophobicContact CG2-CZ 4.39Å; I142-F277 HydrophobicContact CD1-CE1 4.13Å; I142-F277 HydrophobicContact CD1-CZ 3.7Å
143	Y	88.4	Confident	86.4	Confident	35 Å²	35	62.2 Å²	62.2	14%	0.137	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-63.8	-20.3	179.6	-53.7	-64.2	0	0	0	112.7	R116 S141 L145 L146 V151 F154 K155	R116-Y143 WeakPolarHBondContact O-CE2 3.46Å; S141-Y143 PolarHBondContact O-N 3.45Å; S141-Y143 VanDerWaalsContact O-N 3.16Å; S141-Y143 WeakPolarHBondContact OG-CB 3.43Å; S141-Y143 VanDerWaalsContact OG-CD2 3.32Å; S141-Y143 WeakPolarHBondContact OG-CD2 3.28Å; S141-Y143 PolarHBondContact OG-N 3.04Å; Y143-L145 VanDerWaalsContact C-N 3.3Å; Y143-L146 HydrophobicContact CD1-CD1 4.38Å; Y143-V151 HydrophobicContact CD1-CG1 3.91Å; Y143-F154 HydrophobicContact CD1-CD1 4.39Å; Y143-F154 AromaticContact CE1-CD1 3.89Å; Y143-F154 HydrophobicContact CE1-CD1 3.89Å; Y143-K155 HydrophobicContact CD1-CG 4.4Å; Y143-K155 HydrophobicContact CE1-CD 4.25Å; Y143-K155 HydrophobicContact CE1-CG 3.51Å
144	D	85.8	Confident	86.2	Confident	89 Å²	89	55.1 Å²	55.1	48%	0.476	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-79.4	-18.2	178.1	-51.8	-18.1	0	0	0	111.5	S141 I142	S141-D144 WeakPolarHBondContact CB-OD2 3.44Å; S141-D144 WeakPolarHBondContact O-CB 3.19Å; S141-D144 PolarHBondContact O-N 2.89Å; S141-D144 VanDerWaalsContact O-N 3.08Å; I142-D144 PolarHBondContact O-N 2.99Å; I142-D144 VanDerWaalsContact O-N 3.16Å
145	L	86	Confident	86.1	Confident	8 Å²	8	56.8 Å²	56.8	4%	0.042	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-21.9	179.2	-55.1	175	0	0	0	112.8	I119 I132 L137 I142 Y143 S217 L218 L229	I119-L145 HydrophobicContact CD1-CD1 3.64Å; I132-L145 HydrophobicContact CD1-CD2 4.08Å; L137-L145 HydrophobicContact CD2-CD1 3.78Å; L137-L145 HydrophobicContact CD2-CD2 3.62Å; L137-L145 HydrophobicContact CD2-CG 4.31Å; I142-L145 PolarHBondContact O-N 3.28Å; Y143-L145 VanDerWaalsContact C-N 3.3Å; L145-S217 VanDerWaalsContact O-CA 3.31Å; L145-S217 WeakPolarHBondContact O-CA 3.25Å; L145-S217 WeakPolarHBondContact O-CB 3.47Å; L145-L218 HydrophobicContact CD2-CD1 4.46Å; L145-L218 PolarHBondContact O-N 3.24Å; L145-L229 HydrophobicContact CD2-CD1 4.45Å
146	L	87.1	Confident	85.8	Confident	15 Å²	15	57.8 Å²	57.8	8%	0.079	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-82.8	145.4	-176.1	-67.5	173.9	0	0	0	111.2	I142 Y143 V151 F154 F215	I142-L146 HydrophobicContact CG1-CD1 4.36Å; I142-L146 HydrophobicContact CG1-CG 4.35Å; I142-L146 WeakPolarHBondContact O-CG 3.39Å; I142-L146 PolarHBondContact O-N 3.48Å; Y143-L146 HydrophobicContact CD1-CD1 4.38Å; L146-V151 HydrophobicContact CB-CG2 4.12Å; L146-F154 HydrophobicContact CD1-CB 3.73Å; L146-F154 HydrophobicContact CD1-CD1 3.69Å; L146-F154 HydrophobicContact CD1-CD2 3.96Å; L146-F154 HydrophobicContact CD1-CE1 4.26Å; L146-F154 HydrophobicContact CD1-CG 3.52Å; L146-F215 HydrophobicContact CD2-CB 3.82Å; L146-F215 HydrophobicContact CD2-CG 4.26Å
147	H	83.1	Confident	85.4	Confident	49 Å²	49	57.6 Å²	57.6	23%	0.227	28%	0.284	C	S	.	.			trans	-58.9	138.6	169.2	-173.2	-91.4	0	0	0	110.7	K149 D150 V151 S216 Y241	H147-K149 WeakPolarHBondContact ND1-CB 3.18Å; H147-K149 PolarHBondContact ND1-N 2.85Å; H147-K149 PolarHBondContact O-N 3.04Å; H147-D150 HydrophobicContact CB-CB 4.44Å; H147-D150 WeakPolarHBondContact O-CB 3.38Å; H147-D150 PolarHBondContact O-N 3.36Å; H147-V151 PolarHBondContact O-N 2.55Å; H147-S216 WeakPolarHBondContact CB-O 3.17Å; H147-S216 PolarHBondContact N-O 3.09Å; H147-Y241 VanDerWaalsContact CA-CE1 3.49Å; H147-Y241 HydrophobicContact CB-CD1 3.74Å; H147-Y241 HydrophobicContact CB-CE1 3.74Å; H147-Y241 HydrophobicContact CB-CG 4.31Å; H147-Y241 AromaticContact CD2-CD2 3.61Å; H147-Y241 AromaticContact CD2-CE1 3.96Å; H147-Y241 AromaticContact CD2-CE2 3.54Å; H147-Y241 AromaticContact CD2-CG 3.86Å; H147-Y241 AromaticContact CD2-CZ 3.71Å
148	P	85.8	Confident	84.9	Confident	93 Å²	93	57.5 Å²	57.5	60%	0.604	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-32.1	-175.7	-29.9	35.3	0	0	0	115.1	D150	P148-D150 VanDerWaalsContact C-N 3.28Å; P148-D150 PolarHBondContact O-N 3.03Å
149	K	83.7	Confident	84.1	Confident	156 Å²	156	59.7 Å²	59.7	68%	0.678	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-25.5	176.2	-64.9	177.5	-175.3	175.3	0	113.3	H147	H147-K149 WeakPolarHBondContact ND1-CB 3.18Å; H147-K149 PolarHBondContact ND1-N 2.85Å; H147-K149 PolarHBondContact O-N 3.04Å
150	D	84	Confident	83	Confident	4 Å²	4	61.8 Å²	61.8	2%	0.021	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-21.1	-171.9	-71.4	-10.8	0	0	0	112.5	H147 P148 Q152 N153 F154 F215 S216 Q325	H147-D150 HydrophobicContact CB-CB 4.44Å; H147-D150 WeakPolarHBondContact O-CB 3.38Å; H147-D150 PolarHBondContact O-N 3.36Å; P148-D150 VanDerWaalsContact C-N 3.28Å; P148-D150 PolarHBondContact O-N 3.03Å; D150-Q152 VanDerWaalsContact C-N 3.28Å; D150-Q152 PolarHBondContact O-N 2.97Å; D150-N153 PolarHBondContact O-N 3.25Å; D150-N153 VanDerWaalsContact O-N 3.08Å; D150-F154 PolarHBondContact O-N 2.98Å; D150-F215 HydrophobicContact CB-CB 4.32Å; D150-F215 HydrophobicContact CB-CD1 3.88Å; D150-S216 PolarHBondContact OD2-N 2.98Å; D150-S216 PolarHBondContact OD2-OG 2.77Å; D150-Q325 PolarHBondContact OD1-NE2 3.37Å
151	V	86.4	Confident	81.3	Confident	26 Å²	26	65.2 Å²	65.2	16%	0.158	31%	0.311	C	S	.	.	H	α-helix	trans	-52.6	-43.7	-179.1	173.8	0	0	0	0	112.4	Y143 L146 H147 F154 K155	Y143-V151 HydrophobicContact CD1-CG1 3.91Å; L146-V151 HydrophobicContact CB-CG2 4.12Å; H147-V151 PolarHBondContact O-N 2.55Å; V151-F154 PolarHBondContact O-N 2.87Å; V151-K155 HydrophobicContact CG1-CD 4.21Å; V151-K155 WeakPolarHBondContact O-CB 3.42Å; V151-K155 VanDerWaalsContact O-CG 3.3Å; V151-K155 WeakPolarHBondContact O-CG 3.5Å; V151-K155 PolarHBondContact O-N 3.06Å
152	Q	84.6	Confident	78.9	Confident	139 Å²	139	66.7 Å²	66.7	65%	0.65	32%	0.321	S	S	*	.	H	α-helix	trans	-68.4	-39.3	-178.8	-67.8	-171.9	-7.8	0	0	112.3	D150 K155 K156	D150-Q152 VanDerWaalsContact C-N 3.28Å; D150-Q152 PolarHBondContact O-N 2.97Å; Q152-K155 PolarHBondContact O-N 2.99Å; Q152-K156 WeakPolarHBondContact O-CG 3.43Å; Q152-K156 PolarHBondContact O-N 3.19Å; Q152-K156 VanDerWaalsContact O-N 3.08Å
153	N	81.9	Confident	76.2	Confident	62 Å²	62	72.7 Å²	72.7	33%	0.332	36%	0.358	S	S	.	.	H	α-helix	trans	-67	-42.2	177.3	-69.6	-25.4	0	0	0	110.4	D150 K155 K156 Q157 F215	D150-N153 PolarHBondContact O-N 3.25Å; D150-N153 VanDerWaalsContact O-N 3.08Å; N153-K155 PolarHBondContact O-N 2.92Å; N153-K156 PolarHBondContact O-N 2.77Å; N153-Q157 PolarHBondContact O-N 3.19Å; N153-F215 HydrophobicContact CB-CE1 4.12Å
154	F	83.5	Confident	73.4	Confident	1 Å²	1	76 Å²	76	0%	0.004	38%	0.382	C	S	.	.	H	α-helix	trans	-60.4	-46.6	175	-166.3	-100.4	0	0	0	112.3	I142 Y143 L146 D150 V151 K156 Q157 I158 F215 L275	I142-F154 HydrophobicContact CD1-CE1 3.79Å; I142-F154 HydrophobicContact CD1-CE2 4.13Å; I142-F154 HydrophobicContact CD1-CZ 3.41Å; I142-F154 VanDerWaalsContact CD1-CZ 3.41Å; I142-F154 HydrophobicContact CG1-CE1 4.32Å; I142-F154 HydrophobicContact CG1-CZ 4.36Å; I142-F154 HydrophobicContact CG2-CD1 4.35Å; I142-F154 HydrophobicContact CG2-CE1 3.64Å; I142-F154 HydrophobicContact CG2-CZ 4.39Å; Y143-F154 HydrophobicContact CD1-CD1 4.39Å; Y143-F154 AromaticContact CE1-CD1 3.89Å; Y143-F154 HydrophobicContact CE1-CD1 3.89Å; L146-F154 HydrophobicContact CD1-CB 3.73Å; L146-F154 HydrophobicContact CD1-CD1 3.69Å; L146-F154 HydrophobicContact CD1-CD2 3.96Å; L146-F154 HydrophobicContact CD1-CE1 4.26Å; L146-F154 HydrophobicContact CD1-CG 3.52Å; D150-F154 PolarHBondContact O-N 2.98Å; V151-F154 PolarHBondContact O-N 2.87Å; F154-K156 PolarHBondContact O-N 2.92Å; F154-Q157 PolarHBondContact O-N 2.91Å; F154-Q157 VanDerWaalsContact O-N 3.1Å; F154-I158 HydrophobicContact CD1-CD1 3.71Å; F154-I158 HydrophobicContact CD1-CG1 4.18Å; F154-I158 HydrophobicContact CE1-CD1 3.03Å; F154-I158 HydrophobicContact CE1-CG1 3.8Å; F154-I158 HydrophobicContact CZ-CD1 3.59Å; F154-I158 HydrophobicContact CZ-CG1 4.12Å; F154-I158 PolarHBondContact O-N 3.26Å; F154-F215 HydrophobicContact CB-CD1 4.41Å; F154-F215 HydrophobicContact CB-CE1 3.86Å; F154-F215 HydrophobicContact CB-CZ 3.95Å; F154-F215 HydrophobicContact CD2-CD1 4.41Å; F154-F215 AromaticContact CD2-CD2 3.73Å; F154-F215 HydrophobicContact CD2-CD2 3.73Å; F154-F215 HydrophobicContact CD2-CE1 4Å; F154-F215 AromaticContact CD2-CE2 3.26Å; F154-F215 HydrophobicContact CD2-CE2 3.26Å; F154-F215 HydrophobicContact CD2-CG 4.27Å; F154-F215 AromaticContact CD2-CZ 3.39Å; F154-F215 HydrophobicContact CD2-CZ 3.39Å; F154-F215 HydrophobicContact CE2-CD2 4.19Å; F154-F215 AromaticContact CE2-CE2 3.75Å; F154-F215 HydrophobicContact CE2-CE2 3.75Å; F154-F215 HydrophobicContact CE2-CZ 4.27Å; F154-F215 HydrophobicContact CG-CE1 4.47Å; F154-F215 HydrophobicContact CG-CE2 4.38Å; F154-F215 HydrophobicContact CG-CZ 4.14Å; F154-L275 HydrophobicContact CE2-CD2 4.43Å; F154-L275 HydrophobicContact CZ-CD2 3.91Å
155	K	84.8	Confident	70.7	Confident	89 Å²	89	77.6 Å²	77.6	39%	0.387	40%	0.397	S	S	.	.	H	α-helix	trans	-57.5	-46.4	175.9	-77	-178.9	179.2	-179.3	0	111.6	Y143 V151 Q152 N153 Q157 I158 Y159	Y143-K155 HydrophobicContact CD1-CG 4.4Å; Y143-K155 HydrophobicContact CE1-CD 4.25Å; Y143-K155 HydrophobicContact CE1-CG 3.51Å; V151-K155 HydrophobicContact CG1-CD 4.21Å; V151-K155 WeakPolarHBondContact O-CB 3.42Å; V151-K155 VanDerWaalsContact O-CG 3.3Å; V151-K155 WeakPolarHBondContact O-CG 3.5Å; V151-K155 PolarHBondContact O-N 3.06Å; Q152-K155 PolarHBondContact O-N 2.99Å; N153-K155 PolarHBondContact O-N 2.92Å; K155-Q157 PolarHBondContact O-N 3.18Å; K155-I158 PolarHBondContact O-N 3.49Å; K155-Y159 HydrophobicContact CB-CD2 4.06Å; K155-Y159 HydrophobicContact CB-CE2 4.24Å; K155-Y159 HydrophobicContact CG-CD2 4.46Å; K155-Y159 HydrophobicContact CG-CE2 4.14Å; K155-Y159 WeakPolarHBondContact O-CB 3.43Å; K155-Y159 WeakPolarHBondContact O-CD2 3.3Å; K155-Y159 PolarHBondContact O-N 2.82Å
156	K	82.2	Confident	68	Low	135 Å²	135	82.1 Å²	82.1	59%	0.587	43%	0.43	S	S	*	.	H	α-helix	trans	-55.7	-35.9	177.9	-73.8	171.6	-174.7	171.2	0	112	Q152 N153 F154 F160	Q152-K156 WeakPolarHBondContact O-CG 3.43Å; Q152-K156 PolarHBondContact O-N 3.19Å; Q152-K156 VanDerWaalsContact O-N 3.08Å; N153-K156 PolarHBondContact O-N 2.77Å; F154-K156 PolarHBondContact O-N 2.92Å; K156-F160 WeakPolarHBondContact O-CB 3.44Å; K156-F160 PolarHBondContact O-N 2.75Å
157	Q	78	Confident	65.3	Low	58 Å²	58	90.6 Å²	90.6	27%	0.271	47%	0.466	S	S	.	.	H	α-helix	trans	-80.2	-38.8	179.7	-62.8	-150.9	-23.2	0	0	113.9	N153 F154 K155 F160 L211 N212 S213	N153-Q157 PolarHBondContact O-N 3.19Å; F154-Q157 PolarHBondContact O-N 2.91Å; F154-Q157 VanDerWaalsContact O-N 3.1Å; K155-Q157 PolarHBondContact O-N 3.18Å; Q157-F160 PolarHBondContact O-N 3.38Å; Q157-L211 HydrophobicContact CB-CD1 3.42Å; Q157-L211 VanDerWaalsContact CB-CD1 3.42Å; Q157-L211 HydrophobicContact CG-CD1 4.28Å; Q157-L211 VanDerWaalsContact OE1-CG 3.26Å; Q157-N212 PolarHBondContact NE2-O 3.1Å; Q157-N212 VanDerWaalsContact NE2-O 3.09Å; Q157-S213 PolarHBondContact NE2-OG 2.98Å; Q157-S213 PolarHBondContact OE1-OG 2.75Å
158	I	76.4	Confident	63	Low	0 Å²	0	94.6 Å²	94.6	0%	0	49%	0.493	C	S	.	.	H	α-helix	trans	-65.7	-43.3	175.5	-77.3	-168.5	0	0	0	111.8	V112 R114 F154 K155 F160 L250 L275	V112-I158 HydrophobicContact CG1-CD1 4.33Å; R114-I158 HydrophobicContact CB-CG2 4.05Å; R114-I158 HydrophobicContact CG-CG2 3.8Å; R114-I158 PolarHBondContact NE-O 3.23Å; R114-I158 PolarHBondContact NH2-O 3.38Å; F154-I158 HydrophobicContact CD1-CD1 3.71Å; F154-I158 HydrophobicContact CD1-CG1 4.18Å; F154-I158 HydrophobicContact CE1-CD1 3.03Å; F154-I158 HydrophobicContact CE1-CG1 3.8Å; F154-I158 HydrophobicContact CZ-CD1 3.59Å; F154-I158 HydrophobicContact CZ-CG1 4.12Å; F154-I158 PolarHBondContact O-N 3.26Å; K155-I158 PolarHBondContact O-N 3.49Å; I158-F160 VanDerWaalsContact C-N 3.29Å; I158-L250 WeakPolarHBondContact O-CD1 3.43Å; I158-L275 HydrophobicContact CD1-CD2 3.88Å; I158-L275 HydrophobicContact CG1-CD2 3.65Å
159	Y	72.4	Confident	60.4	Low	98 Å²	98	98.1 Å²	98.1	38%	0.384	50%	0.502	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	2.2	-176.6	-65.9	-69.7	0	0	0	113.1	R114 D115 K155 E161	R114-Y159 HydrophobicContact CG-CD1 4.03Å; R114-Y159 HydrophobicContact CG-CE1 3.98Å; R114-Y159 VanDerWaalsContact NH2-C 3.27Å; R114-Y159 WeakPolarHBondContact O-CE1 3.15Å; R114-Y159 PolarHBondContact O-OH 2.86Å; D115-Y159 PolarHBondContact O-OH 3.18Å; D115-Y159 VanDerWaalsContact O-OH 3.1Å; K155-Y159 HydrophobicContact CB-CD2 4.06Å; K155-Y159 HydrophobicContact CB-CE2 4.24Å; K155-Y159 HydrophobicContact CG-CD2 4.46Å; K155-Y159 HydrophobicContact CG-CE2 4.14Å; K155-Y159 WeakPolarHBondContact O-CB 3.43Å; K155-Y159 WeakPolarHBondContact O-CD2 3.3Å; K155-Y159 PolarHBondContact O-N 2.82Å; Y159-E161 PolarHBondContact O-N 3.15Å
160	F	63.4	Low	58	Low	134 Å²	134	96.7 Å²	96.7	59%	0.588	51%	0.506	S	S	*	.			trans	-61.1	107	177.7	-162.1	-98.8	0	0	0	109.6	R114 K156 Q157 I158	R114-F160 PolarHBondContact NH2-O 2.92Å; K156-F160 WeakPolarHBondContact O-CB 3.44Å; K156-F160 PolarHBondContact O-N 2.75Å; Q157-F160 PolarHBondContact O-N 3.38Å; I158-F160 VanDerWaalsContact C-N 3.29Å
161	E	52.8	Low	55.6	Low	146 Å²	146	105.2 Å²	105.2	68%	0.682	54%	0.543	S	S	*	.			trans	-111.6	117.2	170.8	-157.5	163.2	-149.8	0	0	104	Y159 T163	Y159-E161 PolarHBondContact O-N 3.15Å; E161-T163 VanDerWaalsContact C-N 3.35Å; E161-T163 PolarHBondContact O-N 3.1Å
162	S	37.7	Very low	52.9	Low	59 Å²	59	115 Å²	115	41%	0.413	58%	0.577	S	S	.	*			trans	-53.8	106	172.6	56	0	0	0	0	106.7	T164	S162-T164 PolarHBondContact O-N 3.43Å
163	T	31.3	Very low	50.7	Low	131 Å²	131	114 Å²	114	80%	0.804	58%	0.583	S	S	*	*			trans	-64.1	96.7	170.2	-55	0	0	0	0	105	E161	E161-T163 VanDerWaalsContact C-N 3.35Å; E161-T163 PolarHBondContact O-N 3.1Å
164	T	29.8	Very low	48.6	Very low	105 Å²	105	121 Å²	121	64%	0.644	61%	0.611	S	S	*	*			trans	-53.2	128.3	159.8	49.3	0	0	0	0	105.4	S162 S166	S162-T164 PolarHBondContact O-N 3.43Å; T164-S166 PolarHBondContact O-N 2.8Å
165	P	29.3	Very low	46.2	Very low	121 Å²	121	124.6 Å²	124.6	79%	0.786	65%	0.647	S	S	*	*			trans	-62	106.8	175.8	25.8	-30.5	0	0	0	106.3	K167	P165-K167 PolarHBondContact O-N 2.71Å; P165-K167 VanDerWaalsContact O-N 3.07Å
166	S	30.4	Very low	44.2	Very low	104 Å²	104	124.7 Å²	124.7	73%	0.727	67%	0.665	S	S	*	*			trans	-51	122.1	168	-93.7	0	0	0	0	106.4	T164 V168	T164-S166 PolarHBondContact O-N 2.8Å; S166-V168 PolarHBondContact O-N 3.37Å
167	K	30.5	Very low	42.1	Very low	192 Å²	192	126.1 Å²	126.1	84%	0.835	68%	0.679	S	S	*	*			trans	-41.3	105.7	166	-80.2	176	172.8	175.9	0	107.4	P165 E169	P165-K167 PolarHBondContact O-N 2.71Å; P165-K167 VanDerWaalsContact O-N 3.07Å; K167-E169 VanDerWaalsContact C-N 3.34Å; K167-E169 PolarHBondContact O-N 3.37Å
168	V	34.6	Very low	40.2	Very low	133 Å²	133	126.7 Å²	126.7	81%	0.806	70%	0.701	S	S	*	*			trans	-61.5	108.3	162.4	174.8	0	0	0	0	104.5	S166 T170	S166-V168 PolarHBondContact O-N 3.37Å; V168-T170 PolarHBondContact O-N 3.27Å
169	E	30.6	Very low	38.5	Very low	168 Å²	168	137.7 Å²	137.7	79%	0.785	74%	0.742	S	S	*	*			trans	-46.4	106	173.7	-69.3	174.8	148.4	0	0	109	K167 K171	K167-E169 VanDerWaalsContact C-N 3.34Å; K167-E169 PolarHBondContact O-N 3.37Å; E169-K171 VanDerWaalsContact C-N 3.27Å; E169-K171 PolarHBondContact O-N 3.36Å
170	T	32.9	Very low	36.7	Very low	125 Å²	125	140 Å²	140	77%	0.767	76%	0.761	S	S	*	*			trans	-70.3	93.2	165.8	-48	0	0	0	0	106.8	V168 R172	V168-T170 PolarHBondContact O-N 3.27Å; T170-R172 PolarHBondContact O-N 2.85Å
171	K	34.3	Very low	35.9	Very low	184 Å²	184	141.7 Å²	141.7	80%	0.8	78%	0.775	S	S	*	*			trans	-57.3	105.3	162.6	-69.9	-177.3	177.5	179.7	0	107.6	E169	E169-K171 VanDerWaalsContact C-N 3.27Å; E169-K171 PolarHBondContact O-N 3.36Å
172	R	29.9	Very low	35.1	Very low	232 Å²	232	139.1 Å²	139.1	88%	0.875	77%	0.772	S	S	*	*			trans	-84.2	123.4	162.2	-65.1	-173.9	-159.6	-175.9	4.6	108.1	T170	T170-R172 PolarHBondContact O-N 2.85Å
173	P	38.4	Very low	35.1	Very low	118 Å²	118	145.2 Å²	145.2	77%	0.766	80%	0.795	S	S	*	*			trans	-87.9	129.6	156	12.8	5.7	0	0	0	109.7
174	F	37.1	Very low	35.5	Very low	209 Å²	209	142.7 Å²	142.7	92%	0.917	79%	0.787	S	S	*	*			trans	-2.9	130.5	153.6	-73.8	-98.4	0	0	0	119.8
175	G	33.7	Very low	35.7	Very low	75 Å²	75	144.8 Å²	144.8	77%	0.773	79%	0.794	S	S	*	*				98.4	134.7	118.6	0	0	0	0	0	119.1
176	A	41.9	Very low	36.1	Very low	92 Å²	92	144.3 Å²	144.3	76%	0.76	79%	0.794	S	S	*	*			trans	92.5	104.2	158.6	0	0	0	0	0	118.8
177	D	38.4	Very low	36.2	Very low	164 Å²	164	143.9 Å²	143.9	88%	0.877	79%	0.791	S	S	*	*			trans	69.5	112.4	132.6	-61.1	-14	0	0	0	121.8
178	G	39.2	Very low	36.5	Very low	70 Å²	70	140.7 Å²	140.7	72%	0.722	79%	0.787	S	S	*	*				119.2	113.5	115.1	0	0	0	0	0	118.2
179	R	39.6	Very low	36.4	Very low	232 Å²	232	140.6 Å²	140.6	88%	0.875	79%	0.787	S	S	*	*			trans	83.1	102.6	147.3	-68.9	179	-95.3	-172.1	-6.9	119.3
180	D	35.4	Very low	36.3	Very low	145 Å²	145	137.7 Å²	137.7	78%	0.775	79%	0.785	S	S	*	*				30.4	130	117.7	-50.5	-37	0	0	0	119.2
181	I	46.2	Very low	36.2	Very low	171 Å²	171	138 Å²	138	88%	0.877	79%	0.791	S	S	*	*				-176.5	136.8	109.8	-78.6	145	0	0	0	109.2
182	S	34.9	Very low	35.7	Very low	91 Å²	91	137.8 Å²	137.8	64%	0.636	79%	0.793	S	S	*	*			trans	-88	178.8	-178.5	45.6	0	0	0	0	114.1
183	E	39.3	Very low	35.8	Very low	188 Å²	188	132.8 Å²	132.8	88%	0.879	79%	0.79	S	S	*	*			trans	90.4	146.1	161.6	-56.2	-179	173.6	0	0	116.7
184	A	39.8	Very low	35.2	Very low	78 Å²	78	135 Å²	135	65%	0.645	79%	0.794	S	S	*	*			cis	-172.9	153.4	-20.5	0	0	0	0	0	106.3
185	D	33.7	Very low	34.9	Very low	148 Å²	148	127.8 Å²	127.8	79%	0.791	78%	0.779	S	S	*	*			trans	67.1	127.8	144	-65.5	-16	0	0	0	125.4
186	S	36.5	Very low	34.8	Very low	112 Å²	112	130.6 Å²	130.6	78%	0.783	78%	0.783	S	S	*	*			trans	80.6	150	137.4	78.6	0	0	0	0	118.5
187	S	32.3	Very low	34.2	Very low	95 Å²	95	131.6 Å²	131.6	66%	0.664	79%	0.785	S	S	*	*			cis	-176.9	156.5	-32.6	50.3	0	0	0	0	105.4
188	V	37.2	Very low	33.6	Very low	124 Å²	124	129.5 Å²	129.5	75%	0.752	78%	0.782	S	S	*	*			trans	76.5	118.2	164.7	-151.3	0	0	0	0	114.3
189	T	32.5	Very low	33.2	Very low	132 Å²	132	136 Å²	136	81%	0.81	79%	0.793	S	S	*	*				-172.3	142.8	63.6	-32.5	0	0	0	0	109.9
190	S	28.6	Very low	32.7	Very low	106 Å²	106	128 Å²	128	74%	0.741	78%	0.783	S	S	*	*			trans	-75.8	140.3	-179.5	52.4	0	0	0	0	114.7
191	C	30.5	Very low	32.3	Very low	132 Å²	132	130.6 Å²	130.6	89%	0.892	79%	0.791	S	S	*	*			trans	-169.6	118.7	142.8	-98.4	0	0	0	0	110.1
192	E	24.2	Very low	31.5	Very low	180 Å²	180	127.5 Å²	127.5	84%	0.841	78%	0.784	S	S	*	*			trans	-72	156.3	179.2	-65.3	-171.3	151	0	0	113.6
193	P	31.5	Very low	31	Very low	126 Å²	126	131.4 Å²	131.4	82%	0.818	80%	0.798	S	S	*	*			trans	-124.8	132.1	130.3	17.6	1.1	0	0	0	112.3	G195	P193-G195 PolarHBondContact O-N 2.94Å
194	I	27.6	Very low	30.5	Very low	165 Å²	165	127.2 Å²	127.2	85%	0.846	79%	0.789	S	S	*	*			trans	-53.6	119.6	177.4	-63.5	157.9	0	0	0	111.3
195	G	29	Very low	29.7	Very low	58 Å²	58	127.1 Å²	127.1	60%	0.598	80%	0.796	S	S	*	*			trans	-125.5	143	164.4	0	0	0	0	0	109.6	P193 S197	P193-G195 PolarHBondContact O-N 2.94Å; G195-S197 PolarHBondContact O-N 2.95Å
196	P	33.1	Very low	29.4	Very low	133 Å²	133	123.4 Å²	123.4	86%	0.864	78%	0.781	S	S	*	*			trans	-70.8	123.4	-178.5	27.7	-29.4	0	0	0	110.4
197	S	28.3	Very low	28.8	Very low	114 Å²	114	121.1 Å²	121.1	80%	0.797	77%	0.769	S	S	*	*			trans	-21	124.5	176.7	57.1	0	0	0	0	117.9	G195	G195-S197 PolarHBondContact O-N 2.95Å
198	C	26.2	Very low	28.6	Very low	120 Å²	120	124.7 Å²	124.7	81%	0.811	77%	0.768	S	S	*	*			trans	-68.7	153.1	147.7	-49.7	0	0	0	0	110.3
199	E	32	Very low	28.3	Very low	205 Å²	205	120.1 Å²	120.1	96%	0.958	74%	0.742	S	S	*	*			trans	173.1	131.6	143.8	-98.4	169.6	-150	0	0	106.7
200	G	29.1	Very low	28.3	Very low	65 Å²	65	118.5 Å²	118.5	67%	0.67	74%	0.735	S	S	*	*			cis	156.1	133.3	19.5	0	0	0	0	0	104.6	S202	G200-S202 PolarHBondContact O-N 3.14Å
201	Q	26.2	Very low	28.8	Very low	199 Å²	199	113.7 Å²	113.7	93%	0.93	70%	0.701	S	S	*	*			trans	-57.1	123.3	-175.3	-70.5	165.3	1.7	0	0	112.3
202	S	28.2	Very low	29.7	Very low	106 Å²	106	112 Å²	112	74%	0.741	68%	0.684	S	S	*	*			trans	-163.8	98.3	151.4	57.1	0	0	0	0	112	G200 S204	G200-S202 PolarHBondContact O-N 3.14Å; S202-S204 PolarHBondContact O-N 2.91Å
203	N	26	Very low	31.1	Very low	173 Å²	173	104.2 Å²	104.2	93%	0.925	65%	0.649	S	S	*	*	S	Bend	trans	14.4	73.4	151	-61.5	-12.4	0	0	0	119.1
204	S	27.8	Very low	32.1	Very low	100 Å²	100	99 Å²	99	70%	0.699	61%	0.614	S	S	*	*			trans	-174.3	105.7	139.1	55.2	0	0	0	0	107.7	S202 C206	S202-S204 PolarHBondContact O-N 2.91Å; S204-C206 PolarHBondContact O-N 3.29Å
205	G	24	Very low	33.5	Very low	76 Å²	76	91.3 Å²	91.3	78%	0.784	57%	0.574	S	S	*	*			trans	-62.8	113.5	-172.7	0	0	0	0	0	113.4
206	C	26	Very low	34.7	Very low	71 Å²	71	89.5 Å²	89.5	48%	0.48	55%	0.552	S	S	.	*			trans	-142	94.2	149.9	-100.8	0	0	0	0	106.1	S204 R208 C252	S204-C206 PolarHBondContact O-N 3.29Å; C206-R208 PolarHBondContact O-N 3.05Å; C206-C252 WeakPolarHBondContact SG-CB 3.45Å
207	A	24	Very low	35.8	Very low	64 Å²	64	83.7 Å²	83.7	53%	0.529	52%	0.515	S	S	.	.			trans	-78.2	115.2	168.3	0	0	0	0	0	107.4	S209	A207-S209 PolarHBondContact O-N 3Å
208	R	29.2	Very low	36.8	Very low	169 Å²	169	79 Å²	79	64%	0.638	48%	0.48	S	S	*	.			trans	-67.8	100.1	169	-71.1	178.7	174	-173.2	-6.6	107.9	E81 C206	E81-R208 VanDerWaalsContact CG-NH2 3.31Å; E81-R208 IonicContact OE1-CZ 2.68Å; E81-R208 IonicContact OE1-NE 2.75Å; E81-R208 PolarHBondContact OE1-NE 3.32Å; E81-R208 IonicContact OE1-NH2 3.6Å; E81-R208 PolarHBondContact OE1-NH2 3.14Å; C206-R208 PolarHBondContact O-N 3.05Å
209	S	30	Very low	37.8	Very low	29 Å²	29	74.8 Å²	74.8	20%	0.203	45%	0.452	C	S	.	.			trans	-96.6	115.5	168	63.2	0	0	0	0	108.6	A207 L211 F249 L250	A207-S209 PolarHBondContact O-N 3Å; S209-L211 PolarHBondContact O-N 3.12Å; S209-F249 WeakPolarHBondContact O-CA 2.91Å; S209-L250 PolarHBondContact O-N 2.83Å; S209-L250 WeakPolarHBondContact OG-CD1 3.4Å; S209-L250 WeakPolarHBondContact OG-CG 3.17Å
210	S	32.4	Very low	38.2	Very low	97 Å²	97	67.2 Å²	67.2	68%	0.678	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	125.4	168.5	52.3	0	0	0	0	109.5	G248	S210-G248 CarbonylContact C-O 3.57Å; S210-G248 VanDerWaalsContact CA-O 3.24Å; S210-G248 WeakPolarHBondContact CA-O 3.12Å
211	L	40.4	Very low	38.5	Very low	5 Å²	5	67.8 Å²	67.8	3%	0.026	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	116.7	169.4	-168.7	94.4	0	0	0	107.7	Q157 S209 C246 T247 G248 L275 F277	Q157-L211 HydrophobicContact CB-CD1 3.42Å; Q157-L211 VanDerWaalsContact CB-CD1 3.42Å; Q157-L211 HydrophobicContact CG-CD1 4.28Å; Q157-L211 VanDerWaalsContact OE1-CG 3.26Å; S209-L211 PolarHBondContact O-N 3.12Å; L211-C246 HydrophobicContact CD2-CB 3.92Å; L211-T247 CarbonylContact O-C 3.5Å; L211-T247 VanDerWaalsContact O-CA 3.24Å; L211-T247 WeakPolarHBondContact O-CA 3.46Å; L211-G248 PolarHBondContact N-O 3.08Å; L211-G248 PolarHBondContact O-N 3.08Å; L211-L275 HydrophobicContact CB-CD1 4Å; L211-L275 HydrophobicContact CD1-CD1 4.07Å; L211-L275 HydrophobicContact CD1-CD2 4.13Å; L211-L275 HydrophobicContact CD2-CD1 4.19Å; L211-L275 HydrophobicContact CD2-CD2 3.92Å; L211-L275 HydrophobicContact CG-CD1 4.33Å; L211-F277 HydrophobicContact CD2-CB 4.17Å; L211-F277 HydrophobicContact CD2-CG 4.4Å
212	N	48.6	Very low	39.2	Very low	98 Å²	98	60.8 Å²	60.8	52%	0.524	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	113.8	163.1	-74.6	-5.2	0	0	0	106.4	Q157 C246	Q157-N212 PolarHBondContact NE2-O 3.1Å; Q157-N212 VanDerWaalsContact NE2-O 3.09Å; N212-C246 WeakPolarHBondContact CA-O 3.49Å
213	S	52.6	Low	39.5	Very low	16 Å²	16	60.8 Å²	60.8	11%	0.112	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	157.1	178	-92.2	0	0	0	0	113.7	Q157 F215 H245 C246	Q157-S213 PolarHBondContact NE2-OG 2.98Å; Q157-S213 PolarHBondContact OE1-OG 2.75Å; S213-F215 WeakPolarHBondContact OG-CZ 3.43Å; S213-H245 CarbonylContact O-C 3.56Å; S213-H245 WeakPolarHBondContact O-CA 3.4Å; S213-H245 PolarHBondContact O-CD2 3.03Å; S213-C246 PolarHBondContact N-O 3.16Å; S213-C246 VanDerWaalsContact N-O 3.1Å; S213-C246 PolarHBondContact O-N 3.47Å
214	E	53.3	Low	40	Very low	16 Å²	16	59 Å²	59	8%	0.075	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	128.6	170.9	-64	153.3	-151.3	0	0	109.6	F244 F314 A317 P323 S324	E214-F244 CarbonylContact C-O 3.58Å; E214-F244 WeakPolarHBondContact CA-O 3.22Å; E214-F314 HydrophobicContact CG-CD2 4.13Å; E214-F314 HydrophobicContact CG-CE2 4.45Å; E214-F314 VanDerWaalsContact OE1-CD2 3.23Å; E214-F314 WeakPolarHBondContact OE1-CD2 3.36Å; E214-A317 WeakPolarHBondContact OE1-CB 3.43Å; E214-A317 WeakPolarHBondContact OE2-CB 3.18Å; E214-P323 HydrophobicContact CB-CB 4.36Å; E214-P323 WeakPolarHBondContact OE2-CA 3.2Å; E214-S324 PolarHBondContact OE1-OG 3.24Å; E214-S324 PolarHBondContact OE2-N 3.4Å; E214-S324 PolarHBondContact OE2-OG 3.36Å; E214-S324 VanDerWaalsContact OE2-OG 3.08Å
215	F	57.3	Low	40.4	Very low	4 Å²	4	57.6 Å²	57.6	2%	0.018	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	150.8	174.4	-49.4	-72.1	0	0	0	111.1	L146 D150 N153 F154 S213 A243 F244	L146-F215 HydrophobicContact CD2-CB 3.82Å; L146-F215 HydrophobicContact CD2-CG 4.26Å; D150-F215 HydrophobicContact CB-CB 4.32Å; D150-F215 HydrophobicContact CB-CD1 3.88Å; N153-F215 HydrophobicContact CB-CE1 4.12Å; F154-F215 HydrophobicContact CB-CD1 4.41Å; F154-F215 HydrophobicContact CB-CE1 3.86Å; F154-F215 HydrophobicContact CB-CZ 3.95Å; F154-F215 HydrophobicContact CD2-CD1 4.41Å; F154-F215 AromaticContact CD2-CD2 3.73Å; F154-F215 HydrophobicContact CD2-CD2 3.73Å; F154-F215 HydrophobicContact CD2-CE1 4Å; F154-F215 AromaticContact CD2-CE2 3.26Å; F154-F215 HydrophobicContact CD2-CE2 3.26Å; F154-F215 HydrophobicContact CD2-CG 4.27Å; F154-F215 AromaticContact CD2-CZ 3.39Å; F154-F215 HydrophobicContact CD2-CZ 3.39Å; F154-F215 HydrophobicContact CE2-CD2 4.19Å; F154-F215 AromaticContact CE2-CE2 3.75Å; F154-F215 HydrophobicContact CE2-CE2 3.75Å; F154-F215 HydrophobicContact CE2-CZ 4.27Å; F154-F215 HydrophobicContact CG-CE1 4.47Å; F154-F215 HydrophobicContact CG-CE2 4.38Å; F154-F215 HydrophobicContact CG-CZ 4.14Å; S213-F215 WeakPolarHBondContact OG-CZ 3.43Å; F215-A243 CarbonylContact O-C 3.5Å; F215-A243 WeakPolarHBondContact O-CA 3.35Å; F215-F244 PolarHBondContact N-O 3.34Å; F215-F244 PolarHBondContact O-N 3.16Å
216	S	54.2	Low	41.3	Very low	20 Å²	20	63 Å²	63	14%	0.14	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	123.7	177.1	-42.6	0	0	0	0	109.5	H147 D150 V242	H147-S216 WeakPolarHBondContact CB-O 3.17Å; H147-S216 PolarHBondContact N-O 3.09Å; D150-S216 PolarHBondContact OD2-N 2.98Å; D150-S216 PolarHBondContact OD2-OG 2.77Å; S216-V242 CarbonylContact C-O 3.54Å; S216-V242 VanDerWaalsContact CA-O 3.24Å; S216-V242 WeakPolarHBondContact CA-O 3.25Å
217	S	56.4	Low	42.1	Very low	11 Å²	11	64 Å²	64	8%	0.077	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	158	174.5	69.8	0	0	0	0	112	L130 L145 Y241 V242 F244	L130-S217 VanDerWaalsContact CD2-OG 3.25Å; L130-S217 WeakPolarHBondContact CD2-OG 3.4Å; L145-S217 VanDerWaalsContact O-CA 3.31Å; L145-S217 WeakPolarHBondContact O-CA 3.25Å; L145-S217 WeakPolarHBondContact O-CB 3.47Å; S217-Y241 CarbonylContact O-C 3.36Å; S217-Y241 VanDerWaalsContact O-CA 3.3Å; S217-Y241 WeakPolarHBondContact O-CA 3.44Å; S217-V242 PolarHBondContact N-O 3.22Å; S217-V242 PolarHBondContact O-N 3.48Å; S217-F244 WeakPolarHBondContact OG-CD2 3.36Å; S217-F244 WeakPolarHBondContact OG-CE2 3.47Å
218	L	48.9	Very low	43.2	Very low	14 Å²	14	64.8 Å²	64.8	7%	0.073	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-51.6	134.8	179.8	-57	166.9	0	0	0	112.1	L130 L145 L232 V239 Y241	L130-L218 WeakPolarHBondContact CD2-O 3.42Å; L145-L218 HydrophobicContact CD2-CD1 4.46Å; L145-L218 PolarHBondContact O-N 3.24Å; L218-L232 HydrophobicContact CD1-CD1 3.66Å; L218-L232 HydrophobicContact CD1-CD2 4.35Å; L218-L232 HydrophobicContact CD2-CD2 4.07Å; L218-V239 HydrophobicContact CD2-CB 4.41Å; L218-V239 HydrophobicContact CD2-CG1 2.96Å; L218-V239 HydrophobicContact CG-CG1 4.41Å; L218-Y241 HydrophobicContact CD2-CD1 4.37Å; L218-Y241 HydrophobicContact CD2-CE1 3.69Å; L218-Y241 HydrophobicContact CD2-CE2 4.38Å; L218-Y241 HydrophobicContact CG-CE1 4.14Å
219	P	47.5	Very low	43.9	Very low	33 Å²	33	58.4 Å²	58.4	21%	0.214	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-104	159.3	169.8	38.2	-28.1	0	0	0	110.2	N240 V242	P219-N240 WeakPolarHBondContact CD-O 3.15Å; P219-N240 VanDerWaalsContact CG-C 3.47Å; P219-N240 HydrophobicContact CG-CB 3.22Å; P219-V242 HydrophobicContact CB-CB 4.5Å; P219-V242 HydrophobicContact CB-CG2 3.59Å; P219-V242 HydrophobicContact CG-CG2 4.16Å
220	A	40.6	Very low	44.4	Very low	45 Å²	45	61.9 Å²	61.9	37%	0.372	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-91	121.7	171	0	0	0	0	0	111.6	S131	S131-A220 WeakPolarHBondContact OG-CB 3.43Å
221	G	35.3	Very low	44.6	Very low	77 Å²	77	61.5 Å²	61.5	79%	0.794	38%	0.378	S	S	*	.			trans	-147	72.3	165.4	0	0	0	0	0	108.6
222	G	40.8	Very low	44.5	Very low	52 Å²	52	64.3 Å²	64.3	54%	0.536	39%	0.392	S	S	.	.	S	Bend	trans	-176.8	151.8	176.6	0	0	0	0	0	112.7
223	P	33.7	Very low	43.9	Very low	106 Å²	106	65.8 Å²	65.8	69%	0.688	41%	0.405	S	S	*	.			trans	-63.2	157.5	176.1	28.8	-33.2	0	0	0	110.7	T225	P223-T225 PolarHBondContact O-N 2.58Å
224	P	36.7	Very low	42.8	Very low	135 Å²	135	68.4 Å²	68.4	88%	0.877	42%	0.423	S	S	*	.			trans	-66	107.5	-171.5	29	-33.3	0	0	0	109.1
225	T	36.8	Very low	42.1	Very low	71 Å²	71	74 Å²	74	44%	0.436	46%	0.459	S	S	.	.			trans	-111.9	130.4	163.7	61	0	0	0	0	107.5	P223 N227	P223-T225 PolarHBondContact O-N 2.58Å; T225-N227 PolarHBondContact O-N 2.88Å
226	H	43.2	Very low	41.1	Very low	189 Å²	189	80.7 Å²	80.7	88%	0.875	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.3	9.8	-165.4	-116.8	-81.3	0	0	0	115.9
227	N	42.2	Very low	40.4	Very low	92 Å²	92	85.1 Å²	85.1	49%	0.492	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.1	34.8	-165.5	-72.3	-26.8	0	0	0	113.9	T225 L229 T230 Q231	T225-N227 PolarHBondContact O-N 2.88Å; N227-L229 VanDerWaalsContact C-N 3.31Å; N227-L229 PolarHBondContact O-N 3.1Å; N227-T230 PolarHBondContact O-N 3.27Å; N227-Q231 PolarHBondContact O-N 3.19Å
228	H	47.8	Very low	40.2	Very low	82 Å²	82	90.7 Å²	90.7	38%	0.38	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.6	-35	-174	-124.7	-74.1	0	0	0	112.8	L232	H228-L232 WeakPolarHBondContact O-CG 3.45Å
229	L	43.6	Very low	40.7	Very low	34 Å²	34	92.9 Å²	92.9	18%	0.178	57%	0.568	C	S	.	*	T	Hydrogen-bonded Turn	trans	-69.8	-33.8	177.3	-125.5	76.2	0	0	0	113.2	I132 H140 L145 N227 L232	I132-L229 HydrophobicContact CD1-CD1 4.3Å; H140-L229 WeakPolarHBondContact CE1-CD2 3.4Å; H140-L229 VanDerWaalsContact ND1-CD2 3.25Å; H140-L229 WeakPolarHBondContact ND1-CD2 3.24Å; L145-L229 HydrophobicContact CD2-CD1 4.45Å; N227-L229 VanDerWaalsContact C-N 3.31Å; N227-L229 PolarHBondContact O-N 3.1Å; L229-L232 HydrophobicContact CD1-CD1 4.48Å
230	T	41.1	Very low	41.8	Very low	102 Å²	102	96.5 Å²	96.5	63%	0.626	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-17.8	-176.9	-19.7	0	0	0	0	113.1	N227	N227-T230 PolarHBondContact O-N 3.27Å
231	Q	36.6	Very low	43.5	Very low	90 Å²	90	98.1 Å²	98.1	42%	0.421	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.8	-8.6	176.1	-73.7	-177.3	9.6	0	0	113.7	N227 T233 S234	N227-Q231 PolarHBondContact O-N 3.19Å; Q231-T233 VanDerWaalsContact C-N 3.27Å; Q231-T233 PolarHBondContact O-N 3.41Å; Q231-S234 PolarHBondContact O-N 2.92Å; Q231-S234 PolarHBondContact O-OG 3.46Å
232	L	38.3	Very low	45.5	Very low	64 Å²	64	96.5 Å²	96.5	34%	0.335	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.4	-5.4	-175.4	-69.7	162.8	0	0	0	114.4	L218 H228 L229 V239	L218-L232 HydrophobicContact CD1-CD1 3.66Å; L218-L232 HydrophobicContact CD1-CD2 4.35Å; L218-L232 HydrophobicContact CD2-CD2 4.07Å; H228-L232 WeakPolarHBondContact O-CG 3.45Å; L229-L232 HydrophobicContact CD1-CD1 4.48Å; L232-V239 HydrophobicContact CD2-CG1 4.24Å; L232-V239 HydrophobicContact CD2-CG2 3.8Å
233	T	34	Very low	47.5	Very low	129 Å²	129	95 Å²	95	79%	0.791	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-1.1	176.4	59.1	0	0	0	0	113.6	Q231	Q231-T233 VanDerWaalsContact C-N 3.27Å; Q231-T233 PolarHBondContact O-N 3.41Å
234	S	31.6	Very low	50	Low	70 Å²	70	90.2 Å²	90.2	49%	0.49	51%	0.508	S	S	.	.	S	Bend	trans	-92.7	130	172.3	57.7	0	0	0	0	110.6	Q231 D236	Q231-S234 PolarHBondContact O-N 2.92Å; Q231-S234 PolarHBondContact O-OG 3.46Å; S234-D236 PolarHBondContact O-N 3.3Å
235	T	37.2	Very low	52.3	Low	135 Å²	135	84.3 Å²	84.3	83%	0.828	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	5.4	-166.8	45.7	0	0	0	0	116.1
236	D	36.1	Very low	54.6	Low	144 Å²	144	81.3 Å²	81.3	77%	0.77	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.3	7.6	-159.7	-82.8	-16.8	0	0	0	117	S234	S234-D236 PolarHBondContact O-N 3.3Å
237	N	40.3	Very low	56.5	Low	113 Å²	113	74.6 Å²	74.6	60%	0.604	42%	0.423	S	S	*	.	S	Bend	trans	-111.5	127.8	174.5	-81.8	-20.2	0	0	0	111.3	V239	N237-V239 VanDerWaalsContact C-N 3.3Å; N237-V239 WeakPolarHBondContact O-CG2 3.41Å; N237-V239 PolarHBondContact O-N 3.5Å
238	C	51.6	Low	58.3	Low	128 Å²	128	71 Å²	71	87%	0.865	41%	0.407	S	S	*	.			trans	-62.1	92.1	171.6	-82.6	0	0	0	0	109.7	N240	C238-N240 PolarHBondContact O-N 2.94Å
239	V	60.5	Low	59.7	Low	59 Å²	59	72 Å²	72	36%	0.358	41%	0.411	S	S	.	.			trans	-73.7	113	171.9	-180	0	0	0	0	107.5	L218 L232 N237 Y241	L218-V239 HydrophobicContact CD2-CB 4.41Å; L218-V239 HydrophobicContact CD2-CG1 2.96Å; L218-V239 HydrophobicContact CG-CG1 4.41Å; L232-V239 HydrophobicContact CD2-CG1 4.24Å; L232-V239 HydrophobicContact CD2-CG2 3.8Å; N237-V239 VanDerWaalsContact C-N 3.3Å; N237-V239 WeakPolarHBondContact O-CG2 3.41Å; N237-V239 PolarHBondContact O-N 3.5Å; V239-Y241 HydrophobicContact CB-CE2 3.99Å; V239-Y241 HydrophobicContact CG1-CD2 4.2Å; V239-Y241 HydrophobicContact CG1-CE2 3.56Å; V239-Y241 WeakPolarHBondContact O-CD2 3.24Å
240	N	69	Low	61	Low	110 Å²	110	71 Å²	71	59%	0.588	41%	0.406	S	S	*	.			trans	-67.4	161.2	172	-70.1	-32.8	0	0	0	108.8	P219 C238	P219-N240 WeakPolarHBondContact CD-O 3.15Å; P219-N240 VanDerWaalsContact CG-C 3.47Å; P219-N240 HydrophobicContact CG-CB 3.22Å; C238-N240 PolarHBondContact O-N 2.94Å
241	Y	76.2	Confident	62.3	Low	79 Å²	79	67 Å²	67	31%	0.31	38%	0.38	S	S	.	.			trans	-139.2	144.7	172.1	-73.4	-96.2	0	0	0	108.8	H147 S217 L218 V239	H147-Y241 VanDerWaalsContact CA-CE1 3.49Å; H147-Y241 HydrophobicContact CB-CD1 3.74Å; H147-Y241 HydrophobicContact CB-CE1 3.74Å; H147-Y241 HydrophobicContact CB-CG 4.31Å; H147-Y241 AromaticContact CD2-CD2 3.61Å; H147-Y241 AromaticContact CD2-CE1 3.96Å; H147-Y241 AromaticContact CD2-CE2 3.54Å; H147-Y241 AromaticContact CD2-CG 3.86Å; H147-Y241 AromaticContact CD2-CZ 3.71Å; S217-Y241 CarbonylContact O-C 3.36Å; S217-Y241 VanDerWaalsContact O-CA 3.3Å; S217-Y241 WeakPolarHBondContact O-CA 3.44Å; L218-Y241 HydrophobicContact CD2-CD1 4.37Å; L218-Y241 HydrophobicContact CD2-CE1 3.69Å; L218-Y241 HydrophobicContact CD2-CE2 4.38Å; L218-Y241 HydrophobicContact CG-CE1 4.14Å; V239-Y241 HydrophobicContact CB-CE2 3.99Å; V239-Y241 HydrophobicContact CG1-CD2 4.2Å; V239-Y241 HydrophobicContact CG1-CE2 3.56Å; V239-Y241 WeakPolarHBondContact O-CD2 3.24Å
242	V	79.3	Confident	63.2	Low	43 Å²	43	64.3 Å²	64.3	26%	0.261	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	130.9	177	169.2	0	0	0	0	108.8	S216 S217 P219 F244	S216-V242 CarbonylContact C-O 3.54Å; S216-V242 VanDerWaalsContact CA-O 3.24Å; S216-V242 WeakPolarHBondContact CA-O 3.25Å; S217-V242 PolarHBondContact N-O 3.22Å; S217-V242 PolarHBondContact O-N 3.48Å; P219-V242 HydrophobicContact CB-CB 4.5Å; P219-V242 HydrophobicContact CB-CG2 3.59Å; P219-V242 HydrophobicContact CG-CG2 4.16Å; V242-F244 HydrophobicContact CB-CE2 3.78Å; V242-F244 HydrophobicContact CB-CZ 4.26Å; V242-F244 HydrophobicContact CG1-CD2 4.24Å; V242-F244 HydrophobicContact CG1-CE1 4.5Å; V242-F244 HydrophobicContact CG1-CE2 3.57Å; V242-F244 HydrophobicContact CG1-CZ 3.72Å; V242-F244 WeakPolarHBondContact O-CD2 3.3Å; V242-F244 WeakPolarHBondContact O-CE2 3.32Å
243	A	82.7	Confident	64.1	Low	20 Å²	20	65.8 Å²	65.8	17%	0.165	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	127.3	177.4	0	0	0	0	0	111	F215 L282	F215-A243 CarbonylContact O-C 3.5Å; F215-A243 WeakPolarHBondContact O-CA 3.35Å; A243-L282 HydrophobicContact CB-CB 3.95Å; A243-L282 HydrophobicContact CB-CD2 3.98Å; A243-L282 WeakPolarHBondContact O-CB 3.34Å; A243-L282 PolarHBondContact O-N 3.02Å
244	F	85.4	Confident	64.4	Low	5 Å²	5	62.9 Å²	62.9	2%	0.022	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	137.4	174.3	-69.1	-88.7	0	0	0	110.3	F108 Y129 L130 E214 F215 S217 V242 A279 R280 P281	F108-F244 HydrophobicContact CD1-CE1 4.44Å; F108-F244 AromaticContact CE1-CD1 3.9Å; F108-F244 HydrophobicContact CE1-CD1 3.9Å; F108-F244 AromaticContact CE1-CE1 3.63Å; F108-F244 HydrophobicContact CE1-CE1 3.63Å; F108-F244 HydrophobicContact CE1-CZ 4.2Å; Y129-F244 HydrophobicContact CD1-CE1 4.28Å; Y129-F244 HydrophobicContact CG-CE1 4.18Å; L130-F244 HydrophobicContact CD2-CE2 4.21Å; L130-F244 HydrophobicContact CD2-CZ 4.27Å; E214-F244 CarbonylContact C-O 3.58Å; E214-F244 WeakPolarHBondContact CA-O 3.22Å; F215-F244 PolarHBondContact N-O 3.34Å; F215-F244 PolarHBondContact O-N 3.16Å; S217-F244 WeakPolarHBondContact OG-CD2 3.36Å; S217-F244 WeakPolarHBondContact OG-CE2 3.47Å; V242-F244 HydrophobicContact CB-CE2 3.78Å; V242-F244 HydrophobicContact CB-CZ 4.26Å; V242-F244 HydrophobicContact CG1-CD2 4.24Å; V242-F244 HydrophobicContact CG1-CE1 4.5Å; V242-F244 HydrophobicContact CG1-CE2 3.57Å; V242-F244 HydrophobicContact CG1-CZ 3.72Å; V242-F244 WeakPolarHBondContact O-CD2 3.3Å; V242-F244 WeakPolarHBondContact O-CE2 3.32Å; F244-A279 HydrophobicContact CB-CB 4.32Å; F244-A279 HydrophobicContact CD1-CB 4.18Å; F244-A279 HydrophobicContact CG-CB 4.48Å; F244-R280 CarbonylContact C-O 3.5Å; F244-R280 WeakPolarHBondContact CA-O 3.07Å; F244-P281 HydrophobicContact CD1-CB 4.25Å; F244-P281 HydrophobicContact CE1-CB 3.98Å
245	H	84.8	Confident	64.8	Low	12 Å²	12	63.4 Å²	63.4	6%	0.056	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	119.5	163.4	-178.8	-125.9	0	0	0	110.2	S213 T247 A279 R280 L285 F314	S213-H245 CarbonylContact O-C 3.56Å; S213-H245 WeakPolarHBondContact O-CA 3.4Å; S213-H245 PolarHBondContact O-CD2 3.03Å; H245-T247 WeakPolarHBondContact CE1-CG2 3.28Å; H245-A279 WeakPolarHBondContact O-CA 3.42Å; H245-R280 PolarHBondContact N-O 2.75Å; H245-R280 PolarHBondContact O-N 3.26Å; H245-L285 HydrophobicContact CB-CD1 3.62Å; H245-F314 HydrophobicContact CB-CD2 4.47Å; H245-F314 HydrophobicContact CB-CE2 3.53Å; H245-F314 HydrophobicContact CB-CZ 4Å; H245-F314 AromaticContact CD2-CD2 3.23Å; H245-F314 WeakPolarHBondContact CD2-CD2 2.96Å; H245-F314 AromaticContact CD2-CE2 3.07Å; H245-F314 WeakPolarHBondContact CD2-CE2 3.42Å; H245-F314 AromaticContact CD2-CZ 3.73Å; H245-F314 AromaticContact CE1-CD2 3.93Å; H245-F314 AromaticContact CE1-CE1 3.68Å; H245-F314 AromaticContact CE1-CE2 3.59Å; H245-F314 AromaticContact CE1-CZ 3.4Å; H245-F314 VanDerWaalsContact CE1-CZ 3.4Å; H245-F314 WeakPolarHBondContact CE1-CZ 3.16Å; H245-F314 AromaticContact CG-CD2 3.76Å; H245-F314 AromaticContact CG-CE2 3.06Å; H245-F314 AromaticContact CG-CZ 3.41Å; H245-F314 VanDerWaalsContact CG-CZ 3.41Å; H245-F314 AromaticContact ND1-CE1 3.94Å; H245-F314 AromaticContact ND1-CE2 3.43Å; H245-F314 WeakPolarHBondContact ND1-CE2 3.47Å; H245-F314 AromaticContact ND1-CZ 3.22Å; H245-F314 WeakPolarHBondContact ND1-CZ 3.22Å; H245-F314 AromaticContact NE2-CD2 3.39Å; H245-F314 WeakPolarHBondContact NE2-CD2 3.48Å; H245-F314 AromaticContact NE2-CE2 3.45Å; H245-F314 WeakPolarHBondContact NE2-CE2 3.49Å; H245-F314 AromaticContact NE2-CG 3.75Å; H245-F314 AromaticContact NE2-CZ 3.75Å
246	C	85.3	Confident	64.5	Low	7 Å²	7	64.7 Å²	64.7	5%	0.047	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	119.8	179.4	-62.9	0	0	0	0	109.5	L211 N212 S213 F277 V278	L211-C246 HydrophobicContact CD2-CB 3.92Å; N212-C246 WeakPolarHBondContact CA-O 3.49Å; S213-C246 PolarHBondContact N-O 3.16Å; S213-C246 VanDerWaalsContact N-O 3.1Å; S213-C246 PolarHBondContact O-N 3.47Å; C246-F277 HydrophobicContact CB-CD2 3.77Å; C246-F277 HydrophobicContact CB-CE2 4.29Å; C246-F277 HydrophobicContact CB-CG 4.47Å; C246-V278 WeakPolarHBondContact CA-O 3.37Å
247	T	83	Confident	64.3	Low	49 Å²	49	62.8 Å²	62.8	30%	0.301	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	128.8	172.3	54.3	0	0	0	0	109.5	L211 H245 F277 V278	L211-T247 CarbonylContact O-C 3.5Å; L211-T247 VanDerWaalsContact O-CA 3.24Å; L211-T247 WeakPolarHBondContact O-CA 3.46Å; H245-T247 WeakPolarHBondContact CE1-CG2 3.28Å; T247-F277 CarbonylContact O-C 3.46Å; T247-F277 WeakPolarHBondContact O-CA 3.23Å; T247-F277 WeakPolarHBondContact O-CB 3.46Å; T247-V278 PolarHBondContact N-O 3.42Å; T247-V278 PolarHBondContact O-N 3.44Å
248	G	80.5	Confident	63.7	Low	15 Å²	15	60.8 Å²	60.8	16%	0.155	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	-175.2	-172.1	0	0	0	0	0	115.2	S210 L211 F276	S210-G248 CarbonylContact C-O 3.57Å; S210-G248 VanDerWaalsContact CA-O 3.24Å; S210-G248 WeakPolarHBondContact CA-O 3.12Å; L211-G248 PolarHBondContact N-O 3.08Å; L211-G248 PolarHBondContact O-N 3.08Å; G248-F276 CarbonylContact C-O 3.54Å; G248-F276 WeakPolarHBondContact CA-O 3.39Å
249	F	76	Confident	62.8	Low	104 Å²	104	61.4 Å²	61.4	46%	0.456	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	147.2	175.9	60.2	-85.1	0	0	0	111.2	S209 Q251 F276	S209-F249 WeakPolarHBondContact O-CA 2.91Å; F249-Q251 HydrophobicContact CD2-CB 3.95Å; F249-Q251 HydrophobicContact CE2-CB 3.85Å; F249-Q251 HydrophobicContact CE2-CG 4.39Å; F249-F276 HydrophobicContact CD1-CB 4.48Å; F249-F276 HydrophobicContact CE1-CB 4.06Å; F249-F276 HydrophobicContact CE2-CB 4.26Å; F249-F276 AromaticContact CE2-CD2 3.99Å; F249-F276 HydrophobicContact CE2-CD2 3.99Å; F249-F276 HydrophobicContact CE2-CG 4.36Å; F249-F276 HydrophobicContact CZ-CB 3.93Å; F249-F276 HydrophobicContact CZ-CD2 4.32Å; F249-F276 HydrophobicContact CZ-CG 4.24Å; F249-F276 PolarHBondContact N-O 2.94Å; F249-F276 PolarHBondContact O-N 3.02Å
250	L	72.4	Confident	61.5	Low	13 Å²	13	64.9 Å²	64.9	7%	0.068	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	128.9	167.1	-71	179.6	0	0	0	109.5	I158 S209 V273 Y274 L275	I158-L250 WeakPolarHBondContact O-CD1 3.43Å; S209-L250 PolarHBondContact O-N 2.83Å; S209-L250 WeakPolarHBondContact OG-CD1 3.4Å; S209-L250 WeakPolarHBondContact OG-CG 3.17Å; L250-V273 HydrophobicContact CB-CG1 4.48Å; L250-V273 HydrophobicContact CD2-CG1 4.3Å; L250-Y274 WeakPolarHBondContact CA-O 3.1Å; L250-L275 HydrophobicContact CD2-CB 3.6Å; L250-L275 HydrophobicContact CD2-CD1 3.6Å; L250-L275 HydrophobicContact CD2-CG 4.16Å; L250-L275 HydrophobicContact CG-CD1 4.06Å
251	Q	67.3	Low	59.6	Low	18 Å²	18	67.3 Å²	67.3	8%	0.084	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	132.9	176.1	-168.1	69.1	6.9	0	0	110.5	E81 F249 F253 Y274 F276	E81-Q251 PolarHBondContact OE2-NE2 3.42Å; F249-Q251 HydrophobicContact CD2-CB 3.95Å; F249-Q251 HydrophobicContact CE2-CB 3.85Å; F249-Q251 HydrophobicContact CE2-CG 4.39Å; Q251-F253 HydrophobicContact CB-CD2 4.37Å; Q251-F253 HydrophobicContact CB-CE2 3.86Å; Q251-F253 HydrophobicContact CG-CD2 4.03Å; Q251-F253 HydrophobicContact CG-CE1 4.49Å; Q251-F253 HydrophobicContact CG-CE2 3.42Å; Q251-F253 VanDerWaalsContact CG-CE2 3.42Å; Q251-F253 HydrophobicContact CG-CZ 3.7Å; Q251-Y274 PolarHBondContact N-O 3.12Å; Q251-Y274 PolarHBondContact O-N 3.16Å; Q251-F276 HydrophobicContact CB-CD2 4.06Å; Q251-F276 HydrophobicContact CB-CE2 3.96Å
252	C	54.8	Low	57.5	Low	33 Å²	33	71.5 Å²	71.5	22%	0.223	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	124.8	174.6	-166	0	0	0	0	110.2	C206 V273	C206-C252 WeakPolarHBondContact SG-CB 3.45Å; C252-V273 HydrophobicContact CB-CG2 4.2Å
253	F	57.9	Low	55	Low	96 Å²	96	79.2 Å²	79.2	42%	0.421	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	132.8	172.5	-73.3	-79.2	0	0	0	110.1	Q251 I255 S272 Y274 F276	Q251-F253 HydrophobicContact CB-CD2 4.37Å; Q251-F253 HydrophobicContact CB-CE2 3.86Å; Q251-F253 HydrophobicContact CG-CD2 4.03Å; Q251-F253 HydrophobicContact CG-CE1 4.49Å; Q251-F253 HydrophobicContact CG-CE2 3.42Å; Q251-F253 VanDerWaalsContact CG-CE2 3.42Å; Q251-F253 HydrophobicContact CG-CZ 3.7Å; F253-I255 HydrophobicContact CB-CG1 4.35Å; F253-I255 PolarHBondContact O-N 3.47Å; F253-S272 PolarHBondContact N-O 3.16Å; F253-S272 PolarHBondContact O-N 3.25Å; F253-S272 VanDerWaalsContact O-N 3.12Å; F253-S272 VanDerWaalsContact O-O 3.07Å; F253-Y274 HydrophobicContact CB-CD2 3.99Å; F253-Y274 HydrophobicContact CB-CE2 3.86Å; F253-Y274 AromaticContact CD2-CD2 3.85Å; F253-Y274 HydrophobicContact CD2-CD2 3.85Å; F253-Y274 HydrophobicContact CD2-CE2 4.49Å; F253-Y274 HydrophobicContact CD2-CG 4.48Å; F253-Y274 HydrophobicContact CG-CD2 4.41Å; F253-F276 HydrophobicContact CD2-CE2 4.01Å; F253-F276 HydrophobicContact CD2-CZ 4.11Å; F253-F276 AromaticContact CE2-CE2 3.47Å; F253-F276 HydrophobicContact CE2-CE2 3.47Å; F253-F276 VanDerWaalsContact CE2-CE2 3.47Å; F253-F276 AromaticContact CE2-CZ 3.59Å; F253-F276 HydrophobicContact CE2-CZ 3.59Å
254	T	39.5	Very low	52.4	Low	68 Å²	68	83.2 Å²	83.2	42%	0.417	45%	0.446	S	S	.	.			trans	-79.2	95.7	157.6	49.9	0	0	0	0	107.3	F256 K271	T254-F256 PolarHBondContact O-N 3.21Å; T254-F256 VanDerWaalsContact O-N 3.15Å; T254-K271 HydrophobicContact CG2-CG 3.67Å
255	I	40.4	Very low	49.6	Very low	81 Å²	81	88.9 Å²	88.9	42%	0.415	47%	0.473	S	S	.	.			trans	-72.6	108.4	169.1	-59.3	-156.8	0	0	0	107.3	F253 C257 Y274	F253-I255 HydrophobicContact CB-CG1 4.35Å; F253-I255 PolarHBondContact O-N 3.47Å; I255-C257 HydrophobicContact CG2-CB 4.13Å; I255-C257 VanDerWaalsContact CG2-SG 3.51Å; I255-C257 PolarHBondContact O-N 2.97Å; I255-C257 VanDerWaalsContact O-N 3.16Å; I255-Y274 HydrophobicContact CD1-CE1 4.18Å; I255-Y274 HydrophobicContact CD1-CE2 4.07Å; I255-Y274 VanDerWaalsContact CD1-CZ 3.46Å; I255-Y274 WeakPolarHBondContact CD1-OH 3.25Å; I255-Y274 HydrophobicContact CG1-CE2 4.11Å; I255-Y274 WeakPolarHBondContact CG1-OH 3.31Å
256	F	30.7	Very low	46.9	Very low	161 Å²	161	98.1 Å²	98.1	71%	0.706	52%	0.516	S	S	*	.			trans	-76.7	88.4	154.7	-70.6	-84.6	0	0	0	105.8	T254 G258	T254-F256 PolarHBondContact O-N 3.21Å; T254-F256 VanDerWaalsContact O-N 3.15Å; F256-G258 PolarHBondContact O-N 3.49Å
257	C	33.6	Very low	44.1	Very low	105 Å²	105	106.5 Å²	106.5	71%	0.709	55%	0.547	S	S	*	.			trans	-67.7	96.5	167.1	-100.4	0	0	0	0	105.4	I255 D259	I255-C257 HydrophobicContact CG2-CB 4.13Å; I255-C257 VanDerWaalsContact CG2-SG 3.51Å; I255-C257 PolarHBondContact O-N 2.97Å; I255-C257 VanDerWaalsContact O-N 3.16Å; C257-D259 PolarHBondContact O-N 3.37Å
258	G	27.3	Very low	41.6	Very low	71 Å²	71	111.5 Å²	111.5	73%	0.732	57%	0.571	S	S	*	*			trans	-73	62.5	163.1	0	0	0	0	0	109	F256 K260	F256-G258 PolarHBondContact O-N 3.49Å; G258-K260 PolarHBondContact O-N 3.38Å
259	D	31.4	Very low	39.5	Very low	141 Å²	141	114.5 Å²	114.5	75%	0.754	59%	0.59	S	S	*	*			trans	-80	97.3	166.5	-139	-9.5	0	0	0	106.7	C257 N261	C257-D259 PolarHBondContact O-N 3.37Å; D259-N261 PolarHBondContact O-N 2.66Å
260	K	33.1	Very low	38.4	Very low	132 Å²	132	113.2 Å²	113.2	57%	0.574	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	82	175.7	-65.3	178.1	179.9	177.3	0	107.3	T54 G258	T54-K260 PolarHBondContact OG1-NZ 2.92Å; G258-K260 PolarHBondContact O-N 3.38Å
261	N	29.9	Very low	37.9	Very low	160 Å²	160	119.1 Å²	119.1	86%	0.856	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-177.4	20.5	154.9	-94.6	-14.7	0	0	0	117	D259	D259-N261 PolarHBondContact O-N 2.66Å
262	E	31.7	Very low	37.9	Very low	168 Å²	168	120.2 Å²	120.2	79%	0.785	63%	0.633	S	S	*	*			trans	-131.1	109.4	165.9	-73.2	-169.3	156.2	0	0	111.7	V264	E262-V264 PolarHBondContact O-N 2.87Å
263	Q	26.4	Very low	39	Very low	204 Å²	204	120.5 Å²	120.5	95%	0.953	63%	0.634	S	S	*	*			trans	-68	68.7	158.3	-72.1	-174.7	-6.3	0	0	109
264	V	29.9	Very low	40.1	Very low	105 Å²	105	116.7 Å²	116.7	64%	0.636	62%	0.617	S	S	*	*			trans	-139.4	92.1	170.9	-172.5	0	0	0	0	109	E262	E262-V264 PolarHBondContact O-N 2.87Å
265	Q	26	Very low	42.2	Very low	124 Å²	124	113.5 Å²	113.5	58%	0.579	60%	0.597	S	S	*	*			trans	64.3	102.7	137.8	-151.5	144.9	47.7	0	0	117.2	R267	Q265-R267 VanDerWaalsContact C-N 3.26Å; Q265-R267 VanDerWaalsContact CD-CZ 3.5Å; Q265-R267 HydrophobicContact CG-CG 3.9Å; Q265-R267 PolarHBondContact O-N 3.09Å
266	E	27.5	Very low	44.3	Very low	206 Å²	206	112.6 Å²	112.6	96%	0.963	59%	0.59	S	S	*	*			trans	-47.7	86.8	154.1	-70.9	176	141.3	0	0	110.8
267	R	27.3	Very low	46.9	Very low	183 Å²	183	105.4 Å²	105.4	69%	0.691	56%	0.559	S	S	*	*			trans	-136.4	101.5	169.6	-85.2	179.4	-175.1	166.4	-1.3	108.5	Q265	Q265-R267 VanDerWaalsContact C-N 3.26Å; Q265-R267 VanDerWaalsContact CD-CZ 3.5Å; Q265-R267 HydrophobicContact CG-CG 3.9Å; Q265-R267 PolarHBondContact O-N 3.09Å
268	N	31	Very low	49.5	Very low	154 Å²	154	101.9 Å²	101.9	82%	0.824	53%	0.534	S	S	*	.			trans	62.8	95.8	168	-59.9	-17.8	0	0	0	115.7	A270	N268-A270 PolarHBondContact O-N 3.48Å
269	S	35.4	Very low	52.3	Low	77 Å²	77	98.6 Å²	98.6	54%	0.538	50%	0.5	S	S	.	.			trans	-61.8	86.2	158.6	179.1	0	0	0	0	108.7	K271	S269-K271 PolarHBondContact O-N 3.01Å
270	A	52.3	Low	54.9	Low	77 Å²	77	94.5 Å²	94.5	64%	0.636	47%	0.474	S	S	*	.			trans	-69	104.3	174.5	0	0	0	0	0	107.6	N268 S272	N268-A270 PolarHBondContact O-N 3.48Å; A270-S272 PolarHBondContact O-N 3.44Å; A270-S272 PolarHBondContact O-OG 3.33Å
271	K	62.1	Low	57.4	Low	138 Å²	138	88.6 Å²	88.6	60%	0.6	45%	0.449	S	S	*	.			trans	-46.5	110.1	168.5	-82	-176	-179.2	-174	0	109.2	T254 S269	T254-K271 HydrophobicContact CG2-CG 3.67Å; S269-K271 PolarHBondContact O-N 3.01Å
272	S	68.4	Low	59.9	Low	41 Å²	41	81.2 Å²	81.2	29%	0.287	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	133.2	178.8	-68.5	0	0	0	0	108.7	F253 A270 Y274	F253-S272 PolarHBondContact N-O 3.16Å; F253-S272 PolarHBondContact O-N 3.25Å; F253-S272 VanDerWaalsContact O-N 3.12Å; F253-S272 VanDerWaalsContact O-O 3.07Å; A270-S272 PolarHBondContact O-N 3.44Å; A270-S272 PolarHBondContact O-OG 3.33Å; S272-Y274 WeakPolarHBondContact CB-OH 3.49Å; S272-Y274 WeakPolarHBondContact O-CD2 3.48Å; S272-Y274 VanDerWaalsContact O-CE2 3.29Å; S272-Y274 WeakPolarHBondContact O-CE2 3.49Å
273	V	77.6	Confident	62.1	Low	39 Å²	39	76.7 Å²	76.7	24%	0.236	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	131.3	178.3	-179.1	0	0	0	0	108.5	R114 L250 C252	R114-V273 HydrophobicContact CB-CB 3.92Å; R114-V273 HydrophobicContact CB-CG1 4.2Å; R114-V273 WeakPolarHBondContact CB-O 3.3Å; R114-V273 PolarHBondContact N-O 3.4Å; L250-V273 HydrophobicContact CB-CG1 4.48Å; L250-V273 HydrophobicContact CD2-CG1 4.3Å; C252-V273 HydrophobicContact CB-CG2 4.2Å
274	Y	80.4	Confident	64.8	Low	16 Å²	16	68.9 Å²	68.9	6%	0.063	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	137.8	-178.8	-60.7	-96	0	0	0	108.9	V112 L113 V120 L250 Q251 F253 I255 S272 F276	V112-Y274 CarbonylContact O-C 3.57Å; V112-Y274 VanDerWaalsContact O-CA 3.3Å; V112-Y274 WeakPolarHBondContact O-CA 3.43Å; L113-Y274 HydrophobicContact CD2-CD1 3.88Å; L113-Y274 HydrophobicContact CD2-CE1 3.27Å; L113-Y274 HydrophobicContact CD2-CE2 4.35Å; L113-Y274 HydrophobicContact CG-CD1 4.13Å; L113-Y274 HydrophobicContact CG-CE1 3.74Å; V120-Y274 HydrophobicContact CG1-CE1 4.49Å; V120-Y274 HydrophobicContact CG2-CD1 4.41Å; V120-Y274 HydrophobicContact CG2-CE1 4.09Å; L250-Y274 WeakPolarHBondContact CA-O 3.1Å; Q251-Y274 PolarHBondContact N-O 3.12Å; Q251-Y274 PolarHBondContact O-N 3.16Å; F253-Y274 HydrophobicContact CB-CD2 3.99Å; F253-Y274 HydrophobicContact CB-CE2 3.86Å; F253-Y274 AromaticContact CD2-CD2 3.85Å; F253-Y274 HydrophobicContact CD2-CD2 3.85Å; F253-Y274 HydrophobicContact CD2-CE2 4.49Å; F253-Y274 HydrophobicContact CD2-CG 4.48Å; F253-Y274 HydrophobicContact CG-CD2 4.41Å; I255-Y274 HydrophobicContact CD1-CE1 4.18Å; I255-Y274 HydrophobicContact CD1-CE2 4.07Å; I255-Y274 VanDerWaalsContact CD1-CZ 3.46Å; I255-Y274 WeakPolarHBondContact CD1-OH 3.25Å; I255-Y274 HydrophobicContact CG1-CE2 4.11Å; I255-Y274 WeakPolarHBondContact CG1-OH 3.31Å; S272-Y274 WeakPolarHBondContact CB-OH 3.49Å; S272-Y274 WeakPolarHBondContact O-CD2 3.48Å; S272-Y274 VanDerWaalsContact O-CE2 3.29Å; S272-Y274 WeakPolarHBondContact O-CE2 3.49Å; Y274-F276 HydrophobicContact CG-CE2 4.33Å; Y274-F276 HydrophobicContact CG-CZ 4.36Å
275	L	84	Confident	67.2	Low	0 Å²	0	64.3 Å²	64.3	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	117.8	166.5	178	66.2	0	0	0	108.3	A111 V112 F154 I158 L211 L250 F277	A111-L275 CarbonylContact C-O 3.49Å; A111-L275 VanDerWaalsContact CA-O 3.3Å; A111-L275 WeakPolarHBondContact CA-O 3.23Å; V112-L275 PolarHBondContact N-O 3.08Å; V112-L275 PolarHBondContact O-N 3.12Å; F154-L275 HydrophobicContact CE2-CD2 4.43Å; F154-L275 HydrophobicContact CZ-CD2 3.91Å; I158-L275 HydrophobicContact CD1-CD2 3.88Å; I158-L275 HydrophobicContact CG1-CD2 3.65Å; L211-L275 HydrophobicContact CB-CD1 4Å; L211-L275 HydrophobicContact CD1-CD1 4.07Å; L211-L275 HydrophobicContact CD1-CD2 4.13Å; L211-L275 HydrophobicContact CD2-CD1 4.19Å; L211-L275 HydrophobicContact CD2-CD2 3.92Å; L211-L275 HydrophobicContact CG-CD1 4.33Å; L250-L275 HydrophobicContact CD2-CB 3.6Å; L250-L275 HydrophobicContact CD2-CD1 3.6Å; L250-L275 HydrophobicContact CD2-CG 4.16Å; L250-L275 HydrophobicContact CG-CD1 4.06Å; L275-F277 HydrophobicContact CD2-CD1 3.85Å; L275-F277 HydrophobicContact CD2-CE1 4.12Å; L275-F277 HydrophobicContact CG-CD1 3.86Å; L275-F277 HydrophobicContact CG-CE1 4.48Å
276	F	84.4	Confident	69.8	Low	62 Å²	62	58.6 Å²	58.6	27%	0.272	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	126.5	170.6	-63.1	-91.3	0	0	0	108.4	A111 G248 F249 Q251 F253 Y274	A111-F276 HydrophobicContact CB-CD1 3.68Å; A111-F276 HydrophobicContact CB-CE1 3.62Å; A111-F276 HydrophobicContact CB-CZ 4.42Å; G248-F276 CarbonylContact C-O 3.54Å; G248-F276 WeakPolarHBondContact CA-O 3.39Å; F249-F276 HydrophobicContact CD1-CB 4.48Å; F249-F276 HydrophobicContact CE1-CB 4.06Å; F249-F276 HydrophobicContact CE2-CB 4.26Å; F249-F276 AromaticContact CE2-CD2 3.99Å; F249-F276 HydrophobicContact CE2-CD2 3.99Å; F249-F276 HydrophobicContact CE2-CG 4.36Å; F249-F276 HydrophobicContact CZ-CB 3.93Å; F249-F276 HydrophobicContact CZ-CD2 4.32Å; F249-F276 HydrophobicContact CZ-CG 4.24Å; F249-F276 PolarHBondContact N-O 2.94Å; F249-F276 PolarHBondContact O-N 3.02Å; Q251-F276 HydrophobicContact CB-CD2 4.06Å; Q251-F276 HydrophobicContact CB-CE2 3.96Å; F253-F276 HydrophobicContact CD2-CE2 4.01Å; F253-F276 HydrophobicContact CD2-CZ 4.11Å; F253-F276 AromaticContact CE2-CE2 3.47Å; F253-F276 HydrophobicContact CE2-CE2 3.47Å; F253-F276 VanDerWaalsContact CE2-CE2 3.47Å; F253-F276 AromaticContact CE2-CZ 3.59Å; F253-F276 HydrophobicContact CE2-CZ 3.59Å; Y274-F276 HydrophobicContact CG-CE2 4.33Å; Y274-F276 HydrophobicContact CG-CZ 4.36Å
277	F	85.4	Confident	72.3	Confident	10 Å²	10	52.2 Å²	52.2	4%	0.044	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	157.8	177.8	66.3	-83.2	0	0	0	112.2	C109 M110 V112 I142 L211 C246 T247 L275 A279	C109-F277 WeakPolarHBondContact CA-O 3.24Å; M110-F277 HydrophobicContact CB-CD1 4.38Å; M110-F277 HydrophobicContact CB-CE1 3.88Å; M110-F277 HydrophobicContact CB-CE2 4.1Å; M110-F277 HydrophobicContact CB-CZ 3.74Å; M110-F277 HydrophobicContact CE-CE1 4.27Å; M110-F277 HydrophobicContact CE-CE2 3.77Å; M110-F277 HydrophobicContact CE-CZ 3.3Å; M110-F277 HydrophobicContact CG-CE1 4.33Å; M110-F277 HydrophobicContact CG-CZ 4.21Å; M110-F277 PolarHBondContact N-O 3.34Å; M110-F277 PolarHBondContact O-N 3.17Å; M110-F277 HydrophobicContact SD-CE1 3.98Å; M110-F277 HydrophobicContact SD-CZ 3.58Å; M110-F277 VanDerWaalsContact SD-CZ 3.58Å; V112-F277 HydrophobicContact CG2-CE1 3.81Å; V112-F277 HydrophobicContact CG2-CZ 4.48Å; I142-F277 HydrophobicContact CD1-CE1 4.13Å; I142-F277 HydrophobicContact CD1-CZ 3.7Å; L211-F277 HydrophobicContact CD2-CB 4.17Å; L211-F277 HydrophobicContact CD2-CG 4.4Å; C246-F277 HydrophobicContact CB-CD2 3.77Å; C246-F277 HydrophobicContact CB-CE2 4.29Å; C246-F277 HydrophobicContact CB-CG 4.47Å; T247-F277 CarbonylContact O-C 3.46Å; T247-F277 WeakPolarHBondContact O-CA 3.23Å; T247-F277 WeakPolarHBondContact O-CB 3.46Å; L275-F277 HydrophobicContact CD2-CD1 3.85Å; L275-F277 HydrophobicContact CD2-CE1 4.12Å; L275-F277 HydrophobicContact CG-CD1 3.86Å; L275-F277 HydrophobicContact CG-CE1 4.48Å; F277-A279 HydrophobicContact CD2-CB 4.34Å; F277-A279 HydrophobicContact CE2-CB 4.18Å
278	V	87.5	Confident	74.8	Confident	31 Å²	31	45.3 Å²	45.3	19%	0.188	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	123.3	170.6	-167.9	0	0	0	0	108.2	V105 F108 C246 T247	V105-V278 HydrophobicContact CB-CG1 4.12Å; V105-V278 HydrophobicContact CG1-CB 4.38Å; V105-V278 HydrophobicContact CG1-CG1 3.38Å; F108-V278 WeakPolarHBondContact O-CA 3.07Å; C246-V278 WeakPolarHBondContact CA-O 3.37Å; T247-V278 PolarHBondContact N-O 3.42Å; T247-V278 PolarHBondContact O-N 3.44Å
279	A	87.1	Confident	77	Confident	2 Å²	2	38.9 Å²	38.9	2%	0.017	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	120.8	177.4	0	0	0	0	0	109.5	G107 F108 F244 H245 F277	G107-A279 CarbonylContact C-O 3.38Å; G107-A279 WeakPolarHBondContact CA-O 3.45Å; F108-A279 HydrophobicContact CD1-CB 4.17Å; F108-A279 HydrophobicContact CD2-CB 4.23Å; F108-A279 HydrophobicContact CE1-CB 3.72Å; F108-A279 HydrophobicContact CE2-CB 3.76Å; F108-A279 HydrophobicContact CG-CB 4.43Å; F108-A279 HydrophobicContact CZ-CB 3.49Å; F108-A279 VanDerWaalsContact CZ-CB 3.49Å; F108-A279 PolarHBondContact N-O 2.84Å; F108-A279 PolarHBondContact O-N 2.93Å; F244-A279 HydrophobicContact CB-CB 4.32Å; F244-A279 HydrophobicContact CD1-CB 4.18Å; F244-A279 HydrophobicContact CG-CB 4.48Å; H245-A279 WeakPolarHBondContact O-CA 3.42Å; F277-A279 HydrophobicContact CD2-CB 4.34Å; F277-A279 HydrophobicContact CE2-CB 4.18Å
280	R	86.5	Confident	79.1	Confident	55 Å²	55	37.6 Å²	37.6	21%	0.208	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	130.1	177	-58.6	-178.1	74.8	-165.5	-6.1	108.8	V105 F244 H245 L282 L285	V105-R280 HydrophobicContact CG1-CG 3.68Å; V105-R280 PolarHBondContact O-NE 3.32Å; V105-R280 PolarHBondContact O-NH2 3.32Å; F244-R280 CarbonylContact C-O 3.5Å; F244-R280 WeakPolarHBondContact CA-O 3.07Å; H245-R280 PolarHBondContact N-O 2.75Å; H245-R280 PolarHBondContact O-N 3.26Å; R280-L282 PolarHBondContact O-N 3.22Å; R280-L285 HydrophobicContact CB-CD1 3.85Å; R280-L285 HydrophobicContact CB-CG 4.2Å; R280-L285 VanDerWaalsContact NH1-CD2 3.29Å
281	P	84.9	Confident	80.1	Confident	8 Å²	8	40.7 Å²	40.7	5%	0.052	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	135.3	176.4	27.9	-35.9	0	0	0	110.6	D106 Y129 F244 E283 T284 L285	D106-P281 WeakPolarHBondContact O-CD 3.44Å; Y129-P281 HydrophobicContact CD1-CB 4.48Å; Y129-P281 HydrophobicContact CD1-CG 3.97Å; Y129-P281 HydrophobicContact CE1-CG 3.64Å; F244-P281 HydrophobicContact CD1-CB 4.25Å; F244-P281 HydrophobicContact CE1-CB 3.98Å; P281-E283 PolarHBondContact O-N 3.04Å; P281-T284 VanDerWaalsContact CG-OG1 3.3Å; P281-T284 WeakPolarHBondContact CG-OG1 3.48Å; P281-T284 PolarHBondContact O-N 2.76Å; P281-L285 PolarHBondContact O-N 3.42Å
282	L	82.2	Confident	80.3	Confident	5 Å²	5	40 Å²	40	3%	0.026	20%	0.198	C	C	.	.	H	α-helix	trans	-62.1	-30.7	-178.7	-171.7	64.2	0	0	0	111.8	A243 R280 L285 S286 F314 C318	A243-L282 HydrophobicContact CB-CB 3.95Å; A243-L282 HydrophobicContact CB-CD2 3.98Å; A243-L282 WeakPolarHBondContact O-CB 3.34Å; A243-L282 PolarHBondContact O-N 3.02Å; R280-L282 PolarHBondContact O-N 3.22Å; L282-L285 WeakPolarHBondContact O-CB 3.1Å; L282-L285 PolarHBondContact O-N 2.78Å; L282-S286 WeakPolarHBondContact O-CB 3.21Å; L282-S286 PolarHBondContact O-N 2.89Å; L282-F314 HydrophobicContact CD1-CE2 4.26Å; L282-C318 HydrophobicContact CD1-CB 4.49Å
283	E	78.7	Confident	79.8	Confident	73 Å²	73	45 Å²	45	34%	0.341	22%	0.215	S	C	.	.	H	α-helix	trans	-64.9	-50.1	178.1	-176.9	165	-154.7	0	0	112.2	P281 L285 S286 E287 K368	P281-E283 PolarHBondContact O-N 3.04Å; E283-L285 VanDerWaalsContact C-N 3.26Å; E283-L285 PolarHBondContact O-N 3.26Å; E283-S286 WeakPolarHBondContact CA-OG 2.95Å; E283-S286 WeakPolarHBondContact O-CB 3.44Å; E283-S286 PolarHBondContact O-N 2.97Å; E283-S286 VanDerWaalsContact O-N 3.1Å; E283-S286 PolarHBondContact O-OG 2.92Å; E283-E287 PolarHBondContact O-N 3.21Å; E283-K368 HydrophobicContact CG-CD 4.36Å; E283-K368 WeakPolarHBondContact OE1-CD 3.09Å; E283-K368 IonicContact OE1-NZ 3.68Å; E283-K368 PolarHBondContact OE1-NZ 2.91Å; E283-K368 IonicContact OE2-NZ 3.4Å; E283-K368 PolarHBondContact OE2-NZ 2.9Å
284	T	81.7	Confident	79.1	Confident	41 Å²	41	46.7 Å²	46.7	25%	0.252	22%	0.223	S	C	.	.	H	α-helix	trans	-61.6	-37.9	176.7	-52.4	0	0	0	0	111.5	D106 P281 E287 Q288	D106-T284 HydrophobicContact CB-CG2 4.13Å; P281-T284 VanDerWaalsContact CG-OG1 3.3Å; P281-T284 WeakPolarHBondContact CG-OG1 3.48Å; P281-T284 PolarHBondContact O-N 2.76Å; T284-E287 PolarHBondContact O-N 3Å; T284-Q288 WeakPolarHBondContact O-CB 3.16Å; T284-Q288 VanDerWaalsContact O-CG 3.28Å; T284-Q288 WeakPolarHBondContact O-CG 3.18Å; T284-Q288 PolarHBondContact O-N 3.25Å
285	L	80.5	Confident	78.3	Confident	9 Å²	9	48.2 Å²	48.2	5%	0.047	24%	0.239	C	C	.	.	H	α-helix	trans	-62.4	-44.5	173.7	-73.4	164.4	0	0	0	112.2	H245 R280 P281 L282 E283 E287 Q288 I289 F314	H245-L285 HydrophobicContact CB-CD1 3.62Å; R280-L285 HydrophobicContact CB-CD1 3.85Å; R280-L285 HydrophobicContact CB-CG 4.2Å; R280-L285 VanDerWaalsContact NH1-CD2 3.29Å; P281-L285 PolarHBondContact O-N 3.42Å; L282-L285 WeakPolarHBondContact O-CB 3.1Å; L282-L285 PolarHBondContact O-N 2.78Å; E283-L285 VanDerWaalsContact C-N 3.26Å; E283-L285 PolarHBondContact O-N 3.26Å; L285-E287 VanDerWaalsContact C-N 3.33Å; L285-E287 PolarHBondContact O-N 2.99Å; L285-Q288 PolarHBondContact O-N 3.35Å; L285-I289 WeakPolarHBondContact O-CB 3.25Å; L285-I289 WeakPolarHBondContact O-CD1 3.35Å; L285-I289 VanDerWaalsContact O-CG1 3.31Å; L285-I289 WeakPolarHBondContact O-CG1 3.48Å; L285-I289 PolarHBondContact O-N 2.88Å; L285-F314 HydrophobicContact CD1-CE2 4.42Å; L285-F314 HydrophobicContact CD1-CZ 3.95Å
286	S	80.7	Confident	77.8	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-61.3	-42.4	177.4	72.1	0	0	0	0	111.6	L282 E283 I289 L290 C318 H369	L282-S286 WeakPolarHBondContact O-CB 3.21Å; L282-S286 PolarHBondContact O-N 2.89Å; E283-S286 WeakPolarHBondContact CA-OG 2.95Å; E283-S286 WeakPolarHBondContact O-CB 3.44Å; E283-S286 PolarHBondContact O-N 2.97Å; E283-S286 VanDerWaalsContact O-N 3.1Å; E283-S286 PolarHBondContact O-OG 2.92Å; S286-I289 PolarHBondContact O-N 3.3Å; S286-L290 WeakPolarHBondContact O-CB 3.33Å; S286-L290 WeakPolarHBondContact O-CG 3.33Å; S286-L290 PolarHBondContact O-N 2.78Å; S286-C318 WeakPolarHBondContact CA-O 3.44Å; S286-C318 WeakPolarHBondContact CB-O 3.26Å; S286-H369 PolarHBondContact OG-CD2 3.08Å; S286-H369 PolarHBondContact OG-NE2 3.38Å
287	E	80.4	Confident	77.8	Confident	72 Å²	72	54.1 Å²	54.1	34%	0.336	27%	0.271	S	S	.	.	H	α-helix	trans	-65.4	-45.8	177.1	-73.1	-179.5	178.6	0	0	111.7	E283 T284 L285 I289 L290 Q291 H369	E283-E287 PolarHBondContact O-N 3.21Å; T284-E287 PolarHBondContact O-N 3Å; L285-E287 VanDerWaalsContact C-N 3.33Å; L285-E287 PolarHBondContact O-N 2.99Å; E287-I289 PolarHBondContact O-N 3.22Å; E287-L290 PolarHBondContact O-N 3.31Å; E287-Q291 WeakPolarHBondContact O-CB 3.31Å; E287-Q291 WeakPolarHBondContact O-CG 3.34Å; E287-Q291 PolarHBondContact O-N 3.01Å; E287-H369 WeakPolarHBondContact CG-CE1 3.38Å; E287-H369 IonicContact OE1-CE1 2.81Å
288	Q	79.1	Confident	78	Confident	39 Å²	39	58.2 Å²	58.2	18%	0.182	29%	0.29	C	S	.	.	H	α-helix	trans	-58.7	-48.7	176.8	-75.2	174.8	-10.3	0	0	111.2	D106 T284 L285 L290 Q291 E292	D106-Q288 PolarHBondContact OD2-NE2 2.77Å; T284-Q288 WeakPolarHBondContact O-CB 3.16Å; T284-Q288 VanDerWaalsContact O-CG 3.28Å; T284-Q288 WeakPolarHBondContact O-CG 3.18Å; T284-Q288 PolarHBondContact O-N 3.25Å; L285-Q288 PolarHBondContact O-N 3.35Å; Q288-L290 VanDerWaalsContact C-N 3.32Å; Q288-L290 PolarHBondContact O-N 3Å; Q288-Q291 PolarHBondContact O-N 2.85Å; Q288-E292 WeakPolarHBondContact O-CB 3.4Å; Q288-E292 WeakPolarHBondContact O-CG 3.31Å; Q288-E292 PolarHBondContact O-N 3.38Å
289	I	78.1	Confident	78.2	Confident	18 Å²	18	56.8 Å²	56.8	9%	0.092	28%	0.282	C	S	.	.	H	α-helix	trans	-62.6	-40.5	-179.5	-70.7	161.6	0	0	0	111.4	L285 S286 E287 F297 C318 V319 L398	L285-I289 WeakPolarHBondContact O-CB 3.25Å; L285-I289 WeakPolarHBondContact O-CD1 3.35Å; L285-I289 VanDerWaalsContact O-CG1 3.31Å; L285-I289 WeakPolarHBondContact O-CG1 3.48Å; L285-I289 PolarHBondContact O-N 2.88Å; S286-I289 PolarHBondContact O-N 3.3Å; E287-I289 PolarHBondContact O-N 3.22Å; I289-F297 HydrophobicContact CD1-CE1 4.43Å; I289-F297 HydrophobicContact CD1-CE2 3.73Å; I289-F297 HydrophobicContact CD1-CZ 3.66Å; I289-F297 HydrophobicContact CG1-CD2 4.38Å; I289-F297 HydrophobicContact CG1-CE2 4.03Å; I289-F297 HydrophobicContact CG1-CZ 4.33Å; I289-F297 HydrophobicContact CG2-CD1 3.9Å; I289-F297 HydrophobicContact CG2-CD2 4.11Å; I289-F297 HydrophobicContact CG2-CE1 4.05Å; I289-F297 HydrophobicContact CG2-CE2 4.26Å; I289-F297 HydrophobicContact CG2-CG 3.92Å; I289-F297 HydrophobicContact CG2-CZ 4.21Å; I289-C318 HydrophobicContact CD1-CB 3.47Å; I289-C318 VanDerWaalsContact CD1-CB 3.47Å; I289-V319 HydrophobicContact CG2-CG2 4.37Å; I289-L398 HydrophobicContact CG2-CD1 3.69Å
290	L	78.5	Confident	78.5	Confident	51 Å²	51	59.5 Å²	59.5	27%	0.267	30%	0.295	S	S	.	.	H	α-helix	trans	-76.8	-34	-179.3	-65.9	175.1	0	0	0	113	S286 E287 Q288 H369 V372	S286-L290 WeakPolarHBondContact O-CB 3.33Å; S286-L290 WeakPolarHBondContact O-CG 3.33Å; S286-L290 PolarHBondContact O-N 2.78Å; E287-L290 PolarHBondContact O-N 3.31Å; Q288-L290 VanDerWaalsContact C-N 3.32Å; Q288-L290 PolarHBondContact O-N 3Å; L290-H369 HydrophobicContact CD1-CB 3.78Å; L290-V372 HydrophobicContact CD1-CG2 4.18Å; L290-V372 HydrophobicContact CD2-CB 4.45Å; L290-V372 HydrophobicContact CD2-CG1 3.92Å; L290-V372 HydrophobicContact CD2-CG2 3.6Å
291	Q	74.8	Confident	78.9	Confident	142 Å²	142	56.9 Å²	56.9	66%	0.664	29%	0.286	S	S	*	.	H	α-helix	trans	-82.5	-39.9	-179.2	-71.5	-179.8	20.3	0	0	113.1	E287 Q288 K293	E287-Q291 WeakPolarHBondContact O-CB 3.31Å; E287-Q291 WeakPolarHBondContact O-CG 3.34Å; E287-Q291 PolarHBondContact O-N 3.01Å; Q288-Q291 PolarHBondContact O-N 2.85Å; Q291-K293 PolarHBondContact O-N 2.94Å
292	E	65	Low	79.3	Confident	122 Å²	122	61.7 Å²	61.7	57%	0.57	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	1	-173.8	-70	-177.8	172.8	0	0	113.3	Q288 N294	Q288-E292 WeakPolarHBondContact O-CB 3.4Å; Q288-E292 WeakPolarHBondContact O-CG 3.31Å; Q288-E292 PolarHBondContact O-N 3.38Å; E292-N294 PolarHBondContact O-N 2.82Å; E292-N294 VanDerWaalsContact O-N 3.12Å
293	K	58.6	Low	80	Confident	146 Å²	146	61.5 Å²	61.5	64%	0.635	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	37.9	176.3	-58.6	179	-177.4	173.5	0	112.1	Q291 A295 R400	Q291-K293 PolarHBondContact O-N 2.94Å; K293-A295 VanDerWaalsContact C-N 3.29Å; K293-A295 PolarHBondContact O-N 2.81Å; K293-R400 PolarHBondContact O-NH2 2.94Å
294	N	63.2	Low	80.7	Confident	75 Å²	75	61.5 Å²	61.5	40%	0.401	30%	0.304	S	S	.	.			trans	-65.6	89.8	175.6	-99.1	-37.6	0	0	0	109.1	E292 D296 F297	E292-N294 PolarHBondContact O-N 2.82Å; E292-N294 VanDerWaalsContact O-N 3.12Å; N294-D296 PolarHBondContact O-N 2.95Å; N294-F297 HydrophobicContact CB-CB 4.12Å; N294-F297 WeakPolarHBondContact O-CB 3.38Å; N294-F297 PolarHBondContact O-N 3.46Å; N294-F297 VanDerWaalsContact O-N 3.16Å
295	A	62.3	Low	81.2	Confident	48 Å²	48	62.7 Å²	62.7	40%	0.397	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-19.5	179.8	0	0	0	0	0	112.1	K293	K293-A295 VanDerWaalsContact C-N 3.29Å; K293-A295 PolarHBondContact O-N 2.81Å
296	D	74.4	Confident	81.7	Confident	146 Å²	146	66.8 Å²	66.8	78%	0.781	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.6	5.7	-179.2	-56.6	-26.5	0	0	0	112.4	N294 E298	N294-D296 PolarHBondContact O-N 2.95Å; D296-E298 PolarHBondContact O-N 2.86Å; D296-E298 VanDerWaalsContact O-N 3.16Å
297	F	84.5	Confident	82.2	Confident	41 Å²	41	66.7 Å²	66.7	18%	0.18	33%	0.332	C	S	.	.			trans	-72.6	113.4	177.2	-165.3	-93.8	0	0	0	110.1	I289 N294 F299 V319 L398	I289-F297 HydrophobicContact CD1-CE1 4.43Å; I289-F297 HydrophobicContact CD1-CE2 3.73Å; I289-F297 HydrophobicContact CD1-CZ 3.66Å; I289-F297 HydrophobicContact CG1-CD2 4.38Å; I289-F297 HydrophobicContact CG1-CE2 4.03Å; I289-F297 HydrophobicContact CG1-CZ 4.33Å; I289-F297 HydrophobicContact CG2-CD1 3.9Å; I289-F297 HydrophobicContact CG2-CD2 4.11Å; I289-F297 HydrophobicContact CG2-CE1 4.05Å; I289-F297 HydrophobicContact CG2-CE2 4.26Å; I289-F297 HydrophobicContact CG2-CG 3.92Å; I289-F297 HydrophobicContact CG2-CZ 4.21Å; N294-F297 HydrophobicContact CB-CB 4.12Å; N294-F297 WeakPolarHBondContact O-CB 3.38Å; N294-F297 PolarHBondContact O-N 3.46Å; N294-F297 VanDerWaalsContact O-N 3.16Å; F297-F299 HydrophobicContact CD1-CD1 4.19Å; F297-F299 HydrophobicContact CE1-CD1 4.04Å; F297-V319 HydrophobicContact CD1-CG2 4.18Å; F297-V319 HydrophobicContact CE1-CG2 3.81Å; F297-L398 HydrophobicContact CB-CD1 3.87Å; F297-L398 HydrophobicContact CB-CG 4.33Å; F297-L398 HydrophobicContact CD1-CD1 3.88Å; F297-L398 HydrophobicContact CD1-CG 4.26Å; F297-L398 HydrophobicContact CG-CD1 4.17Å; F297-L398 PolarHBondContact O-N 3.36Å
298	E	89.9	Confident	82.9	Confident	95 Å²	95	64.5 Å²	64.5	44%	0.444	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	143	179	-58.1	-173.8	130.4	0	0	110.5	D296 K395 H396 S397	D296-E298 PolarHBondContact O-N 2.86Å; D296-E298 VanDerWaalsContact O-N 3.16Å; E298-K395 WeakPolarHBondContact OE1-CE 3.43Å; E298-K395 IonicContact OE1-NZ 3.44Å; E298-K395 PolarHBondContact OE1-NZ 2.85Å; E298-K395 WeakPolarHBondContact OE2-CE 3.29Å; E298-K395 IonicContact OE2-NZ 2.79Å; E298-K395 PolarHBondContact OE2-NZ 2.81Å; E298-H396 CarbonylContact C-O 3.5Å; E298-H396 WeakPolarHBondContact CA-O 3.38Å; E298-S397 PolarHBondContact OE1-OG 2.59Å; E298-S397 VanDerWaalsContact OE1-OG 3.09Å
299	F	91.7	Very high	83.6	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.009	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	152.8	173.6	61.6	-89.4	0	0	0	110.3	F297 V301 C316 V319 L364 H396 L398	F297-F299 HydrophobicContact CD1-CD1 4.19Å; F297-F299 HydrophobicContact CE1-CD1 4.04Å; F299-V301 HydrophobicContact CD2-CG2 4.11Å; F299-V301 HydrophobicContact CE2-CG2 4.2Å; F299-C316 HydrophobicContact CD2-CB 3.59Å; F299-C316 HydrophobicContact CE2-CB 4.02Å; F299-C316 HydrophobicContact CG-CB 4.32Å; F299-V319 HydrophobicContact CD1-CG2 4.08Å; F299-V319 HydrophobicContact CE1-CB 4.06Å; F299-V319 HydrophobicContact CE1-CG1 4.13Å; F299-V319 HydrophobicContact CE1-CG2 3.76Å; F299-V319 HydrophobicContact CZ-CB 4.3Å; F299-V319 HydrophobicContact CZ-CG1 4.22Å; F299-V319 HydrophobicContact CZ-CG2 4.49Å; F299-L364 HydrophobicContact CE2-CD1 4.42Å; F299-L364 HydrophobicContact CZ-CD1 3.88Å; F299-H396 HydrophobicContact CD1-CB 3.92Å; F299-H396 HydrophobicContact CD2-CB 3.86Å; F299-H396 AromaticContact CD2-ND1 3.78Å; F299-H396 HydrophobicContact CE1-CB 3.51Å; F299-H396 HydrophobicContact CE2-CB 3.46Å; F299-H396 VanDerWaalsContact CE2-CB 3.46Å; F299-H396 AromaticContact CE2-CG 3.43Å; F299-H396 VanDerWaalsContact CE2-CG 3.43Å; F299-H396 AromaticContact CE2-ND1 3.35Å; F299-H396 VanDerWaalsContact CE2-ND1 3.35Å; F299-H396 WeakPolarHBondContact CE2-ND1 2.81Å; F299-H396 HydrophobicContact CG-CB 4.09Å; F299-H396 HydrophobicContact CZ-CB 3.28Å; F299-H396 AromaticContact CZ-CG 3.58Å; F299-H396 PolarHBondContact N-O 2.88Å; F299-H396 PolarHBondContact O-N 3.25Å; F299-L398 HydrophobicContact CE1-CD2 4.49Å
300	I	93.2	Very high	84.3	Confident	58 Å²	58	65.5 Å²	65.5	30%	0.297	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	137.9	-177.4	-54.7	174.2	0	0	0	109.7	D313 I393 V394 K395	I300-D313 VanDerWaalsContact CB-OD2 3.25Å; I300-D313 WeakPolarHBondContact CB-OD2 3.31Å; I300-D313 PolarHBondContact N-OD2 3.1Å; I300-D313 VanDerWaalsContact N-OD2 3.12Å; I300-D313 WeakPolarHBondContact O-CB 3.43Å; I300-D313 VanDerWaalsContact O-CG 3.31Å; I300-D313 PolarHBondContact O-N 2.83Å; I300-I393 HydrophobicContact CG2-CG2 3.47Å; I300-I393 VanDerWaalsContact CG2-CG2 3.47Å; I300-V394 WeakPolarHBondContact CA-O 3.31Å; I300-K395 HydrophobicContact CG1-CG 4.42Å
301	V	94.3	Very high	84.9	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.006	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	132.1	171.1	-174	0	0	0	0	108.4	F299 L303 V309 C316 Y332 V394	F299-V301 HydrophobicContact CD2-CG2 4.11Å; F299-V301 HydrophobicContact CE2-CG2 4.2Å; V301-L303 HydrophobicContact CG1-CD2 3.71Å; V301-V309 HydrophobicContact CG1-CG1 3.73Å; V301-V309 HydrophobicContact CG1-CG2 4.31Å; V301-C316 HydrophobicContact CG2-CB 4.09Å; V301-C316 VanDerWaalsContact CG2-SG 3.56Å; V301-Y332 HydrophobicContact CG1-CD2 4.35Å; V301-Y332 HydrophobicContact CG1-CE2 4.44Å; V301-V394 PolarHBondContact N-O 2.76Å; V301-V394 PolarHBondContact O-N 2.93Å
302	R	94.5	Very high	85.7	Confident	109 Å²	109	58.7 Å²	58.7	41%	0.411	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	132.4	174.9	-55.6	-174.6	-171.3	-163.5	1.4	110.1	I310 S311 L392	R302-I310 PolarHBondContact O-N 3.43Å; R302-S311 WeakPolarHBondContact CB-OG 3.16Å; R302-S311 WeakPolarHBondContact CD-OG 3.32Å; R302-S311 VanDerWaalsContact CG-OG 3.31Å; R302-S311 WeakPolarHBondContact CG-OG 3.34Å; R302-S311 PolarHBondContact N-O 3.35Å; R302-S311 PolarHBondContact O-N 3.17Å; R302-L392 CarbonylContact C-O 3.55Å; R302-L392 VanDerWaalsContact CA-O 3.3Å; R302-L392 WeakPolarHBondContact CA-O 3.39Å
303	L	95.8	Very high	86.8	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	148.9	-175.7	-48.6	176.7	0	0	0	110.6	V301 T308 V309 Y332 W378 Y391 L392 V394	V301-L303 HydrophobicContact CG1-CD2 3.71Å; L303-T308 CarbonylContact C-O 3.58Å; L303-T308 VanDerWaalsContact CA-O 3.28Å; L303-T308 WeakPolarHBondContact CA-O 3.2Å; L303-V309 HydrophobicContact CD2-CB 4.14Å; L303-V309 HydrophobicContact CD2-CG1 4.44Å; L303-V309 HydrophobicContact CD2-CG2 3.62Å; L303-Y332 HydrophobicContact CD1-CD1 4.17Å; L303-Y332 HydrophobicContact CD1-CD2 4.1Å; L303-Y332 HydrophobicContact CD1-CG 3.75Å; L303-Y332 HydrophobicContact CD2-CD2 3.76Å; L303-Y332 HydrophobicContact CD2-CG 3.98Å; L303-W378 HydrophobicContact CD1-CH2 3.74Å; L303-W378 HydrophobicContact CD1-CZ3 3.59Å; L303-Y391 CarbonylContact O-C 3.5Å; L303-Y391 VanDerWaalsContact O-CA 3.27Å; L303-Y391 WeakPolarHBondContact O-CA 3.44Å; L303-Y391 VanDerWaalsContact O-CB 3.27Å; L303-Y391 WeakPolarHBondContact O-CB 3.34Å; L303-L392 HydrophobicContact CB-CB 4.24Å; L303-L392 PolarHBondContact N-O 3.37Å; L303-L392 PolarHBondContact O-N 3.06Å; L303-V394 HydrophobicContact CD1-CG2 3.66Å; L303-V394 HydrophobicContact CG-CG2 4.21Å
304	L	94.4	Very high	87.9	Confident	74 Å²	74	52.3 Å²	52.3	39%	0.387	28%	0.277	S	S	.	.			trans	-69.4	167.4	161.8	-78.3	171	0	0	0	110.2	D306 G307 T308 I310	L304-D306 WeakPolarHBondContact CB-OD1 3.34Å; L304-D306 PolarHBondContact O-N 2.87Å; L304-G307 PolarHBondContact O-N 2.91Å; L304-T308 HydrophobicContact CD1-CG2 4.42Å; L304-T308 PolarHBondContact N-O 2.9Å; L304-I310 HydrophobicContact CB-CD1 4.35Å; L304-I310 HydrophobicContact CB-CG1 4.4Å; L304-I310 HydrophobicContact CD1-CG1 4.39Å; L304-I310 HydrophobicContact CD2-CD1 3.62Å; L304-I310 HydrophobicContact CD2-CG1 4.1Å; L304-I310 HydrophobicContact CG-CD1 3.61Å; L304-I310 HydrophobicContact CG-CG1 3.58Å
305	V	91.7	Very high	88.9	Confident	66 Å²	66	49.1 Å²	49.1	40%	0.4	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-22.6	177.6	178.1	0	0	0	0	112.5	G307 H348 L352 V389	V305-G307 VanDerWaalsContact C-N 3.34Å; V305-H348 PolarHBondContact O-CE1 3.17Å; V305-H348 PolarHBondContact O-NE2 3.47Å; V305-L352 HydrophobicContact CG1-CD1 4.18Å; V305-L352 HydrophobicContact CG1-CD2 3.9Å; V305-V389 HydrophobicContact CG2-CG1 4.17Å
306	D	91.5	Very high	90.1	Very high	95 Å²	95	47 Å²	47	51%	0.508	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-7.1	174.9	69.6	-19.4	0	0	0	113.3	L304 T308	L304-D306 WeakPolarHBondContact CB-OD1 3.34Å; L304-D306 PolarHBondContact O-N 2.87Å; D306-T308 VanDerWaalsContact CG-OG1 3.24Å; D306-T308 VanDerWaalsContact OD1-CB 3.29Å; D306-T308 WeakPolarHBondContact OD1-CB 3.43Å; D306-T308 PolarHBondContact OD1-N 2.86Å; D306-T308 PolarHBondContact OD1-OG1 3.21Å; D306-T308 PolarHBondContact OD2-OG1 3.07Å
307	G	90.1	Very high	90.7	Very high	1 Å²	1	40 Å²	40	1%	0.01	21%	0.207	C	C	.	.	S	Bend	trans	88.7	12	-175.7	0	0	0	0	0	114.8	L304 V305 Y332	L304-G307 PolarHBondContact O-N 2.91Å; V305-G307 VanDerWaalsContact C-N 3.34Å; G307-Y332 VanDerWaalsContact O-CB 3.31Å; G307-Y332 WeakPolarHBondContact O-CB 3.36Å; G307-Y332 PolarHBondContact O-N 3.27Å
308	T	94.7	Very high	90.7	Very high	25 Å²	25	38.1 Å²	38.1	15%	0.153	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-76.5	134.4	173.1	-61.6	0	0	0	0	110.7	L303 L304 D306 I310	L303-T308 CarbonylContact C-O 3.58Å; L303-T308 VanDerWaalsContact CA-O 3.28Å; L303-T308 WeakPolarHBondContact CA-O 3.2Å; L304-T308 HydrophobicContact CD1-CG2 4.42Å; L304-T308 PolarHBondContact N-O 2.9Å; D306-T308 VanDerWaalsContact CG-OG1 3.24Å; D306-T308 VanDerWaalsContact OD1-CB 3.29Å; D306-T308 WeakPolarHBondContact OD1-CB 3.43Å; D306-T308 PolarHBondContact OD1-N 2.86Å; D306-T308 PolarHBondContact OD1-OG1 3.21Å; D306-T308 PolarHBondContact OD2-OG1 3.07Å; T308-I310 PolarHBondContact O-N 2.87Å
309	V	94.4	Very high	90.5	Very high	3 Å²	3	33.6 Å²	33.6	2%	0.018	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	122	-178.9	-176.2	0	0	0	0	110.7	V301 L303 A312 I327 V328 G329 T330 Y332	V301-V309 HydrophobicContact CG1-CG1 3.73Å; V301-V309 HydrophobicContact CG1-CG2 4.31Å; L303-V309 HydrophobicContact CD2-CB 4.14Å; L303-V309 HydrophobicContact CD2-CG1 4.44Å; L303-V309 HydrophobicContact CD2-CG2 3.62Å; V309-A312 HydrophobicContact CG1-CB 4.42Å; V309-I327 HydrophobicContact CG1-CG2 4.11Å; V309-I327 HydrophobicContact CG2-CG2 4.31Å; V309-V328 HydrophobicContact CG1-CG2 4.41Å; V309-G329 PolarHBondContact O-N 3.47Å; V309-T330 PolarHBondContact N-O 3.41Å; V309-Y332 HydrophobicContact CG2-CD2 4.29Å
310	I	93.6	Very high	90.2	Very high	75 Å²	75	33.7 Å²	33.7	39%	0.385	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-44.9	176.8	-56.1	169.8	0	0	0	110.5	R302 L304 T308 V328	R302-I310 PolarHBondContact O-N 3.43Å; L304-I310 HydrophobicContact CB-CD1 4.35Å; L304-I310 HydrophobicContact CB-CG1 4.4Å; L304-I310 HydrophobicContact CD1-CG1 4.39Å; L304-I310 HydrophobicContact CD2-CD1 3.62Å; L304-I310 HydrophobicContact CD2-CG1 4.1Å; L304-I310 HydrophobicContact CG-CD1 3.61Å; L304-I310 HydrophobicContact CG-CG1 3.58Å; T308-I310 PolarHBondContact O-N 2.87Å; I310-V328 WeakPolarHBondContact O-CG1 3.18Å
311	S	91.4	Very high	89.7	Confident	37 Å²	37	32.2 Å²	32.2	26%	0.259	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	139.8	-179.7	68.9	0	0	0	0	109.4	R302	R302-S311 WeakPolarHBondContact CB-OG 3.16Å; R302-S311 WeakPolarHBondContact CD-OG 3.32Å; R302-S311 VanDerWaalsContact CG-OG 3.31Å; R302-S311 WeakPolarHBondContact CG-OG 3.34Å; R302-S311 PolarHBondContact N-O 3.35Å; R302-S311 PolarHBondContact O-N 3.17Å
312	A	89.9	Confident	89.2	Confident	14 Å²	14	34.8 Å²	34.8	12%	0.116	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	132.9	171.2	0	0	0	0	0	107.5	V309 C316 I327	V309-A312 HydrophobicContact CG1-CB 4.42Å; A312-C316 HydrophobicContact CB-CB 3.93Å; A312-I327 HydrophobicContact CB-CG2 4.16Å
313	D	88.1	Confident	88.6	Confident	66 Å²	66	30 Å²	30	35%	0.353	17%	0.173	S	C	.	.			trans	-67.6	158	172.5	-71.2	-7.8	0	0	0	110.4	I300 G315 C316 A317	I300-D313 VanDerWaalsContact CB-OD2 3.25Å; I300-D313 WeakPolarHBondContact CB-OD2 3.31Å; I300-D313 PolarHBondContact N-OD2 3.1Å; I300-D313 VanDerWaalsContact N-OD2 3.12Å; I300-D313 WeakPolarHBondContact O-CB 3.43Å; I300-D313 VanDerWaalsContact O-CG 3.31Å; I300-D313 PolarHBondContact O-N 2.83Å; D313-G315 PolarHBondContact O-N 2.86Å; D313-G315 VanDerWaalsContact O-N 3.08Å; D313-C316 WeakPolarHBondContact O-CA 3.48Å; D313-C316 WeakPolarHBondContact O-CB 3.15Å; D313-C316 PolarHBondContact O-N 2.87Å; D313-A317 PolarHBondContact O-N 3.08Å
314	F	82.5	Confident	88	Confident	67 Å²	67	31.1 Å²	31.1	29%	0.294	18%	0.181	S	C	.	.	H	α-helix	trans	-50.7	-35.1	174.8	164.8	-105.2	0	0	0	113.2	E214 H245 L282 L285 C316 A317 C318	E214-F314 HydrophobicContact CG-CD2 4.13Å; E214-F314 HydrophobicContact CG-CE2 4.45Å; E214-F314 VanDerWaalsContact OE1-CD2 3.23Å; E214-F314 WeakPolarHBondContact OE1-CD2 3.36Å; H245-F314 HydrophobicContact CB-CD2 4.47Å; H245-F314 HydrophobicContact CB-CE2 3.53Å; H245-F314 HydrophobicContact CB-CZ 4Å; H245-F314 AromaticContact CD2-CD2 3.23Å; H245-F314 WeakPolarHBondContact CD2-CD2 2.96Å; H245-F314 AromaticContact CD2-CE2 3.07Å; H245-F314 WeakPolarHBondContact CD2-CE2 3.42Å; H245-F314 AromaticContact CD2-CZ 3.73Å; H245-F314 AromaticContact CE1-CD2 3.93Å; H245-F314 AromaticContact CE1-CE1 3.68Å; H245-F314 AromaticContact CE1-CE2 3.59Å; H245-F314 AromaticContact CE1-CZ 3.4Å; H245-F314 VanDerWaalsContact CE1-CZ 3.4Å; H245-F314 WeakPolarHBondContact CE1-CZ 3.16Å; H245-F314 AromaticContact CG-CD2 3.76Å; H245-F314 AromaticContact CG-CE2 3.06Å; H245-F314 AromaticContact CG-CZ 3.41Å; H245-F314 VanDerWaalsContact CG-CZ 3.41Å; H245-F314 AromaticContact ND1-CE1 3.94Å; H245-F314 AromaticContact ND1-CE2 3.43Å; H245-F314 WeakPolarHBondContact ND1-CE2 3.47Å; H245-F314 AromaticContact ND1-CZ 3.22Å; H245-F314 WeakPolarHBondContact ND1-CZ 3.22Å; H245-F314 AromaticContact NE2-CD2 3.39Å; H245-F314 WeakPolarHBondContact NE2-CD2 3.48Å; H245-F314 AromaticContact NE2-CE2 3.45Å; H245-F314 WeakPolarHBondContact NE2-CE2 3.49Å; H245-F314 AromaticContact NE2-CG 3.75Å; H245-F314 AromaticContact NE2-CZ 3.75Å; L282-F314 HydrophobicContact CD1-CE2 4.26Å; L285-F314 HydrophobicContact CD1-CE2 4.42Å; L285-F314 HydrophobicContact CD1-CZ 3.95Å; F314-C316 VanDerWaalsContact C-N 3.25Å; F314-C316 PolarHBondContact O-N 3.35Å; F314-A317 WeakPolarHBondContact O-CB 3.33Å; F314-A317 PolarHBondContact O-N 2.83Å; F314-A317 VanDerWaalsContact O-N 3.17Å; F314-C318 WeakPolarHBondContact CE1-SG 3.47Å; F314-C318 WeakPolarHBondContact CE2-SG 3.42Å; F314-C318 WeakPolarHBondContact CZ-SG 2.84Å; F314-C318 PolarHBondContact O-N 2.91Å; F314-C318 PolarHBondContact O-SG 2.8Å
315	G	84.9	Confident	87.4	Confident	9 Å²	9	30.4 Å²	30.4	9%	0.093	18%	0.175	C	C	.	.	H	α-helix	trans	-64.1	-30.6	176.7	0	0	0	0	0	113.3	D313 C318 V319	D313-G315 PolarHBondContact O-N 2.86Å; D313-G315 VanDerWaalsContact O-N 3.08Å; G315-C318 PolarHBondContact O-N 2.73Å; G315-V319 WeakPolarHBondContact O-CG2 3.48Å; G315-V319 PolarHBondContact O-N 2.86Å; G315-V319 VanDerWaalsContact O-N 3.07Å
316	C	87.6	Confident	87.1	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.02	18%	0.178	C	C	.	.	H	α-helix	trans	-65.8	-45	172.9	-172.1	0	0	0	0	110.8	F299 V301 A312 D313 F314 C318 V319 I320	F299-C316 HydrophobicContact CD2-CB 3.59Å; F299-C316 HydrophobicContact CE2-CB 4.02Å; F299-C316 HydrophobicContact CG-CB 4.32Å; V301-C316 HydrophobicContact CG2-CB 4.09Å; V301-C316 VanDerWaalsContact CG2-SG 3.56Å; A312-C316 HydrophobicContact CB-CB 3.93Å; D313-C316 WeakPolarHBondContact O-CA 3.48Å; D313-C316 WeakPolarHBondContact O-CB 3.15Å; D313-C316 PolarHBondContact O-N 2.87Å; F314-C316 VanDerWaalsContact C-N 3.25Å; F314-C316 PolarHBondContact O-N 3.35Å; C316-C318 VanDerWaalsContact C-N 3.3Å; C316-C318 PolarHBondContact O-N 2.94Å; C316-V319 PolarHBondContact O-N 2.91Å; C316-I320 WeakPolarHBondContact O-CB 3.35Å; C316-I320 WeakPolarHBondContact O-CG1 3.45Å; C316-I320 PolarHBondContact O-N 2.84Å; C316-I320 WeakPolarHBondContact SG-CD1 3.44Å
317	A	86.1	Confident	86.9	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-61.4	-39.4	177.3	0	0	0	0	0	112.1	E214 D313 F314 G321 L322	E214-A317 WeakPolarHBondContact OE1-CB 3.43Å; E214-A317 WeakPolarHBondContact OE2-CB 3.18Å; D313-A317 PolarHBondContact O-N 3.08Å; F314-A317 WeakPolarHBondContact O-CB 3.33Å; F314-A317 PolarHBondContact O-N 2.83Å; F314-A317 VanDerWaalsContact O-N 3.17Å; A317-G321 VanDerWaalsContact O-CA 3.26Å; A317-G321 WeakPolarHBondContact O-CA 3.42Å; A317-G321 PolarHBondContact O-N 2.73Å; A317-L322 WeakPolarHBondContact CA-O 3.12Å; A317-L322 WeakPolarHBondContact CB-O 3.43Å; A317-L322 PolarHBondContact O-N 2.84Å
318	C	84.7	Confident	86.9	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.5	-44.9	173.6	-70	0	0	0	0	112.9	L282 S286 I289 F314 G315 C316	L282-C318 HydrophobicContact CD1-CB 4.49Å; S286-C318 WeakPolarHBondContact CA-O 3.44Å; S286-C318 WeakPolarHBondContact CB-O 3.26Å; I289-C318 HydrophobicContact CD1-CB 3.47Å; I289-C318 VanDerWaalsContact CD1-CB 3.47Å; F314-C318 WeakPolarHBondContact CE1-SG 3.47Å; F314-C318 WeakPolarHBondContact CE2-SG 3.42Å; F314-C318 WeakPolarHBondContact CZ-SG 2.84Å; F314-C318 PolarHBondContact O-N 2.91Å; F314-C318 PolarHBondContact O-SG 2.8Å; G315-C318 PolarHBondContact O-N 2.73Å; C316-C318 VanDerWaalsContact C-N 3.3Å; C316-C318 PolarHBondContact O-N 2.94Å
319	V	85.6	Confident	86.7	Confident	0 Å²	0	31 Å²	31	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-74.1	-44	-176.1	172.1	0	0	0	0	111.4	I289 F297 F299 G315 C316 G321 T366 V372 L398	I289-V319 HydrophobicContact CG2-CG2 4.37Å; F297-V319 HydrophobicContact CD1-CG2 4.18Å; F297-V319 HydrophobicContact CE1-CG2 3.81Å; F299-V319 HydrophobicContact CD1-CG2 4.08Å; F299-V319 HydrophobicContact CE1-CB 4.06Å; F299-V319 HydrophobicContact CE1-CG1 4.13Å; F299-V319 HydrophobicContact CE1-CG2 3.76Å; F299-V319 HydrophobicContact CZ-CB 4.3Å; F299-V319 HydrophobicContact CZ-CG1 4.22Å; F299-V319 HydrophobicContact CZ-CG2 4.49Å; G315-V319 WeakPolarHBondContact O-CG2 3.48Å; G315-V319 PolarHBondContact O-N 2.86Å; G315-V319 VanDerWaalsContact O-N 3.07Å; C316-V319 PolarHBondContact O-N 2.91Å; V319-G321 VanDerWaalsContact C-N 3.31Å; V319-T366 WeakPolarHBondContact O-CG2 3.27Å; V319-V372 HydrophobicContact CG1-CG1 4.31Å; V319-L398 HydrophobicContact CG1-CD2 4.18Å; V319-L398 HydrophobicContact CG2-CD1 4.36Å; V319-L398 HydrophobicContact CG2-CD2 4.16Å
320	I	86	Confident	86.6	Confident	5 Å²	5	32.8 Å²	32.8	3%	0.026	20%	0.201	C	C	.	.	H	α-helix	trans	-72.6	-29.6	178.4	-63	-178	0	0	0	110.6	C316 L322 I327 H335 T366 A367	C316-I320 WeakPolarHBondContact O-CB 3.35Å; C316-I320 WeakPolarHBondContact O-CG1 3.45Å; C316-I320 PolarHBondContact O-N 2.84Å; C316-I320 WeakPolarHBondContact SG-CD1 3.44Å; I320-L322 VanDerWaalsContact C-N 3.35Å; I320-L322 HydrophobicContact CG2-CB 4.03Å; I320-L322 HydrophobicContact CG2-CD1 3.88Å; I320-L322 HydrophobicContact CG2-CG 3.95Å; I320-I327 HydrophobicContact CB-CD1 4.33Å; I320-I327 HydrophobicContact CD1-CD1 4.05Å; I320-I327 HydrophobicContact CG2-CD1 4.45Å; I320-H335 HydrophobicContact CD1-CB 4.26Å; I320-T366 CarbonylContact O-C 3.51Å; I320-T366 WeakPolarHBondContact O-CA 3.39Å; I320-A367 PolarHBondContact O-N 2.79Å
321	G	82.3	Confident	86.5	Confident	26 Å²	26	37 Å²	37	27%	0.268	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	77	22.5	-175.5	0	0	0	0	0	113.2	A317 V319	A317-G321 VanDerWaalsContact O-CA 3.26Å; A317-G321 WeakPolarHBondContact O-CA 3.42Å; A317-G321 PolarHBondContact O-N 2.73Å; V319-G321 VanDerWaalsContact C-N 3.31Å
322	L	83	Confident	86.6	Confident	56 Å²	56	35.4 Å²	35.4	29%	0.293	20%	0.201	S	C	.	.	S	Bend	trans	-125.5	144.4	177	-67.1	176.8	0	0	0	109.3	A317 I320 I327 A367	A317-L322 WeakPolarHBondContact CA-O 3.12Å; A317-L322 WeakPolarHBondContact CB-O 3.43Å; A317-L322 PolarHBondContact O-N 2.84Å; I320-L322 VanDerWaalsContact C-N 3.35Å; I320-L322 HydrophobicContact CG2-CB 4.03Å; I320-L322 HydrophobicContact CG2-CD1 3.88Å; I320-L322 HydrophobicContact CG2-CG 3.95Å; L322-I327 HydrophobicContact CB-CD1 4.26Å; L322-I327 HydrophobicContact CB-CG1 4.08Å; L322-I327 WeakPolarHBondContact O-CD1 3.3Å; L322-A367 HydrophobicContact CD2-CB 3.96Å; L322-A367 HydrophobicContact CG-CB 4.14Å
323	P	82.5	Confident	86.6	Confident	9 Å²	9	37 Å²	37	6%	0.058	20%	0.204	C	C	.	.			trans	-68.3	149.6	178.3	32.5	-36.5	0	0	0	110.9	E214 Q325 D326 I327	E214-P323 HydrophobicContact CB-CB 4.36Å; E214-P323 WeakPolarHBondContact OE2-CA 3.2Å; P323-Q325 PolarHBondContact O-N 2.87Å; P323-Q325 VanDerWaalsContact O-N 3.14Å; P323-D326 HydrophobicContact CG-CB 4.13Å; P323-D326 WeakPolarHBondContact CG-OD2 3.15Å; P323-D326 PolarHBondContact O-N 2.83Å; P323-I327 PolarHBondContact O-N 3.41Å
324	S	83.7	Confident	86.7	Confident	22 Å²	22	38.7 Å²	38.7	15%	0.154	21%	0.213	C	C	.	.	H	α-helix	trans	-55.7	-36	-172.6	-66	0	0	0	0	112.9	E214 D326 I327 V328	E214-S324 PolarHBondContact OE1-OG 3.24Å; E214-S324 PolarHBondContact OE2-N 3.4Å; E214-S324 PolarHBondContact OE2-OG 3.36Å; E214-S324 VanDerWaalsContact OE2-OG 3.08Å; S324-D326 VanDerWaalsContact C-N 3.28Å; S324-D326 PolarHBondContact O-N 3.14Å; S324-I327 PolarHBondContact O-N 2.91Å; S324-V328 WeakPolarHBondContact O-CB 3.24Å; S324-V328 VanDerWaalsContact O-CG2 3.23Å; S324-V328 WeakPolarHBondContact O-CG2 3.3Å; S324-V328 PolarHBondContact O-N 3.21Å
325	Q	82.1	Confident	87	Confident	59 Å²	59	36.4 Å²	36.4	28%	0.276	20%	0.203	S	C	.	.	H	α-helix	trans	-65.2	-26	177	62	-89	30.7	0	0	114.1	D150 P323	D150-Q325 PolarHBondContact OD1-NE2 3.37Å; P323-Q325 PolarHBondContact O-N 2.87Å; P323-Q325 VanDerWaalsContact O-N 3.14Å
326	D	85.1	Confident	87.2	Confident	85 Å²	85	36 Å²	36	46%	0.455	20%	0.199	S	C	.	.	H	α-helix	trans	-85.4	-22.5	176.9	-71.2	-12	0	0	0	111.6	P323 S324 T330	P323-D326 HydrophobicContact CG-CB 4.13Å; P323-D326 WeakPolarHBondContact CG-OD2 3.15Å; P323-D326 PolarHBondContact O-N 2.83Å; S324-D326 VanDerWaalsContact C-N 3.28Å; S324-D326 PolarHBondContact O-N 3.14Å; D326-T330 VanDerWaalsContact O-CG2 3.26Å; D326-T330 WeakPolarHBondContact O-CG2 3.22Å
327	I	87.1	Confident	87.3	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-81.9	-43.2	175.3	-59.7	164.1	0	0	0	109.9	V309 A312 I320 L322 P323 S324 G329 T330	V309-I327 HydrophobicContact CG1-CG2 4.11Å; V309-I327 HydrophobicContact CG2-CG2 4.31Å; A312-I327 HydrophobicContact CB-CG2 4.16Å; I320-I327 HydrophobicContact CB-CD1 4.33Å; I320-I327 HydrophobicContact CD1-CD1 4.05Å; I320-I327 HydrophobicContact CG2-CD1 4.45Å; L322-I327 HydrophobicContact CB-CD1 4.26Å; L322-I327 HydrophobicContact CB-CG1 4.08Å; L322-I327 WeakPolarHBondContact O-CD1 3.3Å; P323-I327 PolarHBondContact O-N 3.41Å; S324-I327 PolarHBondContact O-N 2.91Å; I327-G329 PolarHBondContact O-N 2.92Å; I327-T330 WeakPolarHBondContact O-CB 3.4Å; I327-T330 PolarHBondContact O-N 2.78Å; I327-T330 VanDerWaalsContact O-N 3.17Å; I327-T330 PolarHBondContact O-OG1 3.43Å
328	V	90.5	Very high	87.4	Confident	60 Å²	60	39.8 Å²	39.8	36%	0.364	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	133.3	-179.1	171.5	0	0	0	0	110.8	V309 I310 S324 T330	V309-V328 HydrophobicContact CG1-CG2 4.41Å; I310-V328 WeakPolarHBondContact O-CG1 3.18Å; S324-V328 WeakPolarHBondContact O-CB 3.24Å; S324-V328 VanDerWaalsContact O-CG2 3.23Å; S324-V328 WeakPolarHBondContact O-CG2 3.3Å; S324-V328 PolarHBondContact O-N 3.21Å; V328-T330 VanDerWaalsContact C-N 3.29Å; V328-T330 PolarHBondContact O-N 2.91Å
329	G	90.4	Very high	87.6	Confident	54 Å²	54	45.3 Å²	45.3	56%	0.557	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.2	-11.8	-176.3	0	0	0	0	0	114.6	V309 I327	V309-G329 PolarHBondContact O-N 3.47Å; I327-G329 PolarHBondContact O-N 2.92Å
330	T	92.1	Very high	87.8	Confident	41 Å²	41	45.7 Å²	45.7	25%	0.252	26%	0.257	S	S	.	.	S	Bend	trans	-82.7	158.4	171.3	69.5	0	0	0	0	111.1	V309 D326 I327 V328 H335	V309-T330 PolarHBondContact N-O 3.41Å; D326-T330 VanDerWaalsContact O-CG2 3.26Å; D326-T330 WeakPolarHBondContact O-CG2 3.22Å; I327-T330 WeakPolarHBondContact O-CB 3.4Å; I327-T330 PolarHBondContact O-N 2.78Å; I327-T330 VanDerWaalsContact O-N 3.17Å; I327-T330 PolarHBondContact O-OG1 3.43Å; V328-T330 VanDerWaalsContact C-N 3.29Å; V328-T330 PolarHBondContact O-N 2.91Å; T330-H335 PolarHBondContact OG1-NE2 3.04Å
331	R	92.2	Very high	87.9	Confident	162 Å²	162	50.8 Å²	50.8	61%	0.611	28%	0.276	S	S	*	.	B	Isolated β-bridge	trans	-73.1	131.8	171.9	-70.1	-175.7	179.5	153.5	0.8	109.6	Y333 N334	R331-Y333 PolarHBondContact O-N 3.09Å; R331-Y333 VanDerWaalsContact O-N 3.14Å; R331-N334 WeakPolarHBondContact O-CB 2.7Å; R331-N334 PolarHBondContact O-N 2.79Å
332	Y	92	Very high	88.3	Confident	5 Å²	5	53.9 Å²	53.9	2%	0.02	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-52.5	-39.7	-179.8	-176.5	-103.4	0	0	0	113.1	V301 L303 G307 V309 N334 H335 V336 Y362 W378 H396	V301-Y332 HydrophobicContact CG1-CD2 4.35Å; V301-Y332 HydrophobicContact CG1-CE2 4.44Å; L303-Y332 HydrophobicContact CD1-CD1 4.17Å; L303-Y332 HydrophobicContact CD1-CD2 4.1Å; L303-Y332 HydrophobicContact CD1-CG 3.75Å; L303-Y332 HydrophobicContact CD2-CD2 3.76Å; L303-Y332 HydrophobicContact CD2-CG 3.98Å; G307-Y332 VanDerWaalsContact O-CB 3.31Å; G307-Y332 WeakPolarHBondContact O-CB 3.36Å; G307-Y332 PolarHBondContact O-N 3.27Å; V309-Y332 HydrophobicContact CG2-CD2 4.29Å; Y332-N334 PolarHBondContact O-N 3.48Å; Y332-N334 VanDerWaalsContact O-N 3.13Å; Y332-H335 PolarHBondContact O-N 2.83Å; Y332-V336 HydrophobicContact CD1-CG2 4.04Å; Y332-V336 HydrophobicContact CE1-CG2 3.61Å; Y332-Y362 HydrophobicContact CE1-CE2 4.46Å; Y332-Y362 WeakPolarHBondContact OH-CE2 3.27Å; Y332-Y362 PolarHBondContact OH-OH 3Å; Y332-W378 AromaticContact CD1-CH2 3.69Å; Y332-W378 HydrophobicContact CD1-CH2 3.69Å; Y332-W378 HydrophobicContact CD1-CZ2 4.04Å; Y332-W378 AromaticContact CE1-CH2 3.77Å; Y332-W378 HydrophobicContact CE1-CH2 3.77Å; Y332-W378 AromaticContact CE1-CZ2 3.62Å; Y332-W378 HydrophobicContact CE1-CZ2 3.62Å; Y332-H396 AromaticContact CZ-CE1 3.95Å; Y332-H396 AromaticContact CZ-NE2 3.73Å; Y332-H396 PolarHBondContact OH-CE1 3.12Å; Y332-H396 VanDerWaalsContact OH-CE1 3.27Å; Y332-H396 PolarHBondContact OH-NE2 3.03Å
333	Y	90.7	Very high	88.7	Confident	46 Å²	46	54.1 Å²	54.1	18%	0.18	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-60.4	-23	-179.8	-54.3	-69.8	0	0	0	114.6	R331 H335 V336 F345 H348	R331-Y333 PolarHBondContact O-N 3.09Å; R331-Y333 VanDerWaalsContact O-N 3.14Å; Y333-H335 PolarHBondContact O-N 3.45Å; Y333-V336 PolarHBondContact O-N 3.21Å; Y333-F345 HydrophobicContact CE1-CB 4.18Å; Y333-F345 HydrophobicContact CE1-CD2 4.31Å; Y333-F345 AromaticContact CZ-CD2 3.96Å; Y333-F345 WeakPolarHBondContact OH-CD2 3.44Å; Y333-H348 AromaticContact CZ-ND1 3.72Å; Y333-H348 PolarHBondContact OH-ND1 2.8Å
334	N	89.3	Confident	89	Confident	102 Å²	102	53.7 Å²	53.7	55%	0.545	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-65.7	-29.4	177.6	-66.9	-2.9	0	0	0	111.6	R331 Y332	R331-N334 WeakPolarHBondContact O-CB 2.7Å; R331-N334 PolarHBondContact O-N 2.79Å; Y332-N334 PolarHBondContact O-N 3.48Å; Y332-N334 VanDerWaalsContact O-N 3.13Å
335	H	88.9	Confident	89.4	Confident	20 Å²	20	57 Å²	57	9%	0.093	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-88.4	-7.7	178.8	-56.3	-67.1	0	0	0	112.8	I320 T330 Y332 Y333 L364 K365	I320-H335 HydrophobicContact CD1-CB 4.26Å; T330-H335 PolarHBondContact OG1-NE2 3.04Å; Y332-H335 PolarHBondContact O-N 2.83Å; Y333-H335 PolarHBondContact O-N 3.45Å; H335-L364 CarbonylContact O-C 3.59Å; H335-L364 WeakPolarHBondContact O-CA 3.43Å; H335-L364 WeakPolarHBondContact O-CD2 3.24Å; H335-K365 PolarHBondContact O-N 3.22Å
336	V	90.6	Very high	89.9	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.305	C	S	.	.	B	Isolated β-bridge	trans	-87.1	148.3	175.8	-175.4	0	0	0	0	109.6	Y332 Y333 S338 D340 Y362 L364 K365	Y332-V336 HydrophobicContact CD1-CG2 4.04Å; Y332-V336 HydrophobicContact CE1-CG2 3.61Å; Y333-V336 PolarHBondContact O-N 3.21Å; V336-S338 PolarHBondContact O-N 3.06Å; V336-D340 HydrophobicContact CG1-CB 4.37Å; V336-Y362 HydrophobicContact CG1-CD2 3.95Å; V336-Y362 HydrophobicContact CG1-CE2 4.49Å; V336-Y362 HydrophobicContact CG2-CD2 4.45Å; V336-Y362 HydrophobicContact CG2-CE2 4.19Å; V336-L364 HydrophobicContact CG2-CD2 4.15Å; V336-K365 WeakPolarHBondContact O-CD 3.27Å; V336-K365 VanDerWaalsContact O-CE 3.24Å; V336-K365 WeakPolarHBondContact O-CE 3.23Å; V336-K365 PolarHBondContact O-NZ 3.25Å
337	C	88.8	Confident	90.2	Very high	6 Å²	6	54.2 Å²	54.2	4%	0.041	28%	0.283	C	S	.	.			trans	-54.9	138.7	172.8	-171.3	0	0	0	0	110.8	D339 D340 W341 R363 M371	C337-D339 PolarHBondContact O-N 3Å; C337-D339 VanDerWaalsContact O-N 3.12Å; C337-D340 HydrophobicContact CB-CB 4.22Å; C337-D340 PolarHBondContact O-N 2.82Å; C337-W341 PolarHBondContact O-N 3.07Å; C337-R363 HydrophobicContact CB-CB 3.52Å; C337-R363 WeakPolarHBondContact CB-O 3.35Å; C337-R363 PolarHBondContact N-O 2.85Å; C337-M371 HydrophobicContact CB-SD 4.11Å
338	S	87.9	Confident	90.5	Very high	77 Å²	77	54.7 Å²	54.7	54%	0.538	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-19.9	-176.4	-56.9	0	0	0	0	113.2	V336 W341 K365	V336-S338 PolarHBondContact O-N 3.06Å; S338-W341 VanDerWaalsContact O-CD1 3.27Å; S338-K365 PolarHBondContact OG-NZ 3.16Å
339	D	88.9	Confident	90.5	Very high	116 Å²	116	58.9 Å²	58.9	62%	0.62	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-19.4	177.7	-56.4	-27.1	0	0	0	112.6	C337 Q342 R363	C337-D339 PolarHBondContact O-N 3Å; C337-D339 VanDerWaalsContact O-N 3.12Å; D339-Q342 PolarHBondContact O-OE1 2.96Å; D339-R363 IonicContact OD2-NH2 2.91Å
340	D	90.2	Very high	90.5	Very high	8 Å²	8	58.1 Å²	58.1	4%	0.043	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	4	-170.1	-57.6	-12.9	0	0	0	112.6	V336 C337 Q342 I343 R363	V336-D340 HydrophobicContact CG1-CB 4.37Å; C337-D340 HydrophobicContact CB-CB 4.22Å; C337-D340 PolarHBondContact O-N 2.82Å; D340-Q342 PolarHBondContact O-N 2.92Å; D340-I343 HydrophobicContact CB-CD1 4.3Å; D340-I343 WeakPolarHBondContact O-CB 3.39Å; D340-I343 PolarHBondContact O-N 2.77Å; D340-I343 VanDerWaalsContact O-N 3.12Å; D340-R363 IonicContact OD1-CZ 3.64Å; D340-R363 IonicContact OD1-NE 3.64Å; D340-R363 IonicContact OD1-NH2 3.8Å; D340-R363 PolarHBondContact OD1-NH2 2.98Å; D340-R363 VanDerWaalsContact OD2-CB 3.29Å; D340-R363 WeakPolarHBondContact OD2-CB 3.47Å; D340-R363 IonicContact OD2-CZ 3.98Å; D340-R363 PolarHBondContact OD2-N 2.89Å; D340-R363 IonicContact OD2-NE 3.76Å; D340-R363 PolarHBondContact OD2-NE 2.8Å; D340-R363 IonicContact OD2-NH2 3.48Å; D340-R363 PolarHBondContact OD2-NH2 3.07Å
341	W	87.8	Confident	90.5	Very high	111 Å²	111	56.2 Å²	56.2	42%	0.42	27%	0.269	S	S	.	.	H	α-helix	trans	-63.7	-30.3	-175.6	77.9	-92.6	0	0	0	112.4	C337 S338 I343 S344 F345	C337-W341 PolarHBondContact O-N 3.07Å; S338-W341 VanDerWaalsContact O-CD1 3.27Å; W341-I343 VanDerWaalsContact C-N 3.25Å; W341-I343 PolarHBondContact O-N 2.75Å; W341-S344 PolarHBondContact O-N 3.08Å; W341-S344 PolarHBondContact O-OG 2.9Å; W341-F345 HydrophobicContact CE3-CB 3.93Å; W341-F345 HydrophobicContact CE3-CG 4.39Å; W341-F345 HydrophobicContact CZ3-CB 3.92Å; W341-F345 HydrophobicContact CZ3-CD1 4.39Å; W341-F345 HydrophobicContact CZ3-CD2 4.2Å; W341-F345 AromaticContact CZ3-CG 3.91Å; W341-F345 HydrophobicContact CZ3-CG 3.91Å; W341-F345 WeakPolarHBondContact O-CB 3.47Å; W341-F345 PolarHBondContact O-N 2.97Å
342	Q	91.6	Very high	90.4	Very high	92 Å²	92	51.6 Å²	51.6	43%	0.43	26%	0.256	S	S	.	.	H	α-helix	trans	-63.3	-34.8	178	-63.9	87.1	-21.8	0	0	111.2	D339 D340 F345 V346	D339-Q342 PolarHBondContact O-OE1 2.96Å; D340-Q342 PolarHBondContact O-N 2.92Å; Q342-F345 PolarHBondContact O-N 2.72Å; Q342-V346 VanDerWaalsContact O-CG2 3.3Å; Q342-V346 WeakPolarHBondContact O-CG2 3.44Å; Q342-V346 PolarHBondContact O-N 3.27Å
343	I	90.9	Very high	90.1	Very high	60 Å²	60	58 Å²	58	31%	0.308	29%	0.286	S	S	.	.	H	α-helix	trans	-65.2	-46.8	178.9	-57.1	174.5	0	0	0	109.8	D340 W341 F345 V346 A347 C360 Y362	D340-I343 HydrophobicContact CB-CD1 4.3Å; D340-I343 WeakPolarHBondContact O-CB 3.39Å; D340-I343 PolarHBondContact O-N 2.77Å; D340-I343 VanDerWaalsContact O-N 3.12Å; W341-I343 VanDerWaalsContact C-N 3.25Å; W341-I343 PolarHBondContact O-N 2.75Å; I343-F345 VanDerWaalsContact C-N 3.34Å; I343-V346 PolarHBondContact O-N 3.07Å; I343-A347 PolarHBondContact O-N 2.65Å; I343-A347 VanDerWaalsContact O-N 3.15Å; I343-C360 HydrophobicContact CG2-CB 3.79Å; I343-Y362 HydrophobicContact CG2-CD1 4.49Å
344	S	89.2	Confident	89.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-67.5	-35.5	176.9	63.5	0	0	0	0	112	W341 A347 H348	W341-S344 PolarHBondContact O-N 3.08Å; W341-S344 PolarHBondContact O-OG 2.9Å; S344-A347 PolarHBondContact O-N 2.94Å; S344-H348 WeakPolarHBondContact O-CB 3.32Å; S344-H348 PolarHBondContact O-N 3.19Å
345	F	91.5	Very high	89.1	Confident	91 Å²	91	58.7 Å²	58.7	40%	0.399	30%	0.301	S	S	.	.	H	α-helix	trans	-65	-42.4	176.1	-174.8	-98.7	0	0	0	112.9	Y333 W341 Q342 I343 H348 R349	Y333-F345 HydrophobicContact CE1-CB 4.18Å; Y333-F345 HydrophobicContact CE1-CD2 4.31Å; Y333-F345 AromaticContact CZ-CD2 3.96Å; Y333-F345 WeakPolarHBondContact OH-CD2 3.44Å; W341-F345 HydrophobicContact CE3-CB 3.93Å; W341-F345 HydrophobicContact CE3-CG 4.39Å; W341-F345 HydrophobicContact CZ3-CB 3.92Å; W341-F345 HydrophobicContact CZ3-CD1 4.39Å; W341-F345 HydrophobicContact CZ3-CD2 4.2Å; W341-F345 AromaticContact CZ3-CG 3.91Å; W341-F345 HydrophobicContact CZ3-CG 3.91Å; W341-F345 WeakPolarHBondContact O-CB 3.47Å; W341-F345 PolarHBondContact O-N 2.97Å; Q342-F345 PolarHBondContact O-N 2.72Å; I343-F345 VanDerWaalsContact C-N 3.34Å; F345-H348 PolarHBondContact O-N 2.93Å; F345-R349 PolarHBondContact O-N 2.63Å
346	V	92	Very high	88.9	Confident	86 Å²	86	65.3 Å²	65.3	52%	0.521	33%	0.33	S	S	.	.	H	α-helix	trans	-62.5	-43.8	174.8	170.3	0	0	0	0	110.7	Q342 I343 R349 S350	Q342-V346 VanDerWaalsContact O-CG2 3.3Å; Q342-V346 WeakPolarHBondContact O-CG2 3.44Å; Q342-V346 PolarHBondContact O-N 3.27Å; I343-V346 PolarHBondContact O-N 3.07Å; V346-R349 PolarHBondContact O-N 2.78Å; V346-S350 WeakPolarHBondContact O-CB 3.39Å; V346-S350 PolarHBondContact O-N 2.83Å
347	A	91.4	Very high	88.8	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-61.3	-46	176.5	0	0	0	0	0	112	I343 S344 R349 S350 V351 H358 W378	I343-A347 PolarHBondContact O-N 2.65Å; I343-A347 VanDerWaalsContact O-N 3.15Å; S344-A347 PolarHBondContact O-N 2.94Å; A347-R349 PolarHBondContact O-N 3.19Å; A347-S350 PolarHBondContact O-N 3.34Å; A347-V351 WeakPolarHBondContact O-CG2 3.38Å; A347-V351 PolarHBondContact O-N 2.93Å; A347-V351 VanDerWaalsContact O-N 3.09Å; A347-H358 HydrophobicContact CB-CB 4.47Å; A347-H358 WeakPolarHBondContact CB-CD2 3.38Å; A347-W378 HydrophobicContact CB-CD2 4.19Å; A347-W378 HydrophobicContact CB-CG 3.97Å
348	H	92.7	Very high	88.9	Confident	11 Å²	11	71.5 Å²	71.5	5%	0.051	37%	0.366	C	S	.	.	H	α-helix	trans	-56.5	-52	175	-177.8	176.4	0	0	0	111.2	V305 Y333 S344 F345 S350 V351 L352 W378 L392	V305-H348 PolarHBondContact O-CE1 3.17Å; V305-H348 PolarHBondContact O-NE2 3.47Å; Y333-H348 AromaticContact CZ-ND1 3.72Å; Y333-H348 PolarHBondContact OH-ND1 2.8Å; S344-H348 WeakPolarHBondContact O-CB 3.32Å; S344-H348 PolarHBondContact O-N 3.19Å; F345-H348 PolarHBondContact O-N 2.93Å; H348-S350 VanDerWaalsContact C-N 3.34Å; H348-S350 PolarHBondContact O-N 2.83Å; H348-V351 PolarHBondContact O-N 2.81Å; H348-L352 WeakPolarHBondContact NE2-CD1 3.16Å; H348-L352 PolarHBondContact O-N 3.03Å; H348-W378 HydrophobicContact CB-CE3 4.24Å; H348-W378 HydrophobicContact CB-CH2 4.36Å; H348-W378 HydrophobicContact CB-CZ3 3.84Å; H348-L392 WeakPolarHBondContact CD2-CD1 3.47Å; H348-L392 VanDerWaalsContact NE2-CD1 3.27Å; H348-L392 WeakPolarHBondContact NE2-CD1 3.37Å
349	R	91.9	Very high	89.1	Confident	149 Å²	149	71.9 Å²	71.9	56%	0.562	37%	0.369	S	S	*	.	H	α-helix	trans	-61.7	-40.9	178.9	-175.7	176.3	170.6	160.6	-2.6	112.5	F345 V346 A347 V351 L352 Q353	F345-R349 PolarHBondContact O-N 2.63Å; V346-R349 PolarHBondContact O-N 2.78Å; A347-R349 PolarHBondContact O-N 3.19Å; R349-V351 VanDerWaalsContact C-N 3.3Å; R349-V351 PolarHBondContact O-N 3.47Å; R349-L352 PolarHBondContact O-N 3.49Å; R349-Q353 HydrophobicContact CG-CG 4.47Å; R349-Q353 WeakPolarHBondContact O-CG 3.35Å; R349-Q353 PolarHBondContact O-N 3.32Å; R349-Q353 VanDerWaalsContact O-N 3.11Å
350	S	90.6	Very high	89.3	Confident	38 Å²	38	67 Å²	67	27%	0.266	34%	0.344	S	S	.	.	H	α-helix	trans	-59	-41	178.5	-177	0	0	0	0	112.1	V346 A347 H348 Q353 S354 H358	V346-S350 WeakPolarHBondContact O-CB 3.39Å; V346-S350 PolarHBondContact O-N 2.83Å; A347-S350 PolarHBondContact O-N 3.34Å; H348-S350 VanDerWaalsContact C-N 3.34Å; H348-S350 PolarHBondContact O-N 2.83Å; S350-Q353 PolarHBondContact O-N 3.02Å; S350-S354 WeakPolarHBondContact O-CB 3.11Å; S350-S354 PolarHBondContact O-N 2.81Å; S350-H358 WeakPolarHBondContact CB-ND1 3.43Å; S350-H358 PolarHBondContact OG-ND1 3.3Å; S350-H358 VanDerWaalsContact OG-ND1 3.16Å
351	V	91.2	Very high	89.3	Confident	0 Å²	0	70 Å²	70	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-79.9	-21.2	-176.2	171.7	0	0	0	0	113	A347 H348 R349 S354 H358 W378 S380 L392	A347-V351 WeakPolarHBondContact O-CG2 3.38Å; A347-V351 PolarHBondContact O-N 2.93Å; A347-V351 VanDerWaalsContact O-N 3.09Å; H348-V351 PolarHBondContact O-N 2.81Å; R349-V351 VanDerWaalsContact C-N 3.3Å; R349-V351 PolarHBondContact O-N 3.47Å; V351-S354 CarbonylContact C-O 3.52Å; V351-S354 WeakPolarHBondContact CA-O 3.43Å; V351-H358 HydrophobicContact CG2-CB 3.53Å; V351-W378 HydrophobicContact CG2-CB 3.68Å; V351-S380 WeakPolarHBondContact O-CB 3.3Å; V351-S380 PolarHBondContact O-OG 3.39Å; V351-L392 HydrophobicContact CG1-CD2 3.85Å
352	L	89.4	Confident	89.6	Confident	65 Å²	65	64.8 Å²	64.8	34%	0.34	35%	0.345	S	S	.	.	H	α-helix	trans	-77.5	-35.1	169.5	-71.3	177.3	0	0	0	112.4	V305 H348 R349 V389 L392	V305-L352 HydrophobicContact CG1-CD1 4.18Å; V305-L352 HydrophobicContact CG1-CD2 3.9Å; H348-L352 WeakPolarHBondContact NE2-CD1 3.16Å; H348-L352 PolarHBondContact O-N 3.03Å; R349-L352 PolarHBondContact O-N 3.49Å; L352-V389 HydrophobicContact CD2-CG1 4.25Å; L352-L392 HydrophobicContact CD2-CD1 4.45Å; L352-L392 HydrophobicContact CD2-CD2 3.97Å
353	Q	87.5	Confident	89.5	Confident	139 Å²	139	62.7 Å²	62.7	65%	0.65	33%	0.333	S	S	*	.	H	α-helix	trans	-82.1	-30.5	179.8	-68.5	-179.8	-28.8	0	0	113	R349 S350	R349-Q353 HydrophobicContact CG-CG 4.47Å; R349-Q353 WeakPolarHBondContact O-CG 3.35Å; R349-Q353 PolarHBondContact O-N 3.32Å; R349-Q353 VanDerWaalsContact O-N 3.11Å; S350-Q353 PolarHBondContact O-N 3.02Å
354	S	80.5	Confident	89.5	Confident	42 Å²	42	59.9 Å²	59.9	29%	0.294	32%	0.319	S	S	.	.			trans	-127.8	133.5	-177.8	145.1	0	0	0	0	108.9	S350 V351 K356	S350-S354 WeakPolarHBondContact O-CB 3.11Å; S350-S354 PolarHBondContact O-N 2.81Å; V351-S354 CarbonylContact C-O 3.52Å; V351-S354 WeakPolarHBondContact CA-O 3.43Å; S354-K356 PolarHBondContact O-N 3.19Å; S354-K356 VanDerWaalsContact O-N 3.08Å; S354-K356 VanDerWaalsContact OG-CB 3.27Å; S354-K356 WeakPolarHBondContact OG-CB 3.13Å; S354-K356 PolarHBondContact OG-N 3.47Å
355	T	76.9	Confident	89.5	Confident	122 Å²	122	62.8 Å²	62.8	75%	0.748	33%	0.332	S	S	*	.	S	Bend	trans	-70.5	3	173.8	52	0	0	0	0	113.6
356	K	84.5	Confident	89.3	Confident	159 Å²	159	59.2 Å²	59.2	69%	0.691	32%	0.317	S	S	*	.	S	Bend	trans	-82.2	147.1	174.2	-56.9	-177.1	177.2	-178.8	0	111.2	S354	S354-K356 PolarHBondContact O-N 3.19Å; S354-K356 VanDerWaalsContact O-N 3.08Å; S354-K356 VanDerWaalsContact OG-CB 3.27Å; S354-K356 WeakPolarHBondContact OG-CB 3.13Å; S354-K356 PolarHBondContact OG-N 3.47Å
357	C	89.7	Confident	88.7	Confident	86 Å²	86	58 Å²	58	58%	0.581	32%	0.316	S	S	*	.			trans	-64.8	149.5	173	-53.6	0	0	0	0	111.5	V377 W378	C357-V377 HydrophobicContact CB-CG1 4.12Å; C357-W378 CarbonylContact C-O 3.59Å; C357-W378 WeakPolarHBondContact CA-O 3.27Å; C357-W378 WeakPolarHBondContact CB-O 3.41Å
358	H	90.7	Very high	87.8	Confident	50 Å²	50	64.3 Å²	64.3	23%	0.231	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	121.5	174.9	-169.1	104.7	0	0	0	109.8	A347 S350 V351 W378	A347-H358 HydrophobicContact CB-CB 4.47Å; A347-H358 WeakPolarHBondContact CB-CD2 3.38Å; S350-H358 WeakPolarHBondContact CB-ND1 3.43Å; S350-H358 PolarHBondContact OG-ND1 3.3Å; S350-H358 VanDerWaalsContact OG-ND1 3.16Å; V351-H358 HydrophobicContact CG2-CB 3.53Å; H358-W378 HydrophobicContact CB-CB 4.45Å; H358-W378 PolarHBondContact N-O 2.79Å; H358-W378 PolarHBondContact O-N 2.85Å
359	S	92.6	Very high	86.8	Confident	84 Å²	84	67 Å²	67	59%	0.587	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.9	130.1	177.8	-60.1	0	0	0	0	110.2	A376	S359-A376 WeakPolarHBondContact CA-O 3.39Å
360	C	92.1	Very high	86.3	Confident	14 Å²	14	62 Å²	62	10%	0.095	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	162.4	174.8	60.5	0	0	0	0	110.7	I343 Y362 A376	I343-C360 HydrophobicContact CG2-CB 3.79Å; C360-Y362 VanDerWaalsContact SG-CE1 3.56Å; C360-A376 PolarHBondContact N-O 3.19Å; C360-A376 PolarHBondContact O-N 2.89Å
361	S	91.1	Very high	86.1	Confident	70 Å²	70	64.4 Å²	64.4	49%	0.49	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	136.3	176.7	-52.4	0	0	0	0	109.5	V374	S361-V374 VanDerWaalsContact CA-O 3.3Å; S361-V374 WeakPolarHBondContact CA-O 3.24Å
362	Y	92.4	Very high	85.9	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.008	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	173.7	-179.5	51.8	-96.5	0	0	0	110.5	Y332 V336 I343 C360 L364 V374 A376 W378 H396	Y332-Y362 HydrophobicContact CE1-CE2 4.46Å; Y332-Y362 WeakPolarHBondContact OH-CE2 3.27Å; Y332-Y362 PolarHBondContact OH-OH 3Å; V336-Y362 HydrophobicContact CG1-CD2 3.95Å; V336-Y362 HydrophobicContact CG1-CE2 4.49Å; V336-Y362 HydrophobicContact CG2-CD2 4.45Å; V336-Y362 HydrophobicContact CG2-CE2 4.19Å; I343-Y362 HydrophobicContact CG2-CD1 4.49Å; C360-Y362 VanDerWaalsContact SG-CE1 3.56Å; Y362-L364 HydrophobicContact CD2-CD2 4.27Å; Y362-L364 HydrophobicContact CE2-CD2 3.75Å; Y362-L364 HydrophobicContact CE2-CG 4.24Å; Y362-V374 HydrophobicContact CD2-CG2 3.87Å; Y362-V374 HydrophobicContact CE2-CG2 3.7Å; Y362-V374 PolarHBondContact N-O 2.9Å; Y362-V374 WeakPolarHBondContact O-CG2 2.99Å; Y362-V374 PolarHBondContact O-N 3.47Å; Y362-A376 HydrophobicContact CD1-CB 4.48Å; Y362-A376 HydrophobicContact CE1-CB 3.44Å; Y362-A376 VanDerWaalsContact CE1-CB 3.44Å; Y362-A376 WeakPolarHBondContact OH-CB 3.46Å; Y362-W378 AromaticContact CE1-NE1 3.91Å; Y362-H396 AromaticContact CZ-NE2 3.98Å; Y362-H396 PolarHBondContact OH-NE2 2.92Å
363	R	90.5	Very high	85.9	Confident	48 Å²	48	63.3 Å²	63.3	18%	0.181	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	136.2	174.9	-73.9	169.6	-78.8	-176.6	11.8	113	C337 D339 D340 M371 V372 F373	C337-R363 HydrophobicContact CB-CB 3.52Å; C337-R363 WeakPolarHBondContact CB-O 3.35Å; C337-R363 PolarHBondContact N-O 2.85Å; D339-R363 IonicContact OD2-NH2 2.91Å; D340-R363 IonicContact OD1-CZ 3.64Å; D340-R363 IonicContact OD1-NE 3.64Å; D340-R363 IonicContact OD1-NH2 3.8Å; D340-R363 PolarHBondContact OD1-NH2 2.98Å; D340-R363 VanDerWaalsContact OD2-CB 3.29Å; D340-R363 WeakPolarHBondContact OD2-CB 3.47Å; D340-R363 IonicContact OD2-CZ 3.98Å; D340-R363 PolarHBondContact OD2-N 2.89Å; D340-R363 IonicContact OD2-NE 3.76Å; D340-R363 PolarHBondContact OD2-NE 2.8Å; D340-R363 IonicContact OD2-NH2 3.48Å; D340-R363 PolarHBondContact OD2-NH2 3.07Å; R363-M371 HydrophobicContact CB-CB 4.48Å; R363-V372 CarbonylContact C-O 3.56Å; R363-V372 VanDerWaalsContact CA-O 3.3Å; R363-V372 WeakPolarHBondContact CA-O 3.36Å; R363-F373 HydrophobicContact CB-CE2 4.4Å; R363-F373 HydrophobicContact CG-CD1 4.3Å; R363-F373 HydrophobicContact CG-CD2 3.6Å; R363-F373 HydrophobicContact CG-CE1 3.86Å; R363-F373 HydrophobicContact CG-CE2 2.96Å; R363-F373 HydrophobicContact CG-CG 4.2Å; R363-F373 HydrophobicContact CG-CZ 3.15Å
364	L	90.7	Very high	86	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.01	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	142.7	164.3	-68.6	179.5	0	0	0	110.9	F299 H335 V336 Y362 M371 V372 V374	F299-L364 HydrophobicContact CE2-CD1 4.42Å; F299-L364 HydrophobicContact CZ-CD1 3.88Å; H335-L364 CarbonylContact O-C 3.59Å; H335-L364 WeakPolarHBondContact O-CA 3.43Å; H335-L364 WeakPolarHBondContact O-CD2 3.24Å; V336-L364 HydrophobicContact CG2-CD2 4.15Å; Y362-L364 HydrophobicContact CD2-CD2 4.27Å; Y362-L364 HydrophobicContact CE2-CD2 3.75Å; Y362-L364 HydrophobicContact CE2-CG 4.24Å; L364-M371 CarbonylContact O-C 3.55Å; L364-M371 WeakPolarHBondContact O-CA 3.26Å; L364-V372 PolarHBondContact N-O 3.37Å; L364-V372 PolarHBondContact O-N 2.9Å; L364-V374 HydrophobicContact CD1-CB 4.44Å; L364-V374 HydrophobicContact CD1-CG1 3.79Å; L364-V374 HydrophobicContact CD1-CG2 3.89Å; L364-V374 HydrophobicContact CG-CG1 4.19Å; L364-V374 HydrophobicContact CG-CG2 3.72Å
365	K	89.5	Confident	86.5	Confident	61 Å²	61	56.6 Å²	56.6	27%	0.265	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	131.6	170.3	-73.2	167.9	176.4	151.2	0	108.9	H335 V336 S338 M371	H335-K365 PolarHBondContact O-N 3.22Å; V336-K365 WeakPolarHBondContact O-CD 3.27Å; V336-K365 VanDerWaalsContact O-CE 3.24Å; V336-K365 WeakPolarHBondContact O-CE 3.23Å; V336-K365 PolarHBondContact O-NZ 3.25Å; S338-K365 PolarHBondContact OG-NZ 3.16Å; K365-M371 HydrophobicContact CB-SD 4.28Å; K365-M371 HydrophobicContact CG-CE 3.68Å; K365-M371 HydrophobicContact CG-SD 3.54Å; K365-M371 VanDerWaalsContact CG-SD 3.54Å
366	T	86.1	Confident	87.3	Confident	15 Å²	15	50.8 Å²	50.8	9%	0.092	29%	0.285	C	S	.	.			trans	-110	149.1	171.3	68.1	0	0	0	0	109.1	V319 I320 K368 H369 G370 V372	V319-T366 WeakPolarHBondContact O-CG2 3.27Å; I320-T366 CarbonylContact O-C 3.51Å; I320-T366 WeakPolarHBondContact O-CA 3.39Å; T366-K368 VanDerWaalsContact C-N 3.29Å; T366-K368 PolarHBondContact O-N 3.4Å; T366-H369 VanDerWaalsContact OG1-CA 3.28Å; T366-H369 WeakPolarHBondContact OG1-CA 3.28Å; T366-H369 WeakPolarHBondContact OG1-CB 3.48Å; T366-H369 PolarHBondContact OG1-N 3.09Å; T366-G370 PolarHBondContact N-O 3.37Å; T366-G370 VanDerWaalsContact OG1-C 3.29Å; T366-G370 PolarHBondContact OG1-N 3.49Å; T366-G370 PolarHBondContact OG1-O 3.15Å; T366-V372 HydrophobicContact CG2-CB 4.15Å; T366-V372 HydrophobicContact CG2-CG2 3.44Å; T366-V372 VanDerWaalsContact CG2-CG2 3.44Å
367	A	80.1	Confident	87.8	Confident	60 Å²	60	45.4 Å²	45.4	50%	0.496	27%	0.266	S	S	.	.	S	Bend	trans	-64.8	-32.6	-176.2	0	0	0	0	0	113	I320 L322	I320-A367 PolarHBondContact O-N 2.79Å; L322-A367 HydrophobicContact CD2-CB 3.96Å; L322-A367 HydrophobicContact CG-CB 4.14Å
368	K	73.4	Confident	88	Confident	134 Å²	134	41.3 Å²	41.3	58%	0.583	24%	0.238	S	C	*	.	S	Bend	trans	-125.6	-30.8	-174.6	-65.7	-170.9	171.9	-169.7	0	114.8	E283 T366	E283-K368 HydrophobicContact CG-CD 4.36Å; E283-K368 WeakPolarHBondContact OE1-CD 3.09Å; E283-K368 IonicContact OE1-NZ 3.68Å; E283-K368 PolarHBondContact OE1-NZ 2.91Å; E283-K368 IonicContact OE2-NZ 3.4Å; E283-K368 PolarHBondContact OE2-NZ 2.9Å; T366-K368 VanDerWaalsContact C-N 3.29Å; T366-K368 PolarHBondContact O-N 3.4Å
369	H	70.3	Confident	88.1	Confident	68 Å²	68	40.4 Å²	40.4	32%	0.315	24%	0.237	S	C	.	.	S	Bend	trans	-95.9	11.7	-169.8	-59.4	-57.1	0	0	0	114.4	S286 E287 L290 T366 M371	S286-H369 PolarHBondContact OG-CD2 3.08Å; S286-H369 PolarHBondContact OG-NE2 3.38Å; E287-H369 WeakPolarHBondContact CG-CE1 3.38Å; E287-H369 IonicContact OE1-CE1 2.81Å; L290-H369 HydrophobicContact CD1-CB 3.78Å; T366-H369 VanDerWaalsContact OG1-CA 3.28Å; T366-H369 WeakPolarHBondContact OG1-CA 3.28Å; T366-H369 WeakPolarHBondContact OG1-CB 3.48Å; T366-H369 PolarHBondContact OG1-N 3.09Å; H369-M371 PolarHBondContact O-N 3.3Å
370	G	83	Confident	88.2	Confident	42 Å²	42	37.5 Å²	37.5	43%	0.433	22%	0.217	S	C	.	.			trans	76.6	-117.7	-176.1	0	0	0	0	0	112.8	T366	T366-G370 PolarHBondContact N-O 3.37Å; T366-G370 VanDerWaalsContact OG1-C 3.29Å; T366-G370 PolarHBondContact OG1-N 3.49Å; T366-G370 PolarHBondContact OG1-O 3.15Å
371	M	85.5	Confident	88.1	Confident	90 Å²	90	40.4 Å²	40.4	44%	0.443	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	134.7	-171.1	-59.8	-74.4	-180	0	0	111.7	C337 R363 L364 K365 H369	C337-M371 HydrophobicContact CB-SD 4.11Å; R363-M371 HydrophobicContact CB-CB 4.48Å; L364-M371 CarbonylContact O-C 3.55Å; L364-M371 WeakPolarHBondContact O-CA 3.26Å; K365-M371 HydrophobicContact CB-SD 4.28Å; K365-M371 HydrophobicContact CG-CE 3.68Å; K365-M371 HydrophobicContact CG-SD 3.54Å; K365-M371 VanDerWaalsContact CG-SD 3.54Å; H369-M371 PolarHBondContact O-N 3.3Å
372	V	87.5	Confident	88.1	Confident	18 Å²	18	39.4 Å²	39.4	11%	0.109	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	137.4	-177.6	175.3	0	0	0	0	111.1	L290 V319 R363 L364 T366 V374 L398	L290-V372 HydrophobicContact CD1-CG2 4.18Å; L290-V372 HydrophobicContact CD2-CB 4.45Å; L290-V372 HydrophobicContact CD2-CG1 3.92Å; L290-V372 HydrophobicContact CD2-CG2 3.6Å; V319-V372 HydrophobicContact CG1-CG1 4.31Å; R363-V372 CarbonylContact C-O 3.56Å; R363-V372 VanDerWaalsContact CA-O 3.3Å; R363-V372 WeakPolarHBondContact CA-O 3.36Å; L364-V372 PolarHBondContact N-O 3.37Å; L364-V372 PolarHBondContact O-N 2.9Å; T366-V372 HydrophobicContact CG2-CB 4.15Å; T366-V372 HydrophobicContact CG2-CG2 3.44Å; T366-V372 VanDerWaalsContact CG2-CG2 3.44Å; V372-V374 HydrophobicContact CG1-CG1 4.41Å; V372-L398 HydrophobicContact CG1-CD2 3.62Å
373	F	88.3	Confident	87.9	Confident	24 Å²	24	40.2 Å²	40.2	11%	0.105	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	120.1	-178.7	-85.5	-108.5	0	0	0	111.5	R363 S399 Y401	R363-F373 HydrophobicContact CB-CE2 4.4Å; R363-F373 HydrophobicContact CG-CD1 4.3Å; R363-F373 HydrophobicContact CG-CD2 3.6Å; R363-F373 HydrophobicContact CG-CE1 3.86Å; R363-F373 HydrophobicContact CG-CE2 2.96Å; R363-F373 HydrophobicContact CG-CG 4.2Å; R363-F373 HydrophobicContact CG-CZ 3.15Å; F373-S399 WeakPolarHBondContact CB-OG 3.38Å; F373-S399 PolarHBondContact O-N 3.28Å; F373-S399 PolarHBondContact O-OG 3.47Å; F373-S399 VanDerWaalsContact O-OG 3.06Å; F373-Y401 HydrophobicContact CB-CD2 4.21Å; F373-Y401 HydrophobicContact CD1-CD1 4.15Å; F373-Y401 HydrophobicContact CD1-CD2 4.34Å; F373-Y401 HydrophobicContact CD1-CE1 4.01Å; F373-Y401 HydrophobicContact CD1-CE2 4.32Å; F373-Y401 HydrophobicContact CD1-CG 4.34Å; F373-Y401 HydrophobicContact CD2-CD1 4.29Å; F373-Y401 AromaticContact CD2-CD2 3.18Å; F373-Y401 HydrophobicContact CD2-CD2 3.18Å; F373-Y401 AromaticContact CD2-CE1 3.98Å; F373-Y401 HydrophobicContact CD2-CE1 3.98Å; F373-Y401 AromaticContact CD2-CE2 2.87Å; F373-Y401 HydrophobicContact CD2-CE2 2.87Å; F373-Y401 AromaticContact CD2-CG 3.96Å; F373-Y401 HydrophobicContact CD2-CG 3.96Å; F373-Y401 AromaticContact CD2-CZ 3.33Å; F373-Y401 HydrophobicContact CE1-CD1 4.1Å; F373-Y401 AromaticContact CE1-CE1 3.52Å; F373-Y401 HydrophobicContact CE1-CE1 3.52Å; F373-Y401 HydrophobicContact CE1-CE2 4.23Å; F373-Y401 AromaticContact CE1-CZ 3.66Å; F373-Y401 HydrophobicContact CE2-CD1 4.31Å; F373-Y401 AromaticContact CE2-CD2 3.62Å; F373-Y401 HydrophobicContact CE2-CD2 3.62Å; F373-Y401 AromaticContact CE2-CE1 3.55Å; F373-Y401 HydrophobicContact CE2-CE1 3.55Å; F373-Y401 AromaticContact CE2-CE2 2.79Å; F373-Y401 HydrophobicContact CE2-CE2 2.79Å; F373-Y401 HydrophobicContact CE2-CG 4.34Å; F373-Y401 AromaticContact CE2-CZ 2.75Å; F373-Y401 WeakPolarHBondContact CE2-OH 3.24Å; F373-Y401 HydrophobicContact CG-CD1 4.23Å; F373-Y401 AromaticContact CG-CD2 3.62Å; F373-Y401 HydrophobicContact CG-CD2 3.62Å; F373-Y401 HydrophobicContact CG-CE1 4.2Å; F373-Y401 AromaticContact CG-CE2 3.71Å; F373-Y401 HydrophobicContact CG-CE2 3.71Å; F373-Y401 AromaticContact CG-CG 3.98Å; F373-Y401 HydrophobicContact CG-CG 3.98Å; F373-Y401 HydrophobicContact CZ-CD1 4.18Å; F373-Y401 HydrophobicContact CZ-CD2 4.31Å; F373-Y401 AromaticContact CZ-CE1 3.27Å; F373-Y401 HydrophobicContact CZ-CE1 3.27Å; F373-Y401 AromaticContact CZ-CE2 3.53Å; F373-Y401 HydrophobicContact CZ-CE2 3.53Å; F373-Y401 AromaticContact CZ-CZ 2.92Å; F373-Y401 WeakPolarHBondContact CZ-OH 3.42Å
374	V	90.5	Very high	87.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	140.1	179.3	-60.7	0	0	0	0	110.9	S361 Y362 L364 V372 L398	S361-V374 VanDerWaalsContact CA-O 3.3Å; S361-V374 WeakPolarHBondContact CA-O 3.24Å; Y362-V374 HydrophobicContact CD2-CG2 3.87Å; Y362-V374 HydrophobicContact CE2-CG2 3.7Å; Y362-V374 PolarHBondContact N-O 2.9Å; Y362-V374 WeakPolarHBondContact O-CG2 2.99Å; Y362-V374 PolarHBondContact O-N 3.47Å; L364-V374 HydrophobicContact CD1-CB 4.44Å; L364-V374 HydrophobicContact CD1-CG1 3.79Å; L364-V374 HydrophobicContact CD1-CG2 3.89Å; L364-V374 HydrophobicContact CG-CG1 4.19Å; L364-V374 HydrophobicContact CG-CG2 3.72Å; V372-V374 HydrophobicContact CG1-CG1 4.41Å; V374-L398 HydrophobicContact CG1-CD2 4.1Å
375	S	91.5	Very high	88	Confident	39 Å²	39	52.4 Å²	52.4	27%	0.273	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	121.8	160.4	-176.1	0	0	0	0	107.7	H396 S397	S375-H396 CarbonylContact O-C 3.54Å; S375-H396 WeakPolarHBondContact O-CA 2.85Å; S375-S397 PolarHBondContact N-O 2.91Å; S375-S397 PolarHBondContact O-N 3.35Å
376	A	92.9	Very high	88.1	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	130.9	-177.7	0	0	0	0	0	110.8	S359 C360 Y362 V394 K395	S359-A376 WeakPolarHBondContact CA-O 3.39Å; C360-A376 PolarHBondContact N-O 3.19Å; C360-A376 PolarHBondContact O-N 2.89Å; Y362-A376 HydrophobicContact CD1-CB 4.48Å; Y362-A376 HydrophobicContact CE1-CB 3.44Å; Y362-A376 VanDerWaalsContact CE1-CB 3.44Å; Y362-A376 WeakPolarHBondContact OH-CB 3.46Å; A376-V394 HydrophobicContact CB-CG1 3.96Å; A376-K395 CarbonylContact C-O 3.47Å; A376-K395 WeakPolarHBondContact CA-O 3.34Å
377	V	94.5	Very high	88.1	Confident	46 Å²	46	60.6 Å²	60.6	28%	0.279	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	112.6	170.9	-174	0	0	0	0	108.4	C357 K395	C357-V377 HydrophobicContact CB-CG1 4.12Å; V377-K395 HydrophobicContact CB-CB 4.48Å; V377-K395 PolarHBondContact N-O 3.5Å; V377-K395 PolarHBondContact O-N 3.17Å
378	W	94.9	Very high	88.5	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	137.2	179.1	-66.6	70.8	0	0	0	110.1	L303 Y332 A347 H348 V351 C357 H358 Y362 V394	L303-W378 HydrophobicContact CD1-CH2 3.74Å; L303-W378 HydrophobicContact CD1-CZ3 3.59Å; Y332-W378 AromaticContact CD1-CH2 3.69Å; Y332-W378 HydrophobicContact CD1-CH2 3.69Å; Y332-W378 HydrophobicContact CD1-CZ2 4.04Å; Y332-W378 AromaticContact CE1-CH2 3.77Å; Y332-W378 HydrophobicContact CE1-CH2 3.77Å; Y332-W378 AromaticContact CE1-CZ2 3.62Å; Y332-W378 HydrophobicContact CE1-CZ2 3.62Å; A347-W378 HydrophobicContact CB-CD2 4.19Å; A347-W378 HydrophobicContact CB-CG 3.97Å; H348-W378 HydrophobicContact CB-CE3 4.24Å; H348-W378 HydrophobicContact CB-CH2 4.36Å; H348-W378 HydrophobicContact CB-CZ3 3.84Å; V351-W378 HydrophobicContact CG2-CB 3.68Å; C357-W378 CarbonylContact C-O 3.59Å; C357-W378 WeakPolarHBondContact CA-O 3.27Å; C357-W378 WeakPolarHBondContact CB-O 3.41Å; H358-W378 HydrophobicContact CB-CB 4.45Å; H358-W378 PolarHBondContact N-O 2.79Å; H358-W378 PolarHBondContact O-N 2.85Å; Y362-W378 AromaticContact CE1-NE1 3.91Å; W378-V394 HydrophobicContact CD2-CB 4.46Å; W378-V394 HydrophobicContact CD2-CG1 4.03Å; W378-V394 HydrophobicContact CD2-CG2 3.63Å; W378-V394 HydrophobicContact CE3-CG2 3.48Å; W378-V394 VanDerWaalsContact CE3-CG2 3.48Å; W378-V394 HydrophobicContact CG-CG1 4.21Å; W378-V394 HydrophobicContact CG-CG2 4.32Å; W378-V394 HydrophobicContact CH2-CG2 3.9Å; W378-V394 HydrophobicContact CZ2-CG1 4.18Å; W378-V394 HydrophobicContact CZ2-CG2 4.04Å; W378-V394 HydrophobicContact CZ3-CG2 3.63Å
379	S	93.7	Very high	89.3	Confident	31 Å²	31	58.7 Å²	58.7	22%	0.217	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	149.9	175.5	57	0	0	0	0	110.5	L392 I393	S379-L392 CarbonylContact O-C 3.57Å; S379-L392 WeakPolarHBondContact O-CA 3.47Å; S379-I393 PolarHBondContact N-O 3.38Å; S379-I393 PolarHBondContact O-N 3.46Å; S379-I393 PolarHBondContact OG-O 3.11Å
380	S	93.2	Very high	90.2	Very high	24 Å²	24	59.7 Å²	59.7	17%	0.168	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	135.9	176.5	41.7	0	0	0	0	110	V351	V351-S380 WeakPolarHBondContact O-CB 3.3Å; V351-S380 PolarHBondContact O-OG 3.39Å
381	F	91.5	Very high	90.6	Very high	74 Å²	74	59.8 Å²	59.8	33%	0.325	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	113.1	170.1	-177.5	-95.3	0	0	0	109.6	Q390 Y391 I393	F381-Q390 HydrophobicContact CD1-CB 4.36Å; F381-Q390 PolarHBondContact O-N 3.27Å; F381-Y391 HydrophobicContact CB-CD1 4.4Å; F381-Y391 HydrophobicContact CB-CD2 3.81Å; F381-Y391 HydrophobicContact CB-CE1 4.08Å; F381-Y391 HydrophobicContact CB-CE2 3.47Å; F381-Y391 VanDerWaalsContact CB-CE2 3.47Å; F381-Y391 HydrophobicContact CB-CG 4.26Å; F381-Y391 AromaticContact CD1-CD1 3.96Å; F381-Y391 HydrophobicContact CD1-CD1 3.96Å; F381-Y391 AromaticContact CD1-CE1 3.21Å; F381-Y391 HydrophobicContact CD1-CE1 3.21Å; F381-Y391 HydrophobicContact CD1-CE2 4.1Å; F381-Y391 AromaticContact CD1-CZ 3.29Å; F381-Y391 WeakPolarHBondContact CD1-OH 3.3Å; F381-Y391 AromaticContact CE1-CE1 3.78Å; F381-Y391 HydrophobicContact CE1-CE1 3.78Å; F381-Y391 AromaticContact CE1-CZ 3.93Å; F381-Y391 HydrophobicContact CG-CD2 4.49Å; F381-Y391 AromaticContact CG-CE1 3.79Å; F381-Y391 HydrophobicContact CG-CE1 3.79Å; F381-Y391 AromaticContact CG-CE2 3.79Å; F381-Y391 HydrophobicContact CG-CE2 3.79Å; F381-Y391 AromaticContact CG-CZ 3.36Å; F381-Y391 WeakPolarHBondContact CG-OH 3.36Å; F381-Y391 PolarHBondContact N-O 2.85Å; F381-I393 HydrophobicContact CB-CD1 4.47Å
382	T	89.7	Confident	91	Very high	49 Å²	49	55.5 Å²	55.5	30%	0.301	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	126.8	174.7	-58.3	0	0	0	0	109.5	K387	T382-K387 VanDerWaalsContact CG2-C 3.43Å; T382-K387 WeakPolarHBondContact CG2-O 3.43Å
383	N	89.4	Confident	91.3	Very high	19 Å²	19	56.6 Å²	56.6	10%	0.102	29%	0.287	C	S	.	.			trans	-64.9	127.1	176.6	174.3	-44.8	0	0	0	110	W385 T386 K387 N388 Q390	N383-W385 PolarHBondContact O-N 3.14Å; N383-W385 WeakPolarHBondContact OD1-CA 3.28Å; N383-W385 WeakPolarHBondContact OD1-CB 3.33Å; N383-W385 VanDerWaalsContact OD1-CE3 3.3Å; N383-W385 PolarHBondContact OD1-N 3.06Å; N383-T386 WeakPolarHBondContact CB-OG1 3.49Å; N383-T386 PolarHBondContact OD1-N 2.72Å; N383-K387 VanDerWaalsContact O-CA 3.31Å; N383-K387 WeakPolarHBondContact O-CA 3.29Å; N383-K387 PolarHBondContact O-N 2.95Å; N383-N388 PolarHBondContact N-O 3.38Å; N383-Q390 HydrophobicContact CB-CG 3.76Å; N383-Q390 PolarHBondContact ND2-NE2 3.01Å
384	P	90.4	Very high	91.6	Very high	89 Å²	89	55.4 Å²	55.4	58%	0.578	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-21.6	-174.2	25.6	-32.4	0	0	0	113.6
385	W	91.7	Very high	91.8	Very high	217 Å²	217	59.1 Å²	59.1	82%	0.822	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-48.2	177.7	-58.3	-84.8	0	0	0	112.7	N383	N383-W385 PolarHBondContact O-N 3.14Å; N383-W385 WeakPolarHBondContact OD1-CA 3.28Å; N383-W385 WeakPolarHBondContact OD1-CB 3.33Å; N383-W385 VanDerWaalsContact OD1-CE3 3.3Å; N383-W385 PolarHBondContact OD1-N 3.06Å
386	T	92.1	Very high	91.9	Very high	75 Å²	75	57.3 Å²	57.3	46%	0.46	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-14.9	-176.1	65.7	0	0	0	0	113.4	N383 N388	N383-T386 WeakPolarHBondContact CB-OG1 3.49Å; N383-T386 PolarHBondContact OD1-N 2.72Å; T386-N388 PolarHBondContact O-N 3.34Å; T386-N388 VanDerWaalsContact O-N 3.09Å; T386-N388 PolarHBondContact OG1-N 3.13Å
387	K	86.2	Confident	91.7	Very high	173 Å²	173	58.5 Å²	58.5	75%	0.752	29%	0.294	S	S	*	.			trans	58.4	12.9	-173.7	-56.4	-177.5	179.8	179.1	0	114.6	T382 N383	T382-K387 VanDerWaalsContact CG2-C 3.43Å; T382-K387 WeakPolarHBondContact CG2-O 3.43Å; N383-K387 VanDerWaalsContact O-CA 3.31Å; N383-K387 WeakPolarHBondContact O-CA 3.29Å; N383-K387 PolarHBondContact O-N 2.95Å
388	N	88.9	Confident	91.3	Very high	109 Å²	109	57.4 Å²	57.4	58%	0.583	29%	0.286	S	S	*	.	S	Bend	trans	-97.1	143.1	176.7	-68.2	-30.5	0	0	0	110.7	N383 T386 Q390	N383-N388 PolarHBondContact N-O 3.38Å; T386-N388 PolarHBondContact O-N 3.34Å; T386-N388 VanDerWaalsContact O-N 3.09Å; T386-N388 PolarHBondContact OG1-N 3.13Å; N388-Q390 PolarHBondContact O-N 2.87Å
389	V	89	Confident	90.4	Very high	46 Å²	46	59.5 Å²	59.5	28%	0.279	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	118.5	170.8	-178.8	0	0	0	0	108.2	V305 L352 L392	V305-V389 HydrophobicContact CG2-CG1 4.17Å; L352-V389 HydrophobicContact CD2-CG1 4.25Å; V389-L392 HydrophobicContact CG1-CD2 4.41Å
390	Q	89	Confident	88.9	Confident	88 Å²	88	66.4 Å²	66.4	41%	0.411	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	-43	179.5	-74.1	-171.5	-34	0	0	112.1	F381 N383 N388	F381-Q390 HydrophobicContact CD1-CB 4.36Å; F381-Q390 PolarHBondContact O-N 3.27Å; N383-Q390 HydrophobicContact CB-CG 3.76Å; N383-Q390 PolarHBondContact ND2-NE2 3.01Å; N388-Q390 PolarHBondContact O-N 2.87Å
391	Y	92.6	Very high	87	Confident	44 Å²	44	70.5 Å²	70.5	17%	0.173	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	162.8	-178.2	55.5	-91.6	0	0	0	110.3	L303 F381 I393	L303-Y391 CarbonylContact O-C 3.5Å; L303-Y391 VanDerWaalsContact O-CA 3.27Å; L303-Y391 WeakPolarHBondContact O-CA 3.44Å; L303-Y391 VanDerWaalsContact O-CB 3.27Å; L303-Y391 WeakPolarHBondContact O-CB 3.34Å; F381-Y391 HydrophobicContact CB-CD1 4.4Å; F381-Y391 HydrophobicContact CB-CD2 3.81Å; F381-Y391 HydrophobicContact CB-CE1 4.08Å; F381-Y391 HydrophobicContact CB-CE2 3.47Å; F381-Y391 VanDerWaalsContact CB-CE2 3.47Å; F381-Y391 HydrophobicContact CB-CG 4.26Å; F381-Y391 AromaticContact CD1-CD1 3.96Å; F381-Y391 HydrophobicContact CD1-CD1 3.96Å; F381-Y391 AromaticContact CD1-CE1 3.21Å; F381-Y391 HydrophobicContact CD1-CE1 3.21Å; F381-Y391 HydrophobicContact CD1-CE2 4.1Å; F381-Y391 AromaticContact CD1-CZ 3.29Å; F381-Y391 WeakPolarHBondContact CD1-OH 3.3Å; F381-Y391 AromaticContact CE1-CE1 3.78Å; F381-Y391 HydrophobicContact CE1-CE1 3.78Å; F381-Y391 AromaticContact CE1-CZ 3.93Å; F381-Y391 HydrophobicContact CG-CD2 4.49Å; F381-Y391 AromaticContact CG-CE1 3.79Å; F381-Y391 HydrophobicContact CG-CE1 3.79Å; F381-Y391 AromaticContact CG-CE2 3.79Å; F381-Y391 HydrophobicContact CG-CE2 3.79Å; F381-Y391 AromaticContact CG-CZ 3.36Å; F381-Y391 WeakPolarHBondContact CG-OH 3.36Å; F381-Y391 PolarHBondContact N-O 2.85Å; Y391-I393 HydrophobicContact CD2-CD1 4.45Å; Y391-I393 HydrophobicContact CD2-CG1 3.8Å; Y391-I393 HydrophobicContact CE2-CD1 3.81Å; Y391-I393 HydrophobicContact CE2-CG1 3.64Å
392	L	93.4	Very high	84.5	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	146.1	171.7	-57.7	170.5	0	0	0	108.8	R302 L303 H348 V351 L352 S379 V389	R302-L392 CarbonylContact C-O 3.55Å; R302-L392 VanDerWaalsContact CA-O 3.3Å; R302-L392 WeakPolarHBondContact CA-O 3.39Å; L303-L392 HydrophobicContact CB-CB 4.24Å; L303-L392 PolarHBondContact N-O 3.37Å; L303-L392 PolarHBondContact O-N 3.06Å; H348-L392 WeakPolarHBondContact CD2-CD1 3.47Å; H348-L392 VanDerWaalsContact NE2-CD1 3.27Å; H348-L392 WeakPolarHBondContact NE2-CD1 3.37Å; V351-L392 HydrophobicContact CG1-CD2 3.85Å; L352-L392 HydrophobicContact CD2-CD1 4.45Å; L352-L392 HydrophobicContact CD2-CD2 3.97Å; S379-L392 CarbonylContact O-C 3.57Å; S379-L392 WeakPolarHBondContact O-CA 3.47Å; V389-L392 HydrophobicContact CG1-CD2 4.41Å
393	I	94.1	Very high	82.1	Confident	41 Å²	41	77.9 Å²	77.9	21%	0.21	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	122.1	174.8	-52.9	173.6	0	0	0	106.9	I300 S379 F381 Y391	I300-I393 HydrophobicContact CG2-CG2 3.47Å; I300-I393 VanDerWaalsContact CG2-CG2 3.47Å; S379-I393 PolarHBondContact N-O 3.38Å; S379-I393 PolarHBondContact O-N 3.46Å; S379-I393 PolarHBondContact OG-O 3.11Å; F381-I393 HydrophobicContact CB-CD1 4.47Å; Y391-I393 HydrophobicContact CD2-CD1 4.45Å; Y391-I393 HydrophobicContact CD2-CG1 3.8Å; Y391-I393 HydrophobicContact CE2-CD1 3.81Å; Y391-I393 HydrophobicContact CE2-CG1 3.64Å
394	V	94.7	Very high	79.5	Confident	0 Å²	0	81 Å²	81	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	115.8	174.1	-165.8	0	0	0	0	107.7	I300 V301 L303 A376 W378 H396	I300-V394 WeakPolarHBondContact CA-O 3.31Å; V301-V394 PolarHBondContact N-O 2.76Å; V301-V394 PolarHBondContact O-N 2.93Å; L303-V394 HydrophobicContact CD1-CG2 3.66Å; L303-V394 HydrophobicContact CG-CG2 4.21Å; A376-V394 HydrophobicContact CB-CG1 3.96Å; W378-V394 HydrophobicContact CD2-CB 4.46Å; W378-V394 HydrophobicContact CD2-CG1 4.03Å; W378-V394 HydrophobicContact CD2-CG2 3.63Å; W378-V394 HydrophobicContact CE3-CG2 3.48Å; W378-V394 VanDerWaalsContact CE3-CG2 3.48Å; W378-V394 HydrophobicContact CG-CG1 4.21Å; W378-V394 HydrophobicContact CG-CG2 4.32Å; W378-V394 HydrophobicContact CH2-CG2 3.9Å; W378-V394 HydrophobicContact CZ2-CG1 4.18Å; W378-V394 HydrophobicContact CZ2-CG2 4.04Å; W378-V394 HydrophobicContact CZ3-CG2 3.63Å; V394-H396 WeakPolarHBondContact CG1-CE1 3.43Å; V394-H396 WeakPolarHBondContact CG1-NE2 3.3Å
395	K	94.6	Very high	76.9	Confident	78 Å²	78	87.6 Å²	87.6	34%	0.339	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	119.3	174	-176.3	-177.1	-177.6	-166.8	0	108.5	E298 I300 A376 V377	E298-K395 WeakPolarHBondContact OE1-CE 3.43Å; E298-K395 IonicContact OE1-NZ 3.44Å; E298-K395 PolarHBondContact OE1-NZ 2.85Å; E298-K395 WeakPolarHBondContact OE2-CE 3.29Å; E298-K395 IonicContact OE2-NZ 2.79Å; E298-K395 PolarHBondContact OE2-NZ 2.81Å; I300-K395 HydrophobicContact CG1-CG 4.42Å; A376-K395 CarbonylContact C-O 3.47Å; A376-K395 WeakPolarHBondContact CA-O 3.34Å; V377-K395 HydrophobicContact CB-CB 4.48Å; V377-K395 PolarHBondContact N-O 3.5Å; V377-K395 PolarHBondContact O-N 3.17Å
396	H	92.8	Very high	74.2	Confident	0 Å²	0	85.5 Å²	85.5	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	136.2	178.4	-62.5	91.3	0	0	0	110.2	E298 F299 Y332 Y362 S375 V394	E298-H396 CarbonylContact C-O 3.5Å; E298-H396 WeakPolarHBondContact CA-O 3.38Å; F299-H396 HydrophobicContact CD1-CB 3.92Å; F299-H396 HydrophobicContact CD2-CB 3.86Å; F299-H396 AromaticContact CD2-ND1 3.78Å; F299-H396 HydrophobicContact CE1-CB 3.51Å; F299-H396 HydrophobicContact CE2-CB 3.46Å; F299-H396 VanDerWaalsContact CE2-CB 3.46Å; F299-H396 AromaticContact CE2-CG 3.43Å; F299-H396 VanDerWaalsContact CE2-CG 3.43Å; F299-H396 AromaticContact CE2-ND1 3.35Å; F299-H396 VanDerWaalsContact CE2-ND1 3.35Å; F299-H396 WeakPolarHBondContact CE2-ND1 2.81Å; F299-H396 HydrophobicContact CG-CB 4.09Å; F299-H396 HydrophobicContact CZ-CB 3.28Å; F299-H396 AromaticContact CZ-CG 3.58Å; F299-H396 PolarHBondContact N-O 2.88Å; F299-H396 PolarHBondContact O-N 3.25Å; Y332-H396 AromaticContact CZ-CE1 3.95Å; Y332-H396 AromaticContact CZ-NE2 3.73Å; Y332-H396 PolarHBondContact OH-CE1 3.12Å; Y332-H396 VanDerWaalsContact OH-CE1 3.27Å; Y332-H396 PolarHBondContact OH-NE2 3.03Å; Y362-H396 AromaticContact CZ-NE2 3.98Å; Y362-H396 PolarHBondContact OH-NE2 2.92Å; S375-H396 CarbonylContact O-C 3.54Å; S375-H396 WeakPolarHBondContact O-CA 2.85Å; V394-H396 WeakPolarHBondContact CG1-CE1 3.43Å; V394-H396 WeakPolarHBondContact CG1-NE2 3.3Å
397	S	90.2	Very high	71.4	Confident	25 Å²	25	87 Å²	87	18%	0.175	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130.4	170	-47.4	0	0	0	0	108.1	E298 S375 S399	E298-S397 PolarHBondContact OE1-OG 2.59Å; E298-S397 VanDerWaalsContact OE1-OG 3.09Å; S375-S397 PolarHBondContact N-O 2.91Å; S375-S397 PolarHBondContact O-N 3.35Å; S397-S399 PolarHBondContact O-N 3.31Å
398	L	86.3	Confident	68.7	Low	23 Å²	23	85.3 Å²	85.3	12%	0.12	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	123	177.4	-68.6	-179.2	0	0	0	110	I289 F297 F299 V319 V372 V374	I289-L398 HydrophobicContact CG2-CD1 3.69Å; F297-L398 HydrophobicContact CB-CD1 3.87Å; F297-L398 HydrophobicContact CB-CG 4.33Å; F297-L398 HydrophobicContact CD1-CD1 3.88Å; F297-L398 HydrophobicContact CD1-CG 4.26Å; F297-L398 HydrophobicContact CG-CD1 4.17Å; F297-L398 PolarHBondContact O-N 3.36Å; F299-L398 HydrophobicContact CE1-CD2 4.49Å; V319-L398 HydrophobicContact CG1-CD2 4.18Å; V319-L398 HydrophobicContact CG2-CD1 4.36Å; V319-L398 HydrophobicContact CG2-CD2 4.16Å; V372-L398 HydrophobicContact CG1-CD2 3.62Å; V374-L398 HydrophobicContact CG1-CD2 4.1Å
399	S	74.4	Confident	66	Low	45 Å²	45	94.6 Å²	94.6	32%	0.315	45%	0.446	S	S	.	.			trans	-102.9	135.3	-178.5	66.5	0	0	0	0	111.3	F373 S397 Y401	F373-S399 WeakPolarHBondContact CB-OG 3.38Å; F373-S399 PolarHBondContact O-N 3.28Å; F373-S399 PolarHBondContact O-OG 3.47Å; F373-S399 VanDerWaalsContact O-OG 3.06Å; S397-S399 PolarHBondContact O-N 3.31Å; S399-Y401 PolarHBondContact O-N 2.94Å
400	R	63.4	Low	64.8	Low	175 Å²	175	97 Å²	97	66%	0.66	45%	0.454	S	S	*	.			trans	-72.3	113.1	171.7	-69.1	-176.9	-178.7	172.4	1.8	108.7	K293 N402	K293-R400 PolarHBondContact O-NH2 2.94Å; R400-N402 PolarHBondContact O-N 3.33Å
401	Y	53.6	Low	63.6	Low	111 Å²	111	97.5 Å²	97.5	44%	0.435	46%	0.457	S	S	.	.			trans	-50	119.5	173	-121.3	-59.6	0	0	0	111.5	F373 S399	F373-Y401 HydrophobicContact CB-CD2 4.21Å; F373-Y401 HydrophobicContact CD1-CD1 4.15Å; F373-Y401 HydrophobicContact CD1-CD2 4.34Å; F373-Y401 HydrophobicContact CD1-CE1 4.01Å; F373-Y401 HydrophobicContact CD1-CE2 4.32Å; F373-Y401 HydrophobicContact CD1-CG 4.34Å; F373-Y401 HydrophobicContact CD2-CD1 4.29Å; F373-Y401 AromaticContact CD2-CD2 3.18Å; F373-Y401 HydrophobicContact CD2-CD2 3.18Å; F373-Y401 AromaticContact CD2-CE1 3.98Å; F373-Y401 HydrophobicContact CD2-CE1 3.98Å; F373-Y401 AromaticContact CD2-CE2 2.87Å; F373-Y401 HydrophobicContact CD2-CE2 2.87Å; F373-Y401 AromaticContact CD2-CG 3.96Å; F373-Y401 HydrophobicContact CD2-CG 3.96Å; F373-Y401 AromaticContact CD2-CZ 3.33Å; F373-Y401 HydrophobicContact CE1-CD1 4.1Å; F373-Y401 AromaticContact CE1-CE1 3.52Å; F373-Y401 HydrophobicContact CE1-CE1 3.52Å; F373-Y401 HydrophobicContact CE1-CE2 4.23Å; F373-Y401 AromaticContact CE1-CZ 3.66Å; F373-Y401 HydrophobicContact CE2-CD1 4.31Å; F373-Y401 AromaticContact CE2-CD2 3.62Å; F373-Y401 HydrophobicContact CE2-CD2 3.62Å; F373-Y401 AromaticContact CE2-CE1 3.55Å; F373-Y401 HydrophobicContact CE2-CE1 3.55Å; F373-Y401 AromaticContact CE2-CE2 2.79Å; F373-Y401 HydrophobicContact CE2-CE2 2.79Å; F373-Y401 HydrophobicContact CE2-CG 4.34Å; F373-Y401 AromaticContact CE2-CZ 2.75Å; F373-Y401 WeakPolarHBondContact CE2-OH 3.24Å; F373-Y401 HydrophobicContact CG-CD1 4.23Å; F373-Y401 AromaticContact CG-CD2 3.62Å; F373-Y401 HydrophobicContact CG-CD2 3.62Å; F373-Y401 HydrophobicContact CG-CE1 4.2Å; F373-Y401 AromaticContact CG-CE2 3.71Å; F373-Y401 HydrophobicContact CG-CE2 3.71Å; F373-Y401 AromaticContact CG-CG 3.98Å; F373-Y401 HydrophobicContact CG-CG 3.98Å; F373-Y401 HydrophobicContact CZ-CD1 4.18Å; F373-Y401 HydrophobicContact CZ-CD2 4.31Å; F373-Y401 AromaticContact CZ-CE1 3.27Å; F373-Y401 HydrophobicContact CZ-CE1 3.27Å; F373-Y401 AromaticContact CZ-CE2 3.53Å; F373-Y401 HydrophobicContact CZ-CE2 3.53Å; F373-Y401 AromaticContact CZ-CZ 2.92Å; F373-Y401 WeakPolarHBondContact CZ-OH 3.42Å; S399-Y401 PolarHBondContact O-N 2.94Å
402	N	39.1	Very low	61.9	Low	135 Å²	135	100.4 Å²	100.4	72%	0.722	47%	0.472	S	S	*	.			trans	-93.8	104.6	150.7	-106.9	-11.6	0	0	0	106.3	R400 S404	R400-N402 PolarHBondContact O-N 3.33Å; N402-S404 WeakPolarHBondContact CB-OG 3.35Å; N402-S404 PolarHBondContact O-N 3.12Å
403	N	38.3	Very low	60.1	Low	143 Å²	143	106.4 Å²	106.4	77%	0.765	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	28.4	176.3	-127.3	3.3	0	0	0	112.8
404	S	33.9	Very low	58	Low	83 Å²	83	110.4 Å²	110.4	58%	0.58	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.8	7.6	-166.8	39.4	0	0	0	0	114.7	N402	N402-S404 WeakPolarHBondContact CB-OG 3.35Å; N402-S404 PolarHBondContact O-N 3.12Å
405	R	35.8	Very low	55.5	Low	228 Å²	228	117.8 Å²	117.8	86%	0.86	55%	0.553	S	S	*	*	S	Bend	trans	-118.5	0.9	176.6	-81	-168	179.6	172.3	1.1	117.1
406	Y	36.6	Very low	52.7	Low	174 Å²	174	120.6 Å²	120.6	68%	0.682	57%	0.568	S	S	*	*	S	Bend	trans	-110.6	23.5	175.1	-72.3	-80.5	0	0	0	113.7
407	S	31.8	Very low	49.7	Very low	107 Å²	107	129.9 Å²	129.9	75%	0.748	61%	0.612	S	S	*	*	S	Bend	trans	-103	10.2	175.9	178.8	0	0	0	0	113.9
408	I	30.3	Very low	46.3	Very low	137 Å²	137	138.7 Å²	138.7	70%	0.703	65%	0.648	S	S	*	*			trans	-143.2	88	179	-51.2	176	0	0	0	107.6
409	Y	31.7	Very low	42.6	Very low	303 Å²	303	149.2 Å²	149.2	100%	1.188	70%	0.696	S	S	*	*			trans	173.1	0	134.7	-91.7	-66.2	0	0	0	110

Retrieved 409 of 409 residues in 415 ms (Link to these results)

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