A0A077ZAW4_TRITR Loading...

ATP-grasp 4 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZAW4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 482 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	40.8	Very low	36.1	Very low	240 Å²	240	146.9 Å²	146.9	100%	1.182	86%	0.858	S	S	*	*				0	103.3	0	-70.9	-165	172.1	0	0	109.2
2	P	36.6	Very low	35.7	Very low	120 Å²	120	144.9 Å²	144.9	78%	0.779	84%	0.839	S	S	*	*			trans	-133.2	134.4	179.1	35.6	-18.4	0	0	0	113.1
3	T	38.3	Very low	35.6	Very low	151 Å²	151	142.4 Å²	142.4	93%	0.926	83%	0.826	S	S	*	*			trans	-146.1	106.4	153.1	37.9	0	0	0	0	110.9
4	R	36.7	Very low	35.3	Very low	252 Å²	252	142.2 Å²	142.2	95%	0.951	82%	0.821	S	S	*	*			trans	-70	134.7	166.4	-75.1	170.7	161.2	174.9	-6.5	109.4
5	S	40.9	Very low	35.3	Very low	119 Å²	119	138.4 Å²	138.4	83%	0.832	81%	0.813	S	S	*	*			trans	-107.7	100	158.6	60.3	0	0	0	0	108.8
6	G	35.3	Very low	35.4	Very low	76 Å²	76	135.9 Å²	135.9	78%	0.784	81%	0.805	S	S	*	*			trans	-83	119.4	172.6	0	0	0	0	0	110.5	S8	G6-S8 PolarHBondContact O-N 3.41Å
7	T	35.9	Very low	35.4	Very low	136 Å²	136	136.4 Å²	136.4	83%	0.834	81%	0.81	S	S	*	*			trans	-80.7	107.7	164.8	47.1	0	0	0	0	108.5	S9	T7-S9 PolarHBondContact O-N 3.49Å
8	S	32.1	Very low	35.4	Very low	116 Å²	116	137.9 Å²	137.9	81%	0.811	81%	0.807	S	S	*	*			trans	-77.1	111.4	171.4	55.9	0	0	0	0	109.9	G6	G6-S8 PolarHBondContact O-N 3.41Å
9	S	32.1	Very low	35.7	Very low	100 Å²	100	136.6 Å²	136.6	70%	0.699	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-66.3	141.9	166.6	-59.7	0	0	0	0	110.1	T7 H11	T7-S9 PolarHBondContact O-N 3.49Å; S9-H11 PolarHBondContact O-N 3.46Å
10	P	33.6	Very low	36.3	Very low	117 Å²	117	139.5 Å²	139.5	76%	0.76	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-68.1	127.6	175.4	28	-32.6	0	0	0	110	I12	P10-I12 PolarHBondContact O-N 3Å
11	H	34.5	Very low	36.6	Very low	189 Å²	189	141.7 Å²	141.7	88%	0.875	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-56.9	116.9	175.4	-81.7	-78.8	0	0	0	111	S9 V13	S9-H11 PolarHBondContact O-N 3.46Å; H11-V13 PolarHBondContact O-N 3.3Å
12	I	31.6	Very low	37.1	Very low	123 Å²	123	133.5 Å²	133.5	63%	0.631	78%	0.776	S	S	*	*			trans	-85.7	107.2	169.2	-61.8	174.5	0	0	0	107.2	P10 N14	P10-I12 PolarHBondContact O-N 3Å; I12-N14 PolarHBondContact O-N 3.45Å
13	V	33.8	Very low	38.1	Very low	112 Å²	112	131 Å²	131	68%	0.679	76%	0.761	S	S	*	*			trans	-79.8	105.7	165.9	-178.5	0	0	0	0	107.2	H11 A15	H11-V13 PolarHBondContact O-N 3.3Å; V13-A15 PolarHBondContact O-N 3.06Å
14	N	31.7	Very low	39.3	Very low	140 Å²	140	132.2 Å²	132.2	75%	0.749	75%	0.753	S	S	*	*			trans	-65.1	114.6	169.4	-81.7	-29.7	0	0	0	108.6	I12 S16	I12-N14 PolarHBondContact O-N 3.45Å; N14-S16 VanDerWaalsContact C-N 3.34Å; N14-S16 PolarHBondContact O-N 3.5Å
15	A	35.2	Very low	40.6	Very low	85 Å²	85	126 Å²	126	70%	0.702	74%	0.739	S	S	*	*			trans	-75.6	89.8	169.6	0	0	0	0	0	108.7	V13	V13-A15 PolarHBondContact O-N 3.06Å
16	S	36.8	Very low	42	Very low	99 Å²	99	124.8 Å²	124.8	69%	0.692	72%	0.717	S	S	*	*			trans	-66.5	144.1	160.3	46.4	0	0	0	0	109.7	N14 E18	N14-S16 VanDerWaalsContact C-N 3.34Å; N14-S16 PolarHBondContact O-N 3.5Å; S16-E18 PolarHBondContact O-N 2.89Å
17	T	35.2	Very low	44	Very low	144 Å²	144	123.9 Å²	123.9	88%	0.883	69%	0.692	S	S	*	*	S	Bend	trans	-58.4	89.7	-179.1	39.2	0	0	0	0	112.9
18	E	36.6	Very low	45.9	Very low	163 Å²	163	121 Å²	121	76%	0.762	68%	0.678	S	S	*	*			trans	-139.4	114.4	164.6	-71.7	-169	167.3	0	0	111.7	S16	S16-E18 PolarHBondContact O-N 2.89Å
19	V	41.2	Very low	47.7	Very low	113 Å²	113	120.3 Å²	120.3	69%	0.685	66%	0.664	S	S	*	*			trans	57.7	113.9	148	-164.4	0	0	0	0	118.4	Q21	V19-Q21 PolarHBondContact O-N 3.35Å
20	E	46.9	Very low	50.2	Low	195 Å²	195	116.7 Å²	116.7	91%	0.911	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.7	4.3	-176.1	-104.9	172.6	163.5	0	0	118.1
21	Q	41.7	Very low	52.5	Low	186 Å²	186	111.7 Å²	111.7	87%	0.869	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	1.4	-176.4	-91.7	154.5	-25.5	0	0	115.6	V19	V19-Q21 PolarHBondContact O-N 3.35Å
22	S	51.4	Low	54.8	Low	68 Å²	68	105.9 Å²	105.9	48%	0.476	58%	0.584	S	S	.	*			trans	-100.6	2.7	179.7	73.2	0	0	0	0	116.2	K24 D25 Y26	S22-K24 PolarHBondContact O-N 3.09Å; S22-D25 PolarHBondContact O-N 3.21Å; S22-Y26 PolarHBondContact O-N 3.32Å
23	S	59.2	Low	57.4	Low	68 Å²	68	102.1 Å²	102.1	48%	0.476	57%	0.568	S	S	.	*	H	α-helix	trans	-67.7	-31.9	-163.9	79	0	0	0	0	115.1	Q27	S23-Q27 WeakPolarHBondContact O-CB 3.25Å; S23-Q27 WeakPolarHBondContact O-CG 3.41Å; S23-Q27 PolarHBondContact O-N 3.11Å
24	K	62.4	Low	59.9	Low	175 Å²	175	96.8 Å²	96.8	76%	0.761	54%	0.536	S	S	*	.	H	α-helix	trans	-70.1	-45.1	-179.2	-74.6	-173.3	179.8	177.1	0	112.3	S22 Q27 S28	S22-K24 PolarHBondContact O-N 3.09Å; K24-Q27 PolarHBondContact O-N 2.93Å; K24-S28 WeakPolarHBondContact O-CB 3.34Å; K24-S28 PolarHBondContact O-N 3.25Å
25	D	65.2	Low	62.4	Low	122 Å²	122	96.4 Å²	96.4	65%	0.652	52%	0.524	S	S	*	.	H	α-helix	trans	-67.9	-40.5	180	-68.1	-18.1	0	0	0	110.6	S22 Q27 S28 I29	S22-D25 PolarHBondContact O-N 3.21Å; D25-Q27 PolarHBondContact O-N 3.34Å; D25-S28 WeakPolarHBondContact O-CB 3.26Å; D25-S28 PolarHBondContact O-N 2.99Å; D25-I29 VanDerWaalsContact O-CG1 3.29Å; D25-I29 WeakPolarHBondContact O-CG1 3.43Å; D25-I29 PolarHBondContact O-N 2.78Å
26	Y	69.9	Low	64.9	Low	93 Å²	93	98.3 Å²	98.3	37%	0.365	52%	0.518	S	S	.	.	H	α-helix	trans	-61.3	-46.7	176.3	-169.8	-102.9	0	0	0	112.2	S22 S28 I29 Q30	S22-Y26 PolarHBondContact O-N 3.32Å; Y26-S28 VanDerWaalsContact C-N 3.33Å; Y26-S28 PolarHBondContact O-N 3.27Å; Y26-I29 PolarHBondContact O-N 2.85Å; Y26-Q30 HydrophobicContact CD1-CG 4.29Å; Y26-Q30 HydrophobicContact CE1-CG 4.04Å; Y26-Q30 VanDerWaalsContact CZ-NE2 3.29Å; Y26-Q30 WeakPolarHBondContact O-CG 3.05Å; Y26-Q30 PolarHBondContact O-N 3.29Å; Y26-Q30 PolarHBondContact OH-NE2 2.91Å; Y26-Q30 VanDerWaalsContact OH-NE2 3.14Å
27	Q	76.4	Confident	67.1	Low	57 Å²	57	95.8 Å²	95.8	27%	0.266	50%	0.496	S	S	.	.	H	α-helix	trans	-63	-39.1	176	-76.5	-179.5	-6.1	0	0	112.2	S23 K24 D25 Q30 L31 L94 I95	S23-Q27 WeakPolarHBondContact O-CB 3.25Å; S23-Q27 WeakPolarHBondContact O-CG 3.41Å; S23-Q27 PolarHBondContact O-N 3.11Å; K24-Q27 PolarHBondContact O-N 2.93Å; D25-Q27 PolarHBondContact O-N 3.34Å; Q27-Q30 PolarHBondContact O-N 3.21Å; Q27-L31 WeakPolarHBondContact O-CB 3.35Å; Q27-L31 VanDerWaalsContact O-CG 3.27Å; Q27-L31 WeakPolarHBondContact O-CG 3.45Å; Q27-L31 PolarHBondContact O-N 2.91Å; Q27-L94 HydrophobicContact CG-CD1 4.39Å; Q27-I95 PolarHBondContact NE2-O 3.05Å
28	S	75.3	Confident	69.4	Low	76 Å²	76	89.3 Å²	89.3	53%	0.531	46%	0.458	S	S	.	.	H	α-helix	trans	-60.3	-45.5	176.3	-173.5	0	0	0	0	111.9	K24 D25 Y26 L31 S32	K24-S28 WeakPolarHBondContact O-CB 3.34Å; K24-S28 PolarHBondContact O-N 3.25Å; D25-S28 WeakPolarHBondContact O-CB 3.26Å; D25-S28 PolarHBondContact O-N 2.99Å; Y26-S28 VanDerWaalsContact C-N 3.33Å; Y26-S28 PolarHBondContact O-N 3.27Å; S28-L31 PolarHBondContact O-N 3.26Å; S28-S32 PolarHBondContact O-N 3.24Å; S28-S32 PolarHBondContact O-OG 2.82Å
29	I	71.1	Confident	71.5	Confident	101 Å²	101	89 Å²	89	52%	0.518	45%	0.454	S	S	.	.	H	α-helix	trans	-63.9	-41.1	176.7	-66.6	164.5	0	0	0	111.4	D25 Y26 S32 S33	D25-I29 VanDerWaalsContact O-CG1 3.29Å; D25-I29 WeakPolarHBondContact O-CG1 3.43Å; D25-I29 PolarHBondContact O-N 2.78Å; Y26-I29 PolarHBondContact O-N 2.85Å; I29-S32 PolarHBondContact O-N 2.85Å; I29-S32 PolarHBondContact O-OG 2.83Å; I29-S33 WeakPolarHBondContact O-CB 3.36Å; I29-S33 PolarHBondContact O-N 2.87Å; I29-S33 PolarHBondContact O-OG 3.14Å
30	Q	83.8	Confident	73.4	Confident	25 Å²	25	89.7 Å²	89.7	12%	0.117	45%	0.449	C	S	.	.	H	α-helix	trans	-68.4	-37.3	177.6	-71.3	-171.7	-38.3	0	0	112.4	Y26 Q27 S33 L34 F93 L94	Y26-Q30 HydrophobicContact CD1-CG 4.29Å; Y26-Q30 HydrophobicContact CE1-CG 4.04Å; Y26-Q30 VanDerWaalsContact CZ-NE2 3.29Å; Y26-Q30 WeakPolarHBondContact O-CG 3.05Å; Y26-Q30 PolarHBondContact O-N 3.29Å; Y26-Q30 PolarHBondContact OH-NE2 2.91Å; Y26-Q30 VanDerWaalsContact OH-NE2 3.14Å; Q27-Q30 PolarHBondContact O-N 3.21Å; Q30-S33 PolarHBondContact O-N 3.44Å; Q30-L34 VanDerWaalsContact O-CB 3.31Å; Q30-L34 WeakPolarHBondContact O-CB 2.97Å; Q30-L34 PolarHBondContact O-N 3.11Å; Q30-F93 PolarHBondContact NE2-O 2.84Å; Q30-L94 HydrophobicContact CB-CD1 3.97Å
31	L	83.1	Confident	74.6	Confident	12 Å²	12	82.8 Å²	82.8	6%	0.063	43%	0.431	C	S	.	.	H	α-helix	trans	-71.1	-33.9	176.6	-74.9	169.8	0	0	0	112.8	Q27 S28 L34 R35 L94 H127 L128 H131	Q27-L31 WeakPolarHBondContact O-CB 3.35Å; Q27-L31 VanDerWaalsContact O-CG 3.27Å; Q27-L31 WeakPolarHBondContact O-CG 3.45Å; Q27-L31 PolarHBondContact O-N 2.91Å; S28-L31 PolarHBondContact O-N 3.26Å; L31-L34 HydrophobicContact CD2-CD2 4.37Å; L31-R35 PolarHBondContact O-N 3.2Å; L31-R35 VanDerWaalsContact O-N 3.12Å; L31-L94 HydrophobicContact CD2-CD2 3.73Å; L31-L94 HydrophobicContact CG-CD2 4.26Å; L31-H127 WeakPolarHBondContact CD1-NE2 3.4Å; L31-L128 HydrophobicContact CD2-CD1 4.05Å; L31-H131 PolarHBondContact O-ND1 3.46Å
32	S	82.1	Confident	76.4	Confident	67 Å²	67	79.8 Å²	79.8	47%	0.469	42%	0.42	S	S	.	.	H	α-helix	trans	-68.1	-43.4	172.4	65.7	0	0	0	0	111	S28 I29 L34 R35 Q36	S28-S32 PolarHBondContact O-N 3.24Å; S28-S32 PolarHBondContact O-OG 2.82Å; I29-S32 PolarHBondContact O-N 2.85Å; I29-S32 PolarHBondContact O-OG 2.83Å; S32-L34 PolarHBondContact O-N 3.12Å; S32-R35 WeakPolarHBondContact O-CB 3.44Å; S32-R35 PolarHBondContact O-N 3.39Å; S32-Q36 PolarHBondContact O-N 2.92Å; S32-Q36 VanDerWaalsContact O-N 3.11Å
33	S	85.4	Confident	78	Confident	43 Å²	43	77.2 Å²	77.2	30%	0.301	40%	0.402	S	S	.	.	H	α-helix	trans	-60.8	-44.2	174.1	-57.6	0	0	0	0	111.7	I29 Q30 R35 Q36 I37	I29-S33 WeakPolarHBondContact O-CB 3.36Å; I29-S33 PolarHBondContact O-N 2.87Å; I29-S33 PolarHBondContact O-OG 3.14Å; Q30-S33 PolarHBondContact O-N 3.44Å; S33-R35 VanDerWaalsContact C-N 3.29Å; S33-R35 PolarHBondContact O-N 2.72Å; S33-Q36 PolarHBondContact O-N 2.96Å; S33-Q36 VanDerWaalsContact O-N 3.14Å; S33-I37 VanDerWaalsContact O-CG1 3.28Å; S33-I37 WeakPolarHBondContact O-CG1 2.99Å; S33-I37 PolarHBondContact O-N 2.73Å
34	L	86.8	Confident	79.5	Confident	0 Å²	0	80.8 Å²	80.8	0%	0	41%	0.406	C	S	.	.	H	α-helix	trans	-56.7	-43.9	175.1	-179.6	63.3	0	0	0	111.7	Q30 L31 S32 Q36 I37 A38 L71 I73 F93 L128 H131 V132	Q30-L34 VanDerWaalsContact O-CB 3.31Å; Q30-L34 WeakPolarHBondContact O-CB 2.97Å; Q30-L34 PolarHBondContact O-N 3.11Å; L31-L34 HydrophobicContact CD2-CD2 4.37Å; S32-L34 PolarHBondContact O-N 3.12Å; L34-Q36 VanDerWaalsContact C-N 3.31Å; L34-Q36 PolarHBondContact O-N 3.39Å; L34-I37 PolarHBondContact O-N 3.35Å; L34-A38 VanDerWaalsContact O-CB 3.24Å; L34-A38 WeakPolarHBondContact O-CB 3.29Å; L34-A38 PolarHBondContact O-N 3.36Å; L34-L71 HydrophobicContact CD1-CD1 3.45Å; L34-L71 VanDerWaalsContact CD1-CD1 3.45Å; L34-I73 HydrophobicContact CD1-CD1 4.23Å; L34-I73 HydrophobicContact CD2-CD1 3.87Å; L34-F93 HydrophobicContact CB-CE1 4.13Å; L34-F93 HydrophobicContact CD1-CE1 4.42Å; L34-L128 HydrophobicContact CD2-CD1 3.46Å; L34-L128 VanDerWaalsContact CD2-CD1 3.46Å; L34-H131 HydrophobicContact CD2-CB 4.33Å; L34-V132 HydrophobicContact CD2-CG1 4.47Å
35	R	85.4	Confident	81	Confident	133 Å²	133	72.5 Å²	72.5	50%	0.502	37%	0.37	S	S	.	.	H	α-helix	trans	-63.9	-37.1	178.7	-171.2	179.5	-175.7	-173.9	0.8	111.9	L31 S32 S33 K39 H131	L31-R35 PolarHBondContact O-N 3.2Å; L31-R35 VanDerWaalsContact O-N 3.12Å; S32-R35 WeakPolarHBondContact O-CB 3.44Å; S32-R35 PolarHBondContact O-N 3.39Å; S33-R35 VanDerWaalsContact C-N 3.29Å; S33-R35 PolarHBondContact O-N 2.72Å; R35-K39 VanDerWaalsContact O-CG 3.26Å; R35-K39 WeakPolarHBondContact O-CG 3.44Å; R35-K39 PolarHBondContact O-N 3.49Å; R35-H131 HydrophobicContact CB-CB 4.21Å
36	Q	85.9	Confident	82.4	Confident	125 Å²	125	66.7 Å²	66.7	58%	0.584	34%	0.339	S	S	*	.	H	α-helix	trans	-67.9	-50.4	175.6	-176.2	173.9	-9.3	0	0	111	S32 S33 L34 A38 K39 E40	S32-Q36 PolarHBondContact O-N 2.92Å; S32-Q36 VanDerWaalsContact O-N 3.11Å; S33-Q36 PolarHBondContact O-N 2.96Å; S33-Q36 VanDerWaalsContact O-N 3.14Å; L34-Q36 VanDerWaalsContact C-N 3.31Å; L34-Q36 PolarHBondContact O-N 3.39Å; Q36-A38 VanDerWaalsContact C-N 3.29Å; Q36-A38 PolarHBondContact O-N 3.29Å; Q36-K39 WeakPolarHBondContact O-CB 3.24Å; Q36-K39 PolarHBondContact O-N 2.84Å; Q36-K39 VanDerWaalsContact O-N 3.09Å; Q36-E40 PolarHBondContact O-N 3.47Å
37	I	84.7	Confident	83.7	Confident	45 Å²	45	62.3 Å²	62.3	23%	0.231	32%	0.321	C	S	.	.	H	α-helix	trans	-61.8	-36.7	-179.9	-63.9	163.4	0	0	0	111.8	S33 L34 S43 L71 F93	S33-I37 VanDerWaalsContact O-CG1 3.28Å; S33-I37 WeakPolarHBondContact O-CG1 2.99Å; S33-I37 PolarHBondContact O-N 2.73Å; L34-I37 PolarHBondContact O-N 3.35Å; I37-S43 WeakPolarHBondContact CG2-OG 3.38Å; I37-S43 WeakPolarHBondContact O-CB 3.15Å; I37-S43 PolarHBondContact O-OG 3.12Å; I37-L71 HydrophobicContact CB-CD1 4.29Å; I37-L71 HydrophobicContact CD1-CD1 4.22Å; I37-L71 HydrophobicContact CG2-CD1 3.77Å; I37-F93 HydrophobicContact CD1-CE2 4.08Å; I37-F93 HydrophobicContact CD1-CZ 3.98Å
38	A	81.9	Confident	84.7	Confident	9 Å²	9	59.6 Å²	59.6	7%	0.074	31%	0.309	C	S	.	.	H	α-helix	trans	-71.1	-31.6	176.5	0	0	0	0	0	113.1	L34 Q36 E40 G41 V132 Q136	L34-A38 VanDerWaalsContact O-CB 3.24Å; L34-A38 WeakPolarHBondContact O-CB 3.29Å; L34-A38 PolarHBondContact O-N 3.36Å; Q36-A38 VanDerWaalsContact C-N 3.29Å; Q36-A38 PolarHBondContact O-N 3.29Å; A38-E40 VanDerWaalsContact C-N 3.31Å; A38-E40 PolarHBondContact O-N 3.11Å; A38-G41 PolarHBondContact O-N 2.79Å; A38-V132 HydrophobicContact CB-CB 4.36Å; A38-V132 HydrophobicContact CB-CG2 4.28Å; A38-Q136 PolarHBondContact O-NE2 3.27Å
39	K	82.2	Confident	85.8	Confident	157 Å²	157	56 Å²	56	68%	0.683	28%	0.283	S	S	*	.	H	α-helix	trans	-69	-27	177	-83.1	177.3	176.9	-171.7	0	113.1	R35 Q36 G41	R35-K39 VanDerWaalsContact O-CG 3.26Å; R35-K39 WeakPolarHBondContact O-CG 3.44Å; R35-K39 PolarHBondContact O-N 3.49Å; Q36-K39 WeakPolarHBondContact O-CB 3.24Å; Q36-K39 PolarHBondContact O-N 2.84Å; Q36-K39 VanDerWaalsContact O-N 3.09Å; K39-G41 PolarHBondContact O-N 2.79Å
40	E	81.7	Confident	87	Confident	126 Å²	126	51.2 Å²	51.2	59%	0.589	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	3	175.2	-67.2	169.9	-172	0	0	112.8	Q36 A38 N42	Q36-E40 PolarHBondContact O-N 3.47Å; A38-E40 VanDerWaalsContact C-N 3.31Å; A38-E40 PolarHBondContact O-N 3.11Å; E40-N42 PolarHBondContact O-N 3.01Å
41	G	71.1	Confident	87.5	Confident	50 Å²	50	50 Å²	50	52%	0.515	25%	0.254	S	S	.	.	S	Bend	trans	80.4	-20.5	161.1	0	0	0	0	0	115.7	A38 K39	A38-G41 PolarHBondContact O-N 2.79Å; K39-G41 PolarHBondContact O-N 2.79Å
42	N	78.9	Confident	87.7	Confident	123 Å²	123	50.5 Å²	50.5	66%	0.658	25%	0.254	S	S	*	.			trans	-99.8	-7.7	-175.2	-70.8	-27.5	0	0	0	114.5	E40 N69	E40-N42 PolarHBondContact O-N 3.01Å; N42-N69 WeakPolarHBondContact O-CB 3.32Å
43	S	85.2	Confident	88	Confident	14 Å²	14	52.7 Å²	52.7	10%	0.098	26%	0.255	C	S	.	.			trans	-90.1	139	-172	-53.8	0	0	0	0	112.7	I37 N69 Q136	I37-S43 WeakPolarHBondContact CG2-OG 3.38Å; I37-S43 WeakPolarHBondContact O-CB 3.15Å; I37-S43 PolarHBondContact O-OG 3.12Å; S43-N69 CarbonylContact C-O 3.59Å; S43-N69 VanDerWaalsContact CA-O 3.25Å; S43-N69 WeakPolarHBondContact CA-O 2.86Å; S43-Q136 PolarHBondContact O-NE2 3.37Å
44	R	91.3	Very high	88.4	Confident	144 Å²	144	52.1 Å²	52.1	54%	0.543	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	159.1	173.5	-60.5	-170.7	179.4	171.4	-6.1	110.4	N69 T70 L71 Q136 Y386	R44-N69 PolarHBondContact N-O 2.82Å; R44-T70 HydrophobicContact CB-CG2 4.45Å; R44-T70 CarbonylContact O-C 3.53Å; R44-T70 VanDerWaalsContact O-CA 3.29Å; R44-T70 WeakPolarHBondContact O-CA 3.28Å; R44-L71 PolarHBondContact O-N 3.29Å; R44-Q136 CarbonylContact C-O 3.56Å; R44-Q136 WeakPolarHBondContact CA-O 3.46Å; R44-Y386 HydrophobicContact CB-CE1 3.84Å; R44-Y386 HydrophobicContact CG-CE1 4.38Å
45	C	93.9	Very high	88.8	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.007	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	123.6	179	-71	0	0	0	0	110.8	L71 I73 V132 Q136 C137 S138 Y386	C45-L71 WeakPolarHBondContact CA-O 3.39Å; C45-I73 HydrophobicContact CB-CD1 4.23Å; C45-V132 HydrophobicContact CB-CG2 4.48Å; C45-Q136 PolarHBondContact N-O 3.37Å; C45-C137 CarbonylContact O-C 3.5Å; C45-C137 WeakPolarHBondContact O-CA 3.37Å; C45-S138 PolarHBondContact O-N 3.01Å; C45-Y386 VanDerWaalsContact C-OH 3.31Å; C45-Y386 PolarHBondContact O-OH 3.37Å
46	L	95.3	Very high	89.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	104.7	166.8	179	66.8	0	0	0	108.7	V48 L62 C66 T70 L71 P72 I73 V140 L382 Y386	L46-V48 HydrophobicContact CD2-CG2 4.12Å; L46-V48 HydrophobicContact CG-CG2 4.08Å; L46-L62 HydrophobicContact CD2-CD1 4.19Å; L46-C66 WeakPolarHBondContact CD2-SG 3.46Å; L46-T70 HydrophobicContact CB-CG2 4.03Å; L46-L71 PolarHBondContact N-O 3.5Å; L46-P72 CarbonylContact O-C 3.42Å; L46-P72 WeakPolarHBondContact O-CA 3.44Å; L46-I73 PolarHBondContact O-N 3.06Å; L46-V140 HydrophobicContact CD1-CB 4.28Å; L46-V140 HydrophobicContact CD1-CG1 3.69Å; L46-V140 HydrophobicContact CD1-CG2 3.58Å; L46-V140 HydrophobicContact CG-CG2 4.23Å; L46-L382 WeakPolarHBondContact CD1-O 3.27Å; L46-L382 WeakPolarHBondContact CD2-O 3.38Å; L46-Y386 HydrophobicContact CB-CD2 4.23Å; L46-Y386 HydrophobicContact CB-CE2 3.6Å; L46-Y386 HydrophobicContact CD1-CD2 4.06Å; L46-Y386 HydrophobicContact CD1-CE2 3.6Å; L46-Y386 HydrophobicContact CG-CE2 4.13Å
47	I	97	Very high	89.4	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	111.6	174.9	-54.8	170.8	0	0	0	108.3	I73 L75 L125 L128 C137 S138 L139 V140	I47-I73 CarbonylContact C-O 3.49Å; I47-I73 WeakPolarHBondContact CA-O 3.44Å; I47-L75 HydrophobicContact CG2-CB 4.47Å; I47-L125 HydrophobicContact CD1-CD1 3.73Å; I47-L128 HydrophobicContact CD1-CD2 3.65Å; I47-L128 HydrophobicContact CG1-CD2 4Å; I47-C137 HydrophobicContact CD1-CB 4.02Å; I47-S138 PolarHBondContact N-O 3.18Å; I47-L139 HydrophobicContact CB-CD1 4.06Å; I47-L139 HydrophobicContact CG2-CD1 3.72Å; I47-L139 WeakPolarHBondContact O-CA 3.43Å; I47-V140 PolarHBondContact O-N 3.4Å
48	V	97.3	Very high	89.8	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	117.9	173.6	-178.1	0	0	0	0	108.7	L46 K50 F55 I73 L74 L75 F92 V140 L382	L46-V48 HydrophobicContact CD2-CG2 4.12Å; L46-V48 HydrophobicContact CG-CG2 4.08Å; V48-K50 HydrophobicContact CG1-CG 4.22Å; V48-F55 HydrophobicContact CG1-CE1 4.06Å; V48-F55 HydrophobicContact CG1-CZ 4.02Å; V48-I73 PolarHBondContact N-O 3.4Å; V48-L74 HydrophobicContact CB-CD1 4.19Å; V48-L74 HydrophobicContact CG1-CD1 4.16Å; V48-L74 WeakPolarHBondContact O-CD1 3.25Å; V48-L75 PolarHBondContact O-N 3.39Å; V48-F92 HydrophobicContact CB-CE1 4.14Å; V48-F92 HydrophobicContact CG2-CE1 3.94Å; V48-V140 HydrophobicContact CB-CG2 4.32Å; V48-V140 HydrophobicContact CG2-CG2 3.78Å; V48-L382 HydrophobicContact CG1-CD1 4.35Å; V48-L382 HydrophobicContact CG1-CD2 3.88Å; V48-L382 HydrophobicContact CG2-CD2 4.33Å
49	L	97.6	Very high	90.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	124.6	174.5	174.3	64.7	0	0	0	110.5	L75 Y98 V121 L139 V140 V141 L146 Y149 L153	L49-L75 WeakPolarHBondContact CA-O 3.07Å; L49-L75 HydrophobicContact CD1-CB 4.3Å; L49-L75 HydrophobicContact CD1-CD2 4.11Å; L49-L75 HydrophobicContact CD1-CG 4.02Å; L49-Y98 HydrophobicContact CD1-CE1 4.06Å; L49-V121 HydrophobicContact CD1-CG1 4.1Å; L49-V121 HydrophobicContact CD1-CG2 3.94Å; L49-V121 HydrophobicContact CD2-CG1 4.29Å; L49-L139 HydrophobicContact CB-CD1 4.02Å; L49-V140 PolarHBondContact N-O 3.13Å; L49-V141 HydrophobicContact CB-CG1 3.92Å; L49-V141 HydrophobicContact CD2-CG1 4.29Å; L49-V141 HydrophobicContact CG-CG1 4.36Å; L49-L146 HydrophobicContact CD2-CD2 4.44Å; L49-L146 HydrophobicContact CG-CD1 4.3Å; L49-L146 WeakPolarHBondContact O-CD1 3.46Å; L49-Y149 HydrophobicContact CD2-CD1 4.08Å; L49-Y149 HydrophobicContact CD2-CE1 4.27Å; L49-L153 HydrophobicContact CD2-CD1 3.98Å
50	K	96.3	Very high	90.8	Very high	2 Å²	2	42 Å²	42	1%	0.009	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	133.3	177	-75.3	-80.8	-153.4	166.2	0	110.5	V48 A54 F55 L74 L75 A76 S77 V80 Y98 S142 E143 E378	V48-K50 HydrophobicContact CG1-CG 4.22Å; K50-A54 PolarHBondContact NZ-O 2.8Å; K50-F55 HydrophobicContact CD-CE1 4.22Å; K50-F55 HydrophobicContact CD-CZ 4.35Å; K50-F55 HydrophobicContact CG-CE1 4.11Å; K50-F55 HydrophobicContact CG-CE2 4.32Å; K50-F55 HydrophobicContact CG-CZ 3.8Å; K50-L74 HydrophobicContact CB-CD1 4.37Å; K50-L74 HydrophobicContact CG-CD1 4.24Å; K50-L75 PolarHBondContact N-O 3.27Å; K50-A76 VanDerWaalsContact O-CA 3.3Å; K50-A76 WeakPolarHBondContact O-CA 3.29Å; K50-S77 PolarHBondContact O-N 3.49Å; K50-V80 HydrophobicContact CB-CG1 3.98Å; K50-V80 HydrophobicContact CB-CG2 4.37Å; K50-Y98 PolarHBondContact O-OH 3.28Å; K50-Y98 VanDerWaalsContact O-OH 3.13Å; K50-S142 VanDerWaalsContact CE-OG 3.24Å; K50-S142 WeakPolarHBondContact CE-OG 3.33Å; K50-S142 PolarHBondContact NZ-OG 3.32Å; K50-E143 HydrophobicContact CD-CG 4.47Å; K50-E378 IonicContact NZ-OE1 3.37Å; K50-E378 PolarHBondContact NZ-OE1 2.97Å
51	A	93.4	Very high	91.1	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.204	C	C	.	.	S	Bend	trans	-123	-34.6	-174.8	0	0	0	0	0	113.8	S77 V80 Y98 Y118 E143 L146	A51-S77 WeakPolarHBondContact O-CB 3.34Å; A51-S77 PolarHBondContact O-OG 3.28Å; A51-V80 VanDerWaalsContact C-CG2 3.48Å; A51-Y98 WeakPolarHBondContact CA-OH 3.34Å; A51-Y98 WeakPolarHBondContact CB-OH 3.47Å; A51-Y118 HydrophobicContact CB-CD2 4.23Å; A51-Y118 HydrophobicContact CB-CE1 4.09Å; A51-Y118 HydrophobicContact CB-CE2 3.57Å; A51-Y118 VanDerWaalsContact CB-CZ 3.48Å; A51-E143 PolarHBondContact N-OE1 3.25Å; A51-L146 HydrophobicContact CB-CD1 4.07Å; A51-L146 HydrophobicContact CB-CD2 3.89Å; A51-L146 HydrophobicContact CB-CG 4.49Å
52	R	88.2	Confident	92.1	Very high	21 Å²	21	34.6 Å²	34.6	8%	0.079	18%	0.179	C	C	.	.	S	Bend	trans	-137.6	-37.5	-168	-71.4	-174	171.6	-119.1	12.7	114.4	E104 K106 C109 W110 Y118 E143	R52-E104 VanDerWaalsContact CZ-O 3.29Å; R52-E104 PolarHBondContact NH2-O 2.81Å; R52-K106 PolarHBondContact NH1-O 3.34Å; R52-K106 PolarHBondContact NH2-O 2.96Å; R52-C109 VanDerWaalsContact CZ-SG 3.5Å; R52-C109 PolarHBondContact NE-SG 3.24Å; R52-C109 PolarHBondContact NH2-SG 3.28Å; R52-W110 HydrophobicContact CB-CZ2 3.86Å; R52-W110 VanDerWaalsContact CD-NE1 3.31Å; R52-W110 HydrophobicContact CG-CZ2 4.23Å; R52-Y118 PolarHBondContact NE-OH 3.44Å; R52-E143 PolarHBondContact N-OE1 2.89Å; R52-E143 VanDerWaalsContact N-OE1 3.15Å
53	K	89.2	Confident	92.5	Very high	113 Å²	113	33 Å²	33	49%	0.491	16%	0.164	S	C	.	.	S	Bend	trans	-99.5	131.8	179.2	-65.7	177.2	177.7	174.8	0	109.8	W110 E143	K53-W110 HydrophobicContact CD-CH2 4.29Å; K53-W110 HydrophobicContact CG-CH2 4.47Å; K53-E143 HydrophobicContact CB-CG 4.12Å; K53-E143 WeakPolarHBondContact CB-OE2 3.32Å; K53-E143 HydrophobicContact CD-CG 4.45Å; K53-E143 WeakPolarHBondContact CG-OE2 3.39Å; K53-E143 VanDerWaalsContact N-CD 3.32Å; K53-E143 PolarHBondContact N-OE1 3.17Å; K53-E143 PolarHBondContact N-OE2 2.8Å; K53-E143 VanDerWaalsContact N-OE2 3.09Å
54	A	92.7	Very high	92.7	Very high	32 Å²	32	39 Å²	39	26%	0.264	19%	0.19	S	C	.	.	P	Polyproline II helix	trans	-60.9	167.2	169.1	0	0	0	0	0	110.6	K50 K83	K50-A54 PolarHBondContact NZ-O 2.8Å; A54-K83 HydrophobicContact CB-CB 4.18Å
55	F	95.2	Very high	92.5	Very high	12 Å²	12	32.7 Å²	32.7	5%	0.053	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-65	146.2	167	-63.6	-81	0	0	0	110	V48 K50 L59 L74 L84 F92 E378 L382	V48-F55 HydrophobicContact CG1-CE1 4.06Å; V48-F55 HydrophobicContact CG1-CZ 4.02Å; K50-F55 HydrophobicContact CD-CE1 4.22Å; K50-F55 HydrophobicContact CD-CZ 4.35Å; K50-F55 HydrophobicContact CG-CE1 4.11Å; K50-F55 HydrophobicContact CG-CE2 4.32Å; K50-F55 HydrophobicContact CG-CZ 3.8Å; F55-L59 HydrophobicContact CB-CD1 4.39Å; F55-L59 HydrophobicContact CB-CD2 4.39Å; F55-L59 HydrophobicContact CB-CG 4.27Å; F55-L59 HydrophobicContact CD1-CD1 3.64Å; F55-L59 HydrophobicContact CD1-CD2 3.63Å; F55-L59 HydrophobicContact CD1-CG 3.98Å; F55-L59 HydrophobicContact CD2-CD1 3.79Å; F55-L59 HydrophobicContact CE1-CD1 3.71Å; F55-L59 HydrophobicContact CE1-CD2 4.12Å; F55-L59 HydrophobicContact CE1-CG 4.44Å; F55-L59 HydrophobicContact CE2-CD1 3.87Å; F55-L59 HydrophobicContact CG-CD1 3.68Å; F55-L59 HydrophobicContact CG-CD2 4.14Å; F55-L59 HydrophobicContact CG-CG 4.04Å; F55-L59 HydrophobicContact CZ-CD1 3.84Å; F55-L74 HydrophobicContact CE2-CD1 4.12Å; F55-L74 HydrophobicContact CE2-CD2 4.04Å; F55-L74 HydrophobicContact CZ-CD1 3.81Å; F55-L74 HydrophobicContact CZ-CD2 4.47Å; F55-L84 HydrophobicContact CD2-CD2 3.49Å; F55-L84 VanDerWaalsContact CD2-CD2 3.49Å; F55-L84 HydrophobicContact CE2-CD2 3.72Å; F55-F92 HydrophobicContact CE1-CZ 4.36Å; F55-F92 HydrophobicContact CE2-CE2 4.05Å; F55-F92 HydrophobicContact CE2-CZ 4.09Å; F55-F92 HydrophobicContact CZ-CE2 4.07Å; F55-F92 AromaticContact CZ-CZ 3.62Å; F55-F92 HydrophobicContact CZ-CZ 3.62Å; F55-E378 WeakPolarHBondContact CA-OE1 3.19Å; F55-E378 HydrophobicContact CD1-CG 4.33Å; F55-E378 VanDerWaalsContact CD1-OE1 3.29Å; F55-E378 WeakPolarHBondContact CD1-OE1 3.21Å; F55-L382 HydrophobicContact CD1-CD1 4.32Å; F55-L382 HydrophobicContact CE1-CD1 3.82Å
56	T	92.4	Very high	92.1	Very high	68 Å²	68	32.9 Å²	32.9	42%	0.417	17%	0.17	S	C	.	.	S	Bend	trans	-85.8	-22.1	179.5	-50.3	0	0	0	0	111.2	V366 E378	T56-V366 HydrophobicContact CG2-CB 3.93Å; T56-V366 HydrophobicContact CG2-CG1 4Å; T56-E378 PolarHBondContact N-OE1 3.08Å; T56-E378 PolarHBondContact N-OE2 2.83Å
57	T	93	Very high	91.6	Very high	8 Å²	8	34.1 Å²	34.1	5%	0.049	18%	0.183	C	C	.	.	S	Bend	trans	-119.8	173.1	179.2	70.9	0	0	0	0	111.2	L59 Q88 V366 N376 E378	T57-L59 PolarHBondContact O-N 3.5Å; T57-L59 PolarHBondContact OG1-N 3.34Å; T57-Q88 PolarHBondContact O-NE2 2.99Å; T57-V366 HydrophobicContact CG2-CG1 3.68Å; T57-N376 WeakPolarHBondContact CB-ND2 3.48Å; T57-N376 WeakPolarHBondContact CG2-OD1 3.23Å; T57-N376 PolarHBondContact OG1-ND2 3.19Å; T57-N376 PolarHBondContact OG1-OD1 3.22Å; T57-E378 HydrophobicContact CG2-CB 4.17Å; T57-E378 PolarHBondContact N-OE2 3.4Å; T57-E378 PolarHBondContact OG1-OE2 2.96Å
58	D	92.7	Very high	91	Very high	61 Å²	61	39.1 Å²	39.1	33%	0.326	23%	0.225	S	C	.	.			trans	-73.8	-3.2	171	62.5	-1.2	0	0	0	113.9	I60	D58-I60 PolarHBondContact O-N 2.86Å; D58-I60 WeakPolarHBondContact OD1-CB 3.34Å; D58-I60 VanDerWaalsContact OD1-CG2 3.26Å; D58-I60 WeakPolarHBondContact OD1-CG2 3.5Å; D58-I60 PolarHBondContact OD1-N 2.77Å
59	L	93.4	Very high	90.5	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	25%	0.249	C	C	.	.			trans	60.3	21.4	-174.5	-57.2	174.3	0	0	0	114.5	F55 T57 G61 L62 Q91 F92 E378 V379 L382	F55-L59 HydrophobicContact CB-CD1 4.39Å; F55-L59 HydrophobicContact CB-CD2 4.39Å; F55-L59 HydrophobicContact CB-CG 4.27Å; F55-L59 HydrophobicContact CD1-CD1 3.64Å; F55-L59 HydrophobicContact CD1-CD2 3.63Å; F55-L59 HydrophobicContact CD1-CG 3.98Å; F55-L59 HydrophobicContact CD2-CD1 3.79Å; F55-L59 HydrophobicContact CE1-CD1 3.71Å; F55-L59 HydrophobicContact CE1-CD2 4.12Å; F55-L59 HydrophobicContact CE1-CG 4.44Å; F55-L59 HydrophobicContact CE2-CD1 3.87Å; F55-L59 HydrophobicContact CG-CD1 3.68Å; F55-L59 HydrophobicContact CG-CD2 4.14Å; F55-L59 HydrophobicContact CG-CG 4.04Å; F55-L59 HydrophobicContact CZ-CD1 3.84Å; T57-L59 PolarHBondContact O-N 3.5Å; T57-L59 PolarHBondContact OG1-N 3.34Å; L59-G61 PolarHBondContact O-N 3.15Å; L59-L62 HydrophobicContact CB-CB 4.44Å; L59-L62 HydrophobicContact CD1-CD2 4.44Å; L59-L62 WeakPolarHBondContact O-CB 3.42Å; L59-L62 PolarHBondContact O-N 2.85Å; L59-Q91 HydrophobicContact CB-CB 4.31Å; L59-Q91 HydrophobicContact CB-CG 3.79Å; L59-Q91 WeakPolarHBondContact O-CG 3.39Å; L59-Q91 PolarHBondContact O-OE1 3.01Å; L59-F92 HydrophobicContact CD1-CE2 3.6Å; L59-F92 HydrophobicContact CD1-CZ 3.7Å; L59-E378 HydrophobicContact CD2-CG 3.96Å; L59-V379 HydrophobicContact CB-CG2 4.34Å; L59-V379 HydrophobicContact CD2-CG2 4.21Å; L59-L382 HydrophobicContact CD2-CD1 4.09Å
60	I	90.6	Very high	90.2	Very high	107 Å²	107	44.4 Å²	44.4	55%	0.549	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	131	177	-162.4	168.6	0	0	0	110.4	D58	D58-I60 PolarHBondContact O-N 2.86Å; D58-I60 WeakPolarHBondContact OD1-CB 3.34Å; D58-I60 VanDerWaalsContact OD1-CG2 3.26Å; D58-I60 WeakPolarHBondContact OD1-CG2 3.5Å; D58-I60 PolarHBondContact OD1-N 2.77Å
61	G	88.8	Confident	90	Very high	21 Å²	21	45.5 Å²	45.5	22%	0.216	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.1	-5.6	-176.9	0	0	0	0	0	115.1	L59 R63 Q64 A65	L59-G61 PolarHBondContact O-N 3.15Å; G61-R63 PolarHBondContact O-N 3.31Å; G61-Q64 VanDerWaalsContact C-OE1 3.29Å; G61-Q64 PolarHBondContact O-N 3.42Å; G61-Q64 PolarHBondContact O-OE1 3.23Å; G61-A65 VanDerWaalsContact O-CB 3.27Å; G61-A65 WeakPolarHBondContact O-CB 3.11Å; G61-A65 PolarHBondContact O-N 3.09Å
62	L	91.8	Very high	90.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-57.6	-47.9	-176.5	-179.1	62.8	0	0	0	112.7	L46 L59 Q64 A65 C66 P72 Q91 F92 V379 L382	L46-L62 HydrophobicContact CD2-CD1 4.19Å; L59-L62 HydrophobicContact CB-CB 4.44Å; L59-L62 HydrophobicContact CD1-CD2 4.44Å; L59-L62 WeakPolarHBondContact O-CB 3.42Å; L59-L62 PolarHBondContact O-N 2.85Å; L62-Q64 PolarHBondContact O-N 2.85Å; L62-A65 PolarHBondContact O-N 2.95Å; L62-C66 PolarHBondContact O-N 3.48Å; L62-C66 PolarHBondContact O-SG 2.86Å; L62-P72 HydrophobicContact CD2-CB 4.18Å; L62-P72 HydrophobicContact CG-CG 4.44Å; L62-Q91 HydrophobicContact CB-CB 4.32Å; L62-Q91 HydrophobicContact CD2-CB 4.23Å; L62-F92 HydrophobicContact CD2-CE1 3.89Å; L62-F92 HydrophobicContact CD2-CZ 3.94Å; L62-V379 HydrophobicContact CB-CG1 4.49Å; L62-V379 HydrophobicContact CB-CG2 4.2Å; L62-V379 HydrophobicContact CD1-CG1 4.39Å; L62-L382 HydrophobicContact CD1-CB 4.29Å
63	R	88.2	Confident	90.5	Very high	88 Å²	88	44.6 Å²	44.6	33%	0.332	26%	0.256	S	S	.	.	H	α-helix	trans	-62.6	-43.9	179.6	-70.2	-177	175.6	-172.7	0.1	111.6	G61 A65 C66 G67 P72 G90 Q91 F92	G61-R63 PolarHBondContact O-N 3.31Å; R63-A65 VanDerWaalsContact C-N 3.34Å; R63-A65 PolarHBondContact O-N 3.13Å; R63-C66 PolarHBondContact O-N 3.09Å; R63-G67 PolarHBondContact O-N 2.88Å; R63-P72 HydrophobicContact CG-CG 4.14Å; R63-G90 PolarHBondContact NE-O 3.36Å; R63-G90 PolarHBondContact NH2-O 2.97Å; R63-Q91 VanDerWaalsContact CG-O 3.28Å; R63-Q91 WeakPolarHBondContact CG-O 3.5Å; R63-Q91 PolarHBondContact NE-O 3.32Å; R63-F92 PolarHBondContact NH2-O 3.12Å
64	Q	88.2	Confident	90.9	Very high	140 Å²	140	39.2 Å²	39.2	65%	0.654	23%	0.233	S	C	*	.	H	α-helix	trans	-61.5	-45	176.4	-65	83.8	-9.2	0	0	110.9	G61 L62 C66 G67	G61-Q64 VanDerWaalsContact C-OE1 3.29Å; G61-Q64 PolarHBondContact O-N 3.42Å; G61-Q64 PolarHBondContact O-OE1 3.23Å; L62-Q64 PolarHBondContact O-N 2.85Å; Q64-C66 VanDerWaalsContact C-N 3.29Å; Q64-C66 PolarHBondContact O-N 3.48Å; Q64-G67 PolarHBondContact O-N 2.85Å; Q64-G67 VanDerWaalsContact O-N 3.11Å
65	A	86.8	Confident	91.1	Very high	13 Å²	13	38 Å²	38	11%	0.107	22%	0.222	C	C	.	.	H	α-helix	trans	-67.5	-26.3	179.6	0	0	0	0	0	112.8	G61 L62 R63 G67 V379 S383 F387	G61-A65 VanDerWaalsContact O-CB 3.27Å; G61-A65 WeakPolarHBondContact O-CB 3.11Å; G61-A65 PolarHBondContact O-N 3.09Å; L62-A65 PolarHBondContact O-N 2.95Å; R63-A65 VanDerWaalsContact C-N 3.34Å; R63-A65 PolarHBondContact O-N 3.13Å; A65-G67 VanDerWaalsContact C-N 3.29Å; A65-V379 HydrophobicContact CB-CG1 3.72Å; A65-S383 WeakPolarHBondContact CB-OG 3.31Å; A65-F387 WeakPolarHBondContact O-CB 3.11Å
66	C	85.2	Confident	91.2	Very high	4 Å²	4	37.4 Å²	37.4	3%	0.027	22%	0.219	C	C	.	.	H	α-helix	trans	-80.2	-13.9	174.4	-60.6	0	0	0	0	113	L46 L62 R63 Q64 T70	L46-C66 WeakPolarHBondContact CD2-SG 3.46Å; L62-C66 PolarHBondContact O-N 3.48Å; L62-C66 PolarHBondContact O-SG 2.86Å; R63-C66 PolarHBondContact O-N 3.09Å; Q64-C66 VanDerWaalsContact C-N 3.29Å; Q64-C66 PolarHBondContact O-N 3.48Å; C66-T70 HydrophobicContact CB-CG2 3.66Å; C66-T70 WeakPolarHBondContact O-CB 3.14Å; C66-T70 PolarHBondContact O-OG1 2.76Å
67	G	85	Confident	91.4	Very high	27 Å²	27	34.1 Å²	34.1	28%	0.278	20%	0.199	S	C	.	.			trans	83.3	159.2	-172.2	0	0	0	0	0	113.2	R63 Q64 A65 N69 T70	R63-G67 PolarHBondContact O-N 2.88Å; Q64-G67 PolarHBondContact O-N 2.85Å; Q64-G67 VanDerWaalsContact O-N 3.11Å; A65-G67 VanDerWaalsContact C-N 3.29Å; G67-N69 PolarHBondContact O-N 2.79Å; G67-N69 VanDerWaalsContact O-N 3.11Å; G67-T70 PolarHBondContact O-N 2.89Å; G67-T70 VanDerWaalsContact O-N 3.12Å
68	A	84.9	Confident	91.5	Very high	105 Å²	105	37.1 Å²	37.1	87%	0.868	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-26.8	-172.9	0	0	0	0	0	114.3
69	N	87.5	Confident	91.5	Very high	96 Å²	96	38.4 Å²	38.4	51%	0.513	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	12	-176.8	-61.6	-20.3	0	0	0	113.2	N42 S43 R44 G67	N42-N69 WeakPolarHBondContact O-CB 3.32Å; S43-N69 CarbonylContact C-O 3.59Å; S43-N69 VanDerWaalsContact CA-O 3.25Å; S43-N69 WeakPolarHBondContact CA-O 2.86Å; R44-N69 PolarHBondContact N-O 2.82Å; G67-N69 PolarHBondContact O-N 2.79Å; G67-N69 VanDerWaalsContact O-N 3.11Å
70	T	90.2	Very high	91.6	Very high	14 Å²	14	38.4 Å²	38.4	9%	0.086	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129	178.8	-55.4	0	0	0	0	110.5	R44 L46 C66 G67 P72 Y386	R44-T70 HydrophobicContact CB-CG2 4.45Å; R44-T70 CarbonylContact O-C 3.53Å; R44-T70 VanDerWaalsContact O-CA 3.29Å; R44-T70 WeakPolarHBondContact O-CA 3.28Å; L46-T70 HydrophobicContact CB-CG2 4.03Å; C66-T70 HydrophobicContact CB-CG2 3.66Å; C66-T70 WeakPolarHBondContact O-CB 3.14Å; C66-T70 PolarHBondContact O-OG1 2.76Å; G67-T70 PolarHBondContact O-N 2.89Å; G67-T70 VanDerWaalsContact O-N 3.12Å; T70-P72 WeakPolarHBondContact O-CD 3.36Å; T70-Y386 HydrophobicContact CG2-CD1 4.38Å; T70-Y386 HydrophobicContact CG2-CD2 3.96Å; T70-Y386 HydrophobicContact CG2-CE1 4.26Å; T70-Y386 HydrophobicContact CG2-CE2 3.8Å; T70-Y386 HydrophobicContact CG2-CG 4.23Å
71	L	93.2	Very high	91.9	Very high	25 Å²	25	36.7 Å²	36.7	13%	0.131	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	111.2	178.4	-59.7	177.1	0	0	0	110	L34 I37 R44 C45 L46 I73 F93	L34-L71 HydrophobicContact CD1-CD1 3.45Å; L34-L71 VanDerWaalsContact CD1-CD1 3.45Å; I37-L71 HydrophobicContact CB-CD1 4.29Å; I37-L71 HydrophobicContact CD1-CD1 4.22Å; I37-L71 HydrophobicContact CG2-CD1 3.77Å; R44-L71 PolarHBondContact O-N 3.29Å; C45-L71 WeakPolarHBondContact CA-O 3.39Å; L46-L71 PolarHBondContact N-O 3.5Å; L71-I73 PolarHBondContact O-N 3.11Å; L71-F93 HydrophobicContact CB-CB 4.28Å; L71-F93 HydrophobicContact CB-CG 4.43Å; L71-F93 HydrophobicContact CD1-CD1 4.41Å; L71-F93 HydrophobicContact CD2-CB 4.44Å; L71-F93 HydrophobicContact CD2-CD2 4.01Å; L71-F93 HydrophobicContact CD2-CG 4.17Å
72	P	94.9	Very high	92.3	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.019	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	126	173.2	-16.4	32	0	0	0	110.4	L46 L62 R63 T70 F92 F93	L46-P72 CarbonylContact O-C 3.42Å; L46-P72 WeakPolarHBondContact O-CA 3.44Å; L62-P72 HydrophobicContact CD2-CB 4.18Å; L62-P72 HydrophobicContact CG-CG 4.44Å; R63-P72 HydrophobicContact CG-CG 4.14Å; T70-P72 WeakPolarHBondContact O-CD 3.36Å; P72-F92 HydrophobicContact CB-CD1 3.84Å; P72-F92 HydrophobicContact CB-CE1 4.29Å; P72-F92 CarbonylContact O-C 3.57Å; P72-F93 WeakPolarHBondContact O-CB 3.48Å; P72-F93 PolarHBondContact O-N 2.98Å
73	I	96.4	Very high	92.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128	177.7	-58.2	-179.7	0	0	0	107.8	L34 C45 L46 I47 V48 L71 L94 L128	L34-I73 HydrophobicContact CD1-CD1 4.23Å; L34-I73 HydrophobicContact CD2-CD1 3.87Å; C45-I73 HydrophobicContact CB-CD1 4.23Å; L46-I73 PolarHBondContact O-N 3.06Å; I47-I73 CarbonylContact C-O 3.49Å; I47-I73 WeakPolarHBondContact CA-O 3.44Å; V48-I73 PolarHBondContact N-O 3.4Å; L71-I73 PolarHBondContact O-N 3.11Å; I73-L94 WeakPolarHBondContact CA-O 3.47Å; I73-L94 HydrophobicContact CG1-CB 4.34Å; I73-L94 HydrophobicContact CG2-CB 4.21Å; I73-L94 HydrophobicContact CG2-CD2 4.27Å; I73-L94 HydrophobicContact CG2-CG 4.24Å; I73-L128 HydrophobicContact CD1-CD1 3.87Å; I73-L128 HydrophobicContact CD1-CD2 4.23Å; I73-L128 HydrophobicContact CG2-CD2 4.07Å
74	L	97.5	Very high	92.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	123.2	176	-179.2	58	0	0	0	110	V48 K50 F55 A76 L84 F92 L94 I95 I96	V48-L74 HydrophobicContact CB-CD1 4.19Å; V48-L74 HydrophobicContact CG1-CD1 4.16Å; V48-L74 WeakPolarHBondContact O-CD1 3.25Å; K50-L74 HydrophobicContact CB-CD1 4.37Å; K50-L74 HydrophobicContact CG-CD1 4.24Å; F55-L74 HydrophobicContact CE2-CD1 4.12Å; F55-L74 HydrophobicContact CE2-CD2 4.04Å; F55-L74 HydrophobicContact CZ-CD1 3.81Å; F55-L74 HydrophobicContact CZ-CD2 4.47Å; L74-A76 HydrophobicContact CD1-CB 4.08Å; L74-A76 HydrophobicContact CD2-CB 3.95Å; L74-A76 HydrophobicContact CG-CB 3.74Å; L74-L84 HydrophobicContact CD2-CD1 3.51Å; L74-F92 HydrophobicContact CB-CB 4.35Å; L74-F92 HydrophobicContact CB-CD1 3.59Å; L74-F92 HydrophobicContact CB-CD2 4.02Å; L74-F92 HydrophobicContact CB-CE1 3.81Å; L74-F92 HydrophobicContact CB-CE2 4.23Å; L74-F92 HydrophobicContact CB-CG 3.7Å; L74-F92 HydrophobicContact CB-CZ 4.13Å; L74-F92 HydrophobicContact CD1-CE1 4.39Å; L74-F92 HydrophobicContact CD1-CZ 4.22Å; L74-F92 HydrophobicContact CD2-CD2 4.05Å; L74-F92 HydrophobicContact CD2-CE2 3.89Å; L74-F92 HydrophobicContact CD2-CZ 4.28Å; L74-F92 HydrophobicContact CG-CE2 4.49Å; L74-F92 HydrophobicContact CG-CZ 4.45Å; L74-L94 PolarHBondContact N-O 2.64Å; L74-I95 HydrophobicContact CB-CB 4.49Å; L74-I95 HydrophobicContact CB-CG1 4.15Å; L74-I95 HydrophobicContact CB-CG2 4.23Å; L74-I95 HydrophobicContact CD2-CD1 4.49Å; L74-I95 HydrophobicContact CD2-CG1 4.49Å; L74-I95 HydrophobicContact CD2-CG2 4.15Å; L74-I95 HydrophobicContact CG-CG2 4.29Å; L74-I95 CarbonylContact O-C 3.57Å; L74-I95 WeakPolarHBondContact O-CA 3.33Å; L74-I96 PolarHBondContact O-N 2.89Å
75	L	97.6	Very high	93.3	Very high	5 Å²	5	39 Å²	39	3%	0.026	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	101.3	163.9	-175.6	58.3	0	0	0	107.7	I47 V48 L49 K50 I96 Y98 V121 K124	I47-L75 HydrophobicContact CG2-CB 4.47Å; V48-L75 PolarHBondContact O-N 3.39Å; L49-L75 WeakPolarHBondContact CA-O 3.07Å; L49-L75 HydrophobicContact CD1-CB 4.3Å; L49-L75 HydrophobicContact CD1-CD2 4.11Å; L49-L75 HydrophobicContact CD1-CG 4.02Å; K50-L75 PolarHBondContact N-O 3.27Å; L75-I96 WeakPolarHBondContact CA-O 3.5Å; L75-I96 HydrophobicContact CD1-CB 3.87Å; L75-I96 HydrophobicContact CD1-CG2 3.79Å; L75-Y98 HydrophobicContact CD1-CD1 3.78Å; L75-Y98 HydrophobicContact CD1-CE1 4.24Å; L75-Y98 HydrophobicContact CG-CD1 4.02Å; L75-Y98 HydrophobicContact CG-CE1 3.96Å; L75-V121 HydrophobicContact CD2-CB 4.49Å; L75-V121 HydrophobicContact CD2-CG1 3.83Å; L75-K124 HydrophobicContact CD1-CB 3.81Å; L75-K124 HydrophobicContact CD1-CG 4.31Å
76	A	97.4	Very high	93.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	142.4	-172.1	0	0	0	0	0	112.4	K50 L74 V80 I96 T97 Y98	K50-A76 VanDerWaalsContact O-CA 3.3Å; K50-A76 WeakPolarHBondContact O-CA 3.29Å; L74-A76 HydrophobicContact CD1-CB 4.08Å; L74-A76 HydrophobicContact CD2-CB 3.95Å; L74-A76 HydrophobicContact CG-CB 3.74Å; A76-V80 HydrophobicContact CB-CB 4.31Å; A76-V80 HydrophobicContact CB-CG1 4.21Å; A76-I96 PolarHBondContact N-O 3.26Å; A76-T97 CarbonylContact O-C 3.6Å; A76-T97 WeakPolarHBondContact O-CA 3.45Å; A76-Y98 VanDerWaalsContact C-CD1 3.48Å; A76-Y98 VanDerWaalsContact O-CD1 3.24Å; A76-Y98 WeakPolarHBondContact O-CD1 3.28Å; A76-Y98 PolarHBondContact O-N 3.35Å; A76-Y98 VanDerWaalsContact O-N 3.08Å
77	S	95.8	Very high	94.2	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	155.9	167.5	74	0	0	0	0	111.1	K50 A51 K79 V80 F81 Y98	K50-S77 PolarHBondContact O-N 3.49Å; A51-S77 WeakPolarHBondContact O-CB 3.34Å; A51-S77 PolarHBondContact O-OG 3.28Å; S77-K79 PolarHBondContact O-N 3.09Å; S77-K79 VanDerWaalsContact O-N 3.14Å; S77-V80 PolarHBondContact O-N 3.41Å; S77-V80 PolarHBondContact OG-N 3.45Å; S77-F81 PolarHBondContact O-N 3.49Å; S77-Y98 CarbonylContact C-O 3.54Å; S77-Y98 VanDerWaalsContact CA-O 3.22Å; S77-Y98 WeakPolarHBondContact CA-O 3.49Å; S77-Y98 VanDerWaalsContact N-CE1 3.29Å
78	D	95	Very high	94.8	Very high	70 Å²	70	44.2 Å²	44.2	37%	0.374	27%	0.268	S	S	.	.	H	α-helix	trans	-56.2	-33.7	176.1	-63.2	-24.3	0	0	0	112.1	V80 F81 S82 T97 Y98 P99	D78-V80 PolarHBondContact O-N 2.85Å; D78-F81 PolarHBondContact O-N 2.69Å; D78-S82 WeakPolarHBondContact O-CB 3.47Å; D78-S82 PolarHBondContact O-N 2.76Å; D78-S82 PolarHBondContact O-OG 2.9Å; D78-T97 WeakPolarHBondContact OD1-CB 3.37Å; D78-Y98 PolarHBondContact N-O 2.76Å; D78-P99 VanDerWaalsContact OD2-CA 3.25Å; D78-P99 WeakPolarHBondContact OD2-CA 3.36Å
79	K	93.7	Very high	95.3	Very high	89 Å²	89	43 Å²	43	39%	0.387	24%	0.243	S	C	.	.	H	α-helix	trans	-63.4	-39.1	175	177	179.2	-179.1	174.8	0	113	S77 S82 L100	S77-K79 PolarHBondContact O-N 3.09Å; S77-K79 VanDerWaalsContact O-N 3.14Å; K79-S82 PolarHBondContact O-OG 3.35Å; K79-S82 VanDerWaalsContact O-OG 3.14Å; K79-L100 HydrophobicContact CB-CD1 4.2Å; K79-L100 HydrophobicContact CD-CD1 4.3Å
80	V	95.6	Very high	95.7	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-76.6	-44.5	177.3	170.9	0	0	0	0	109.3	K50 A51 A76 S77 D78 S82 K83 L84	K50-V80 HydrophobicContact CB-CG1 3.98Å; K50-V80 HydrophobicContact CB-CG2 4.37Å; A51-V80 VanDerWaalsContact C-CG2 3.48Å; A76-V80 HydrophobicContact CB-CB 4.31Å; A76-V80 HydrophobicContact CB-CG1 4.21Å; S77-V80 PolarHBondContact O-N 3.41Å; S77-V80 PolarHBondContact OG-N 3.45Å; D78-V80 PolarHBondContact O-N 2.85Å; V80-S82 VanDerWaalsContact C-N 3.3Å; V80-S82 PolarHBondContact O-N 2.96Å; V80-K83 PolarHBondContact O-N 3.49Å; V80-L84 HydrophobicContact CG1-CD2 4.23Å; V80-L84 PolarHBondContact O-N 2.95Å
81	F	96.7	Very high	95.9	Very high	71 Å²	71	41.3 Å²	41.3	31%	0.311	24%	0.242	S	C	.	.	H	α-helix	trans	-55.9	-43	-179	-178.1	-102	0	0	0	112.7	S77 D78 K83 L84 I95 T97	S77-F81 PolarHBondContact O-N 3.49Å; D78-F81 PolarHBondContact O-N 2.69Å; F81-K83 PolarHBondContact O-N 3.17Å; F81-K83 VanDerWaalsContact O-N 3.13Å; F81-L84 HydrophobicContact CD2-CD1 4.01Å; F81-L84 PolarHBondContact O-N 2.74Å; F81-L84 VanDerWaalsContact O-N 3.13Å; F81-I95 HydrophobicContact CD2-CG2 3.79Å; F81-I95 HydrophobicContact CE2-CD1 4.35Å; F81-I95 HydrophobicContact CE2-CG2 3.86Å; F81-T97 HydrophobicContact CB-CG2 3.9Å; F81-T97 HydrophobicContact CD1-CG2 4.06Å; F81-T97 HydrophobicContact CD2-CG2 3.64Å; F81-T97 HydrophobicContact CE2-CG2 4.14Å; F81-T97 HydrophobicContact CG-CG2 3.58Å
82	S	96.3	Very high	96	Very high	93 Å²	93	40.6 Å²	40.6	65%	0.65	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-14.7	177.9	63.8	0	0	0	0	114.3	D78 K79 V80	D78-S82 WeakPolarHBondContact O-CB 3.47Å; D78-S82 PolarHBondContact O-N 2.76Å; D78-S82 PolarHBondContact O-OG 2.9Å; K79-S82 PolarHBondContact O-OG 3.35Å; K79-S82 VanDerWaalsContact O-OG 3.14Å; V80-S82 VanDerWaalsContact C-N 3.3Å; V80-S82 PolarHBondContact O-N 2.96Å
83	K	96.3	Very high	95.9	Very high	120 Å²	120	42.7 Å²	42.7	52%	0.522	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103	-2.5	178.4	-61.9	-176.5	179.4	-164.1	0	113.6	A54 V80 F81	A54-K83 HydrophobicContact CB-CB 4.18Å; V80-K83 PolarHBondContact O-N 3.49Å; F81-K83 PolarHBondContact O-N 3.17Å; F81-K83 VanDerWaalsContact O-N 3.13Å
84	L	96.8	Very high	95.8	Very high	14 Å²	14	42.8 Å²	42.8	7%	0.073	25%	0.247	C	C	.	.			trans	-75	132.1	-179.3	-62.4	177.5	0	0	0	111	F55 L74 V80 F81 Q88 K89	F55-L84 HydrophobicContact CD2-CD2 3.49Å; F55-L84 VanDerWaalsContact CD2-CD2 3.49Å; F55-L84 HydrophobicContact CE2-CD2 3.72Å; L74-L84 HydrophobicContact CD2-CD1 3.51Å; V80-L84 HydrophobicContact CG1-CD2 4.23Å; V80-L84 PolarHBondContact O-N 2.95Å; F81-L84 HydrophobicContact CD2-CD1 4.01Å; F81-L84 PolarHBondContact O-N 2.74Å; F81-L84 VanDerWaalsContact O-N 3.13Å; L84-Q88 VanDerWaalsContact CA-OE1 3.3Å; L84-Q88 HydrophobicContact CD2-CB 4.44Å; L84-K89 HydrophobicContact CB-CD 4.42Å; L84-K89 HydrophobicContact CB-CG 3.83Å; L84-K89 HydrophobicContact CD1-CG 4.2Å
85	T	96.5	Very high	95.8	Very high	69 Å²	69	44.1 Å²	44.1	42%	0.423	25%	0.254	S	S	.	.			trans	-73.3	160.6	170	70.9	0	0	0	0	110.8	A87 Q88 K89	T85-A87 PolarHBondContact O-N 3.47Å; T85-Q88 PolarHBondContact O-N 3.22Å; T85-Q88 WeakPolarHBondContact OG1-CG 3.31Å; T85-Q88 PolarHBondContact OG1-N 3.26Å; T85-K89 WeakPolarHBondContact O-CG 3.37Å; T85-K89 PolarHBondContact O-N 3.44Å
86	A	95.8	Very high	95.7	Very high	88 Å²	88	44.5 Å²	44.5	73%	0.727	26%	0.256	S	S	*	.	H	α-helix	trans	-57.4	-40.2	174	0	0	0	0	0	111.9	Q88 K89 G90	A86-Q88 PolarHBondContact O-N 3.06Å; A86-K89 PolarHBondContact O-N 2.9Å; A86-G90 PolarHBondContact O-N 3.14Å
87	A	95.3	Very high	95.7	Very high	54 Å²	54	46.4 Å²	46.4	45%	0.446	27%	0.267	S	S	.	.	H	α-helix	trans	-59.8	-45.1	176.5	0	0	0	0	0	112.3	T85 G90	T85-A87 PolarHBondContact O-N 3.47Å; A87-G90 PolarHBondContact O-N 2.96Å
88	Q	97	Very high	95.6	Very high	13 Å²	13	46.4 Å²	46.4	6%	0.061	27%	0.267	C	S	.	.	H	α-helix	trans	-64.7	-44.8	176.6	-72	166.7	-16.1	0	0	111.7	T57 L84 T85 A86 G90 Q91 F92	T57-Q88 PolarHBondContact O-NE2 2.99Å; L84-Q88 VanDerWaalsContact CA-OE1 3.3Å; L84-Q88 HydrophobicContact CD2-CB 4.44Å; T85-Q88 PolarHBondContact O-N 3.22Å; T85-Q88 WeakPolarHBondContact OG1-CG 3.31Å; T85-Q88 PolarHBondContact OG1-N 3.26Å; A86-Q88 PolarHBondContact O-N 3.06Å; Q88-G90 VanDerWaalsContact C-N 3.27Å; Q88-G90 PolarHBondContact O-N 2.9Å; Q88-Q91 PolarHBondContact O-N 3.16Å; Q88-F92 VanDerWaalsContact O-CD2 3.31Å; Q88-F92 WeakPolarHBondContact O-CD2 3.21Å
89	K	96.3	Very high	95.6	Very high	79 Å²	79	45.5 Å²	45.5	34%	0.343	27%	0.265	S	S	.	.	H	α-helix	trans	-58.6	-41.8	177.1	-69.3	178	-176.5	-179.4	0	111.1	L84 T85 A86 Q91 F92 I95	L84-K89 HydrophobicContact CB-CD 4.42Å; L84-K89 HydrophobicContact CB-CG 3.83Å; L84-K89 HydrophobicContact CD1-CG 4.2Å; T85-K89 WeakPolarHBondContact O-CG 3.37Å; T85-K89 PolarHBondContact O-N 3.44Å; A86-K89 PolarHBondContact O-N 2.9Å; K89-Q91 PolarHBondContact O-N 2.98Å; K89-Q91 VanDerWaalsContact O-N 3.14Å; K89-F92 PolarHBondContact O-N 3.38Å; K89-F92 VanDerWaalsContact O-N 3.16Å; K89-I95 HydrophobicContact CB-CD1 3.99Å; K89-I95 HydrophobicContact CG-CD1 3.97Å
90	G	94.6	Very high	95.4	Very high	41 Å²	41	42.1 Å²	42.1	42%	0.423	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-15.6	178.9	0	0	0	0	0	115.4	R63 A86 A87 Q88 F92	R63-G90 PolarHBondContact NE-O 3.36Å; R63-G90 PolarHBondContact NH2-O 2.97Å; A86-G90 PolarHBondContact O-N 3.14Å; A87-G90 PolarHBondContact O-N 2.96Å; Q88-G90 VanDerWaalsContact C-N 3.27Å; Q88-G90 PolarHBondContact O-N 2.9Å; G90-F92 VanDerWaalsContact C-N 3.35Å
91	Q	94.7	Very high	95	Very high	34 Å²	34	45.9 Å²	45.9	16%	0.159	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-19.6	176.5	-60.3	-51.9	-47.7	0	0	113.2	L59 L62 R63 Q88 K89	L59-Q91 HydrophobicContact CB-CB 4.31Å; L59-Q91 HydrophobicContact CB-CG 3.79Å; L59-Q91 WeakPolarHBondContact O-CG 3.39Å; L59-Q91 PolarHBondContact O-OE1 3.01Å; L62-Q91 HydrophobicContact CB-CB 4.32Å; L62-Q91 HydrophobicContact CD2-CB 4.23Å; R63-Q91 VanDerWaalsContact CG-O 3.28Å; R63-Q91 WeakPolarHBondContact CG-O 3.5Å; R63-Q91 PolarHBondContact NE-O 3.32Å; Q88-Q91 PolarHBondContact O-N 3.16Å; K89-Q91 PolarHBondContact O-N 2.98Å; K89-Q91 VanDerWaalsContact O-N 3.14Å
92	F	95.2	Very high	94.4	Very high	9 Å²	9	47.7 Å²	47.7	4%	0.039	28%	0.283	C	S	.	.			trans	-96.8	144.5	-177.9	-62	-80.8	0	0	0	111.3	V48 F55 L59 L62 R63 P72 L74 Q88 K89 G90 I95	V48-F92 HydrophobicContact CB-CE1 4.14Å; V48-F92 HydrophobicContact CG2-CE1 3.94Å; F55-F92 HydrophobicContact CE1-CZ 4.36Å; F55-F92 HydrophobicContact CE2-CE2 4.05Å; F55-F92 HydrophobicContact CE2-CZ 4.09Å; F55-F92 HydrophobicContact CZ-CE2 4.07Å; F55-F92 AromaticContact CZ-CZ 3.62Å; F55-F92 HydrophobicContact CZ-CZ 3.62Å; L59-F92 HydrophobicContact CD1-CE2 3.6Å; L59-F92 HydrophobicContact CD1-CZ 3.7Å; L62-F92 HydrophobicContact CD2-CE1 3.89Å; L62-F92 HydrophobicContact CD2-CZ 3.94Å; R63-F92 PolarHBondContact NH2-O 3.12Å; P72-F92 HydrophobicContact CB-CD1 3.84Å; P72-F92 HydrophobicContact CB-CE1 4.29Å; P72-F92 CarbonylContact O-C 3.57Å; L74-F92 HydrophobicContact CB-CB 4.35Å; L74-F92 HydrophobicContact CB-CD1 3.59Å; L74-F92 HydrophobicContact CB-CD2 4.02Å; L74-F92 HydrophobicContact CB-CE1 3.81Å; L74-F92 HydrophobicContact CB-CE2 4.23Å; L74-F92 HydrophobicContact CB-CG 3.7Å; L74-F92 HydrophobicContact CB-CZ 4.13Å; L74-F92 HydrophobicContact CD1-CE1 4.39Å; L74-F92 HydrophobicContact CD1-CZ 4.22Å; L74-F92 HydrophobicContact CD2-CD2 4.05Å; L74-F92 HydrophobicContact CD2-CE2 3.89Å; L74-F92 HydrophobicContact CD2-CZ 4.28Å; L74-F92 HydrophobicContact CG-CE2 4.49Å; L74-F92 HydrophobicContact CG-CZ 4.45Å; Q88-F92 VanDerWaalsContact O-CD2 3.31Å; Q88-F92 WeakPolarHBondContact O-CD2 3.21Å; K89-F92 PolarHBondContact O-N 3.38Å; K89-F92 VanDerWaalsContact O-N 3.16Å; G90-F92 VanDerWaalsContact C-N 3.35Å; F92-I95 HydrophobicContact CB-CD1 4.48Å; F92-I95 HydrophobicContact CB-CG1 3.94Å
93	F	93.6	Very high	93.6	Very high	48 Å²	48	50.6 Å²	50.6	21%	0.211	29%	0.286	C	S	.	.	S	Bend	trans	-73.6	-42.2	169.9	175.9	-96.2	0	0	0	110.5	Q30 L34 I37 L71 P72	Q30-F93 PolarHBondContact NE2-O 2.84Å; L34-F93 HydrophobicContact CB-CE1 4.13Å; L34-F93 HydrophobicContact CD1-CE1 4.42Å; I37-F93 HydrophobicContact CD1-CE2 4.08Å; I37-F93 HydrophobicContact CD1-CZ 3.98Å; L71-F93 HydrophobicContact CB-CB 4.28Å; L71-F93 HydrophobicContact CB-CG 4.43Å; L71-F93 HydrophobicContact CD1-CD1 4.41Å; L71-F93 HydrophobicContact CD2-CB 4.44Å; L71-F93 HydrophobicContact CD2-CD2 4.01Å; L71-F93 HydrophobicContact CD2-CG 4.17Å; P72-F93 WeakPolarHBondContact O-CB 3.48Å; P72-F93 PolarHBondContact O-N 2.98Å
94	L	95.2	Very high	92.9	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	139.9	-178.7	170.9	63.6	0	0	0	109.6	Q27 Q30 L31 I73 L74 I96 L128	Q27-L94 HydrophobicContact CG-CD1 4.39Å; Q30-L94 HydrophobicContact CB-CD1 3.97Å; L31-L94 HydrophobicContact CD2-CD2 3.73Å; L31-L94 HydrophobicContact CG-CD2 4.26Å; I73-L94 WeakPolarHBondContact CA-O 3.47Å; I73-L94 HydrophobicContact CG1-CB 4.34Å; I73-L94 HydrophobicContact CG2-CB 4.21Å; I73-L94 HydrophobicContact CG2-CD2 4.27Å; I73-L94 HydrophobicContact CG2-CG 4.24Å; L74-L94 PolarHBondContact N-O 2.64Å; L94-I96 HydrophobicContact CD1-CG1 4.3Å; L94-I96 HydrophobicContact CD2-CD1 4.02Å; L94-I96 HydrophobicContact CD2-CG1 4.05Å; L94-I96 HydrophobicContact CG-CD1 4.47Å; L94-I96 HydrophobicContact CG-CG1 3.98Å; L94-L128 HydrophobicContact CD2-CD1 4.19Å
95	I	96.3	Very high	92	Very high	28 Å²	28	50.8 Å²	50.8	14%	0.144	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	119.9	172.1	-53.6	179	0	0	0	108.6	Q27 L74 F81 K89 F92 T97	Q27-I95 PolarHBondContact NE2-O 3.05Å; L74-I95 HydrophobicContact CB-CB 4.49Å; L74-I95 HydrophobicContact CB-CG1 4.15Å; L74-I95 HydrophobicContact CB-CG2 4.23Å; L74-I95 HydrophobicContact CD2-CD1 4.49Å; L74-I95 HydrophobicContact CD2-CG1 4.49Å; L74-I95 HydrophobicContact CD2-CG2 4.15Å; L74-I95 HydrophobicContact CG-CG2 4.29Å; L74-I95 CarbonylContact O-C 3.57Å; L74-I95 WeakPolarHBondContact O-CA 3.33Å; F81-I95 HydrophobicContact CD2-CG2 3.79Å; F81-I95 HydrophobicContact CE2-CD1 4.35Å; F81-I95 HydrophobicContact CE2-CG2 3.86Å; K89-I95 HydrophobicContact CB-CD1 3.99Å; K89-I95 HydrophobicContact CG-CD1 3.97Å; F92-I95 HydrophobicContact CB-CD1 4.48Å; F92-I95 HydrophobicContact CB-CG1 3.94Å; I95-T97 HydrophobicContact CG2-CG2 4.37Å
96	I	96.2	Very high	90.8	Very high	12 Å²	12	53.8 Å²	53.8	6%	0.062	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	122.1	174	-55.4	176.1	0	0	0	107.3	L74 L75 A76 L94 K124 L128	L74-I96 PolarHBondContact O-N 2.89Å; L75-I96 WeakPolarHBondContact CA-O 3.5Å; L75-I96 HydrophobicContact CD1-CB 3.87Å; L75-I96 HydrophobicContact CD1-CG2 3.79Å; A76-I96 PolarHBondContact N-O 3.26Å; L94-I96 HydrophobicContact CD1-CG1 4.3Å; L94-I96 HydrophobicContact CD2-CD1 4.02Å; L94-I96 HydrophobicContact CD2-CG1 4.05Å; L94-I96 HydrophobicContact CG-CD1 4.47Å; L94-I96 HydrophobicContact CG-CG1 3.98Å; I96-K124 HydrophobicContact CG2-CB 4.05Å; I96-K124 HydrophobicContact CG2-CD 3.92Å; I96-K124 HydrophobicContact CG2-CG 4.05Å; I96-L128 HydrophobicContact CD1-CB 4.2Å; I96-L128 HydrophobicContact CD1-CD1 4.3Å; I96-L128 HydrophobicContact CD1-CD2 4.41Å
97	T	96.2	Very high	89.2	Confident	40 Å²	40	54.1 Å²	54.1	25%	0.245	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	156.8	177	66.2	0	0	0	0	112.1	A76 D78 F81 I95	A76-T97 CarbonylContact O-C 3.6Å; A76-T97 WeakPolarHBondContact O-CA 3.45Å; D78-T97 WeakPolarHBondContact OD1-CB 3.37Å; F81-T97 HydrophobicContact CB-CG2 3.9Å; F81-T97 HydrophobicContact CD1-CG2 4.06Å; F81-T97 HydrophobicContact CD2-CG2 3.64Å; F81-T97 HydrophobicContact CE2-CG2 4.14Å; F81-T97 HydrophobicContact CG-CG2 3.58Å; I95-T97 HydrophobicContact CG2-CG2 4.37Å
98	Y	95.1	Very high	87.4	Confident	1 Å²	1	58.4 Å²	58.4	0%	0.004	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	143.4	172.3	63.5	-89.2	0	0	0	111.6	L49 K50 A51 L75 A76 S77 D78 L100 Y118 E120 V121	L49-Y98 HydrophobicContact CD1-CE1 4.06Å; K50-Y98 PolarHBondContact O-OH 3.28Å; K50-Y98 VanDerWaalsContact O-OH 3.13Å; A51-Y98 WeakPolarHBondContact CA-OH 3.34Å; A51-Y98 WeakPolarHBondContact CB-OH 3.47Å; L75-Y98 HydrophobicContact CD1-CD1 3.78Å; L75-Y98 HydrophobicContact CD1-CE1 4.24Å; L75-Y98 HydrophobicContact CG-CD1 4.02Å; L75-Y98 HydrophobicContact CG-CE1 3.96Å; A76-Y98 VanDerWaalsContact C-CD1 3.48Å; A76-Y98 VanDerWaalsContact O-CD1 3.24Å; A76-Y98 WeakPolarHBondContact O-CD1 3.28Å; A76-Y98 PolarHBondContact O-N 3.35Å; A76-Y98 VanDerWaalsContact O-N 3.08Å; S77-Y98 CarbonylContact C-O 3.54Å; S77-Y98 VanDerWaalsContact CA-O 3.22Å; S77-Y98 WeakPolarHBondContact CA-O 3.49Å; S77-Y98 VanDerWaalsContact N-CE1 3.29Å; D78-Y98 PolarHBondContact N-O 2.76Å; Y98-L100 HydrophobicContact CE2-CD2 4.03Å; Y98-Y118 HydrophobicContact CE2-CD1 4.27Å; Y98-Y118 HydrophobicContact CE2-CG 4.14Å; Y98-E120 HydrophobicContact CD2-CB 4.47Å; Y98-E120 HydrophobicContact CG-CB 4.5Å; Y98-V121 HydrophobicContact CD1-CG2 3.99Å; Y98-V121 HydrophobicContact CD2-CG2 3.94Å; Y98-V121 HydrophobicContact CE1-CG2 3.61Å; Y98-V121 HydrophobicContact CE2-CG2 3.57Å; Y98-V121 HydrophobicContact CG-CG2 4.14Å
99	P	93.8	Very high	85.5	Confident	51 Å²	51	59.3 Å²	59.3	33%	0.331	31%	0.309	S	S	.	.	P	Polyproline II helix	trans	-72.3	149.1	175.1	30.8	-35.3	0	0	0	110.9	D78 E120	D78-P99 VanDerWaalsContact OD2-CA 3.25Å; D78-P99 WeakPolarHBondContact OD2-CA 3.36Å; P99-E120 HydrophobicContact CG-CG 3.99Å
100	L	89.6	Confident	84	Confident	18 Å²	18	57.7 Å²	57.7	9%	0.094	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-85.8	126.6	162.8	-61.6	179.7	0	0	0	108.1	K79 Y98 E104 K105 Y118	K79-L100 HydrophobicContact CB-CD1 4.2Å; K79-L100 HydrophobicContact CD-CD1 4.3Å; Y98-L100 HydrophobicContact CE2-CD2 4.03Å; L100-E104 HydrophobicContact CB-CB 4.28Å; L100-K105 HydrophobicContact CB-CG 3.95Å; L100-K105 WeakPolarHBondContact O-CE 3.26Å; L100-Y118 HydrophobicContact CD2-CD1 3.55Å; L100-Y118 HydrophobicContact CD2-CE1 3.55Å
101	M	88	Confident	82.6	Confident	78 Å²	78	56.8 Å²	56.8	38%	0.384	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-76.9	163.6	174.8	-54.3	-56.5	-73.3	0	0	110.4	E103 E104 K105 K119	M101-E103 PolarHBondContact O-N 2.95Å; M101-E104 HydrophobicContact CB-CG 4.2Å; M101-E104 PolarHBondContact N-OE2 3.03Å; M101-E104 CarbonylContact O-C 3.56Å; M101-E104 VanDerWaalsContact O-CA 3.26Å; M101-E104 WeakPolarHBondContact O-CA 3.49Å; M101-E104 VanDerWaalsContact O-CB 3.23Å; M101-E104 WeakPolarHBondContact O-CB 3.15Å; M101-E104 PolarHBondContact O-N 3.5Å; M101-K105 PolarHBondContact O-N 3.22Å; M101-K119 HydrophobicContact CG-CB 4.41Å; M101-K119 HydrophobicContact CG-CD 4.31Å
102	D	83.1	Confident	81.9	Confident	110 Å²	110	55.9 Å²	55.9	59%	0.588	28%	0.284	S	S	*	.	H	α-helix	trans	-55.9	-45.3	-163.6	-62.5	-39.3	0	0	0	115.4	E104 K105 K106	D102-E104 VanDerWaalsContact C-N 3.27Å; D102-E104 PolarHBondContact O-N 3.01Å; D102-K105 WeakPolarHBondContact O-CB 3.29Å; D102-K105 PolarHBondContact O-N 2.91Å; D102-K105 VanDerWaalsContact O-N 3.15Å; D102-K105 IonicContact OD1-NZ 3.77Å; D102-K105 PolarHBondContact OD1-NZ 3.39Å; D102-K106 PolarHBondContact O-N 3.47Å
103	E	79	Confident	81.4	Confident	153 Å²	153	55.4 Å²	55.4	72%	0.715	28%	0.282	S	S	*	.	H	α-helix	trans	-64.4	-34.9	174.2	-65.3	178.5	173.6	0	0	112	M101 K105 K106	M101-E103 PolarHBondContact O-N 2.95Å; E103-K105 PolarHBondContact O-N 3.47Å; E103-K106 WeakPolarHBondContact O-CB 3.43Å; E103-K106 PolarHBondContact O-N 3.31Å
104	E	81.6	Confident	80.8	Confident	15 Å²	15	54.9 Å²	54.9	7%	0.07	28%	0.283	C	S	.	.	H	α-helix	trans	-73.9	-12.7	176.8	-49.4	170.6	171	0	0	112.7	R52 L100 M101 D102 Y118 K119	R52-E104 VanDerWaalsContact CZ-O 3.29Å; R52-E104 PolarHBondContact NH2-O 2.81Å; L100-E104 HydrophobicContact CB-CB 4.28Å; M101-E104 HydrophobicContact CB-CG 4.2Å; M101-E104 PolarHBondContact N-OE2 3.03Å; M101-E104 CarbonylContact O-C 3.56Å; M101-E104 VanDerWaalsContact O-CA 3.26Å; M101-E104 WeakPolarHBondContact O-CA 3.49Å; M101-E104 VanDerWaalsContact O-CB 3.23Å; M101-E104 WeakPolarHBondContact O-CB 3.15Å; M101-E104 PolarHBondContact O-N 3.5Å; D102-E104 VanDerWaalsContact C-N 3.27Å; D102-E104 PolarHBondContact O-N 3.01Å; E104-Y118 HydrophobicContact CB-CD1 4.12Å; E104-Y118 HydrophobicContact CB-CE1 4.14Å; E104-Y118 HydrophobicContact CG-CD1 4.25Å; E104-Y118 VanDerWaalsContact OE1-CA 3.31Å; E104-Y118 WeakPolarHBondContact OE1-CA 3.34Å; E104-K119 PolarHBondContact OE1-N 3.24Å
105	K	78.8	Confident	80.3	Confident	123 Å²	123	61.5 Å²	61.5	54%	0.535	31%	0.313	S	S	.	.	H	α-helix	trans	-80.2	-34.5	169.5	-64.1	172.8	-167.3	158.5	0	110.8	L100 M101 D102 E103	L100-K105 HydrophobicContact CB-CG 3.95Å; L100-K105 WeakPolarHBondContact O-CE 3.26Å; M101-K105 PolarHBondContact O-N 3.22Å; D102-K105 WeakPolarHBondContact O-CB 3.29Å; D102-K105 PolarHBondContact O-N 2.91Å; D102-K105 VanDerWaalsContact O-N 3.15Å; D102-K105 IonicContact OD1-NZ 3.77Å; D102-K105 PolarHBondContact OD1-NZ 3.39Å; E103-K105 PolarHBondContact O-N 3.47Å
106	K	71.5	Confident	79.7	Confident	133 Å²	133	60.3 Å²	60.3	58%	0.578	31%	0.307	S	S	*	.	S	Bend	trans	-64.1	139	-179.7	-61.3	179.1	-176.3	176.4	0	110.1	R52 D102 E103 Q108	R52-K106 PolarHBondContact NH1-O 3.34Å; R52-K106 PolarHBondContact NH2-O 2.96Å; D102-K106 PolarHBondContact O-N 3.47Å; E103-K106 WeakPolarHBondContact O-CB 3.43Å; E103-K106 PolarHBondContact O-N 3.31Å; K106-Q108 PolarHBondContact O-N 2.89Å; K106-Q108 VanDerWaalsContact O-N 3.1Å
107	S	61.1	Low	79.2	Confident	94 Å²	94	62.7 Å²	62.7	66%	0.657	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-69.1	-3.4	-175.9	55.5	0	0	0	0	114.6	C109	S107-C109 VanDerWaalsContact C-N 3.31Å; S107-C109 PolarHBondContact O-N 3.36Å
108	Q	59.1	Low	78.9	Confident	145 Å²	145	61 Å²	61	68%	0.678	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-79.4	-4.2	-171.2	-66.9	-179.3	-11.1	0	0	114.6	K106 W110 C111	K106-Q108 PolarHBondContact O-N 2.89Å; K106-Q108 VanDerWaalsContact O-N 3.1Å; Q108-W110 PolarHBondContact O-N 3.26Å; Q108-C111 PolarHBondContact O-N 3.08Å; Q108-C111 PolarHBondContact O-SG 3.16Å
109	C	55.5	Low	78.8	Confident	32 Å²	32	67.7 Å²	67.7	22%	0.216	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-68.9	3.3	177.7	80.1	0	0	0	0	114.4	R52 S107 V116	R52-C109 VanDerWaalsContact CZ-SG 3.5Å; R52-C109 PolarHBondContact NE-SG 3.24Å; R52-C109 PolarHBondContact NH2-SG 3.28Å; S107-C109 VanDerWaalsContact C-N 3.31Å; S107-C109 PolarHBondContact O-N 3.36Å; C109-V116 WeakPolarHBondContact O-CG2 3.47Å
110	W	65.7	Low	78.8	Confident	44 Å²	44	68.1 Å²	68.1	17%	0.167	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-101.5	-2.5	-177.3	-55	60.7	0	0	0	111.7	R52 K53 Q108 P145	R52-W110 HydrophobicContact CB-CZ2 3.86Å; R52-W110 VanDerWaalsContact CD-NE1 3.31Å; R52-W110 HydrophobicContact CG-CZ2 4.23Å; K53-W110 HydrophobicContact CD-CH2 4.29Å; K53-W110 HydrophobicContact CG-CH2 4.47Å; Q108-W110 PolarHBondContact O-N 3.26Å; W110-P145 HydrophobicContact CD2-CG 3.5Å; W110-P145 VanDerWaalsContact CD2-CG 3.5Å; W110-P145 HydrophobicContact CE3-CG 3.15Å; W110-P145 HydrophobicContact CG-CG 4.28Å; W110-P145 HydrophobicContact CH2-CG 3.6Å; W110-P145 HydrophobicContact CZ2-CG 3.95Å; W110-P145 VanDerWaalsContact CZ3-CD 3.47Å; W110-P145 HydrophobicContact CZ3-CG 3.2Å
111	C	65.2	Low	79.1	Confident	22 Å²	22	67.2 Å²	67.2	15%	0.149	34%	0.336	C	S	.	.	S	Bend	trans	-68.5	-36.9	176	-56.5	0	0	0	0	111.6	Q108 S232 F236	Q108-C111 PolarHBondContact O-N 3.08Å; Q108-C111 PolarHBondContact O-SG 3.16Å; C111-S232 WeakPolarHBondContact O-CB 3.43Å; C111-F236 HydrophobicContact CB-CD1 4.32Å; C111-F236 HydrophobicContact CB-CE1 3.82Å; C111-F236 HydrophobicContact CB-CZ 4.44Å; C111-F236 WeakPolarHBondContact SG-CE1 3.39Å; C111-F236 WeakPolarHBondContact SG-CZ 3.17Å
112	D	81	Confident	79.5	Confident	15 Å²	15	64 Å²	64	8%	0.08	32%	0.323	C	S	.	.			trans	-138.5	105.7	174.7	-165.7	-28.9	0	0	0	110.4	T114 E115 S231	D112-T114 PolarHBondContact O-N 3.29Å; D112-T114 WeakPolarHBondContact OD1-CA 3.42Å; D112-T114 WeakPolarHBondContact OD1-CB 3.34Å; D112-T114 PolarHBondContact OD1-N 3.34Å; D112-T114 PolarHBondContact OD1-OG1 2.98Å; D112-E115 HydrophobicContact CB-CB 4.35Å; D112-E115 HydrophobicContact CB-CG 4.04Å; D112-E115 PolarHBondContact O-N 2.68Å; D112-S231 CarbonylContact C-O 3.55Å; D112-S231 WeakPolarHBondContact CA-O 3.41Å; D112-S231 VanDerWaalsContact OD1-CB 3.22Å; D112-S231 WeakPolarHBondContact OD1-CB 3.36Å
113	L	83.8	Confident	80.2	Confident	0 Å²	0	62 Å²	62	0%	0	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-19.2	178.5	-59.2	168.7	0	0	0	112.1	E144 P145 S231 C233	L113-E144 HydrophobicContact CD1-CG 4.12Å; L113-E144 HydrophobicContact CD2-CB 4.5Å; L113-P145 HydrophobicContact CD2-CB 3.88Å; L113-P145 HydrophobicContact CD2-CG 3.84Å; L113-S231 VanDerWaalsContact CB-O 3.3Å; L113-S231 WeakPolarHBondContact CB-O 3.35Å; L113-S231 WeakPolarHBondContact CD1-O 3.36Å; L113-S231 WeakPolarHBondContact CG-O 3.33Å; L113-S231 PolarHBondContact N-O 3.49Å; L113-C233 HydrophobicContact CD1-CB 4.35Å; L113-C233 HydrophobicContact CD2-CB 4.4Å
114	T	80.9	Confident	81	Confident	37 Å²	37	58.2 Å²	58.2	23%	0.227	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-25.3	179.1	70.7	0	0	0	0	113.1	D112 Y148 K152	D112-T114 PolarHBondContact O-N 3.29Å; D112-T114 WeakPolarHBondContact OD1-CA 3.42Å; D112-T114 WeakPolarHBondContact OD1-CB 3.34Å; D112-T114 PolarHBondContact OD1-N 3.34Å; D112-T114 PolarHBondContact OD1-OG1 2.98Å; T114-Y148 HydrophobicContact CG2-CD1 4.23Å; T114-Y148 HydrophobicContact CG2-CE1 4.18Å; T114-Y148 HydrophobicContact CG2-CG 4.48Å; T114-K152 PolarHBondContact O-NZ 2.82Å
115	E	83.8	Confident	81.7	Confident	140 Å²	140	57.5 Å²	57.5	65%	0.654	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-12.7	179.7	-62.1	-170.9	156.9	0	0	112.9	D112 S117	D112-E115 HydrophobicContact CB-CB 4.35Å; D112-E115 HydrophobicContact CB-CG 4.04Å; D112-E115 PolarHBondContact O-N 2.68Å; E115-S117 PolarHBondContact O-N 3.11Å; E115-S117 VanDerWaalsContact O-N 3.15Å
116	V	84.3	Confident	82.5	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.018	29%	0.291	C	S	.	.			trans	-54.4	125.2	177	-179.9	0	0	0	0	109.9	C109 Y118 P145 Y149 K152	C109-V116 WeakPolarHBondContact O-CG2 3.47Å; V116-Y118 HydrophobicContact CG1-CD2 4.44Å; V116-Y118 HydrophobicContact CG1-CE2 3.71Å; V116-P145 WeakPolarHBondContact CB-O 3.2Å; V116-P145 HydrophobicContact CG1-CB 4.32Å; V116-P145 WeakPolarHBondContact CG1-O 3.11Å; V116-P145 HydrophobicContact CG2-CB 3.86Å; V116-Y149 VanDerWaalsContact O-CD2 3.31Å; V116-Y149 WeakPolarHBondContact O-CD2 3.28Å; V116-K152 PolarHBondContact O-NZ 2.89Å
117	S	86.2	Confident	83.6	Confident	63 Å²	63	55 Å²	55	44%	0.441	28%	0.281	S	S	.	.			trans	-150.8	156.5	172.4	59.5	0	0	0	0	109.3	E115	E115-S117 PolarHBondContact O-N 3.11Å; E115-S117 VanDerWaalsContact O-N 3.15Å
118	Y	90.6	Very high	85.2	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.016	25%	0.25	C	S	.	.			trans	-134.1	110.6	174	-66.1	-75.6	0	0	0	107.3	A51 R52 Y98 L100 E104 V116 E120 V121 L146 Y149	A51-Y118 HydrophobicContact CB-CD2 4.23Å; A51-Y118 HydrophobicContact CB-CE1 4.09Å; A51-Y118 HydrophobicContact CB-CE2 3.57Å; A51-Y118 VanDerWaalsContact CB-CZ 3.48Å; R52-Y118 PolarHBondContact NE-OH 3.44Å; Y98-Y118 HydrophobicContact CE2-CD1 4.27Å; Y98-Y118 HydrophobicContact CE2-CG 4.14Å; L100-Y118 HydrophobicContact CD2-CD1 3.55Å; L100-Y118 HydrophobicContact CD2-CE1 3.55Å; E104-Y118 HydrophobicContact CB-CD1 4.12Å; E104-Y118 HydrophobicContact CB-CE1 4.14Å; E104-Y118 HydrophobicContact CG-CD1 4.25Å; E104-Y118 VanDerWaalsContact OE1-CA 3.31Å; E104-Y118 WeakPolarHBondContact OE1-CA 3.34Å; V116-Y118 HydrophobicContact CG1-CD2 4.44Å; V116-Y118 HydrophobicContact CG1-CE2 3.71Å; Y118-E120 PolarHBondContact O-N 3.45Å; Y118-E120 VanDerWaalsContact O-N 3.1Å; Y118-V121 HydrophobicContact CG-CG2 4.37Å; Y118-V121 WeakPolarHBondContact O-CB 3.41Å; Y118-V121 PolarHBondContact O-N 3.06Å; Y118-L146 HydrophobicContact CD2-CD2 4.13Å; Y118-L146 HydrophobicContact CE2-CD2 3.45Å; Y118-L146 VanDerWaalsContact CE2-CD2 3.45Å; Y118-Y149 AromaticContact CD2-CD1 4Å; Y118-Y149 HydrophobicContact CD2-CD1 4Å; Y118-Y149 AromaticContact CD2-CE1 3.73Å; Y118-Y149 HydrophobicContact CD2-CE1 3.73Å; Y118-Y149 HydrophobicContact CG-CE1 4.48Å; Y118-Y149 PolarHBondContact N-OH 3.05Å; Y118-Y149 PolarHBondContact O-OH 2.99Å
119	K	91.4	Very high	86.9	Confident	141 Å²	141	45.4 Å²	45.4	61%	0.613	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.2	-39.6	-168.1	-71.5	-178.7	-176.7	178.4	0	112.4	M101 E104 P123	M101-K119 HydrophobicContact CG-CB 4.41Å; M101-K119 HydrophobicContact CG-CD 4.31Å; E104-K119 PolarHBondContact OE1-N 3.24Å; K119-P123 WeakPolarHBondContact O-CD 3.42Å
120	E	94.6	Very high	88.8	Confident	60 Å²	60	52.1 Å²	52.1	28%	0.28	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-18.9	-176.3	-69	-58.2	118.7	0	0	114.5	Y98 P99 Y118 G122 P123 K124	Y98-E120 HydrophobicContact CD2-CB 4.47Å; Y98-E120 HydrophobicContact CG-CB 4.5Å; P99-E120 HydrophobicContact CG-CG 3.99Å; Y118-E120 PolarHBondContact O-N 3.45Å; Y118-E120 VanDerWaalsContact O-N 3.1Å; E120-G122 PolarHBondContact O-N 3Å; E120-P123 WeakPolarHBondContact O-CD 3.36Å; E120-K124 VanDerWaalsContact O-CG 3.24Å; E120-K124 WeakPolarHBondContact O-CG 3.4Å; E120-K124 PolarHBondContact O-N 3.44Å; E120-K124 VanDerWaalsContact O-N 3.08Å
121	V	96.3	Very high	90.1	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.9	-43.7	-177.5	165.7	0	0	0	0	111.7	L49 L75 Y98 Y118 K124 L125 Y149 L153	L49-V121 HydrophobicContact CD1-CG1 4.1Å; L49-V121 HydrophobicContact CD1-CG2 3.94Å; L49-V121 HydrophobicContact CD2-CG1 4.29Å; L75-V121 HydrophobicContact CD2-CB 4.49Å; L75-V121 HydrophobicContact CD2-CG1 3.83Å; Y98-V121 HydrophobicContact CD1-CG2 3.99Å; Y98-V121 HydrophobicContact CD2-CG2 3.94Å; Y98-V121 HydrophobicContact CE1-CG2 3.61Å; Y98-V121 HydrophobicContact CE2-CG2 3.57Å; Y98-V121 HydrophobicContact CG-CG2 4.14Å; Y118-V121 HydrophobicContact CG-CG2 4.37Å; Y118-V121 WeakPolarHBondContact O-CB 3.41Å; Y118-V121 PolarHBondContact O-N 3.06Å; V121-K124 PolarHBondContact O-N 3.27Å; V121-L125 VanDerWaalsContact O-CB 3.28Å; V121-L125 WeakPolarHBondContact O-CB 3.48Å; V121-L125 PolarHBondContact O-N 2.87Å; V121-Y149 HydrophobicContact CB-CE1 4.15Å; V121-Y149 HydrophobicContact CG1-CE1 3.95Å; V121-Y149 HydrophobicContact CG2-CE1 4.43Å; V121-L153 HydrophobicContact CG1-CD1 3.57Å; V121-L153 HydrophobicContact CG1-CD2 4.35Å
122	G	96.4	Very high	91.3	Very high	9 Å²	9	51.3 Å²	51.3	9%	0.093	24%	0.243	C	C	.	.	H	α-helix	trans	-60	-53.3	178.6	0	0	0	0	0	113.1	E120 K124 L125 R126 F157	E120-G122 PolarHBondContact O-N 3Å; G122-K124 PolarHBondContact O-N 2.99Å; G122-L125 PolarHBondContact O-N 3.48Å; G122-R126 WeakPolarHBondContact O-CB 3.39Å; G122-R126 PolarHBondContact O-N 3.35Å; G122-F157 WeakPolarHBondContact O-CZ 3.41Å
123	P	96.6	Very high	91.9	Very high	69 Å²	69	56.7 Å²	56.7	45%	0.448	27%	0.268	S	S	.	.	H	α-helix	trans	-54	-45.8	172.6	-29.3	35.8	0	0	0	114.2	K119 E120 R126 H127	K119-P123 WeakPolarHBondContact O-CD 3.42Å; E120-P123 WeakPolarHBondContact O-CD 3.36Å; P123-R126 PolarHBondContact O-N 3.33Å; P123-H127 PolarHBondContact O-N 2.87Å
124	K	96	Very high	92.4	Very high	73 Å²	73	57.8 Å²	57.8	32%	0.317	28%	0.277	S	S	.	.	H	α-helix	trans	-64.5	-43.4	178.2	-64.9	-55.7	179	-167.9	0	112.2	L75 I96 E120 V121 G122 H127 L128	L75-K124 HydrophobicContact CD1-CB 3.81Å; L75-K124 HydrophobicContact CD1-CG 4.31Å; I96-K124 HydrophobicContact CG2-CB 4.05Å; I96-K124 HydrophobicContact CG2-CD 3.92Å; I96-K124 HydrophobicContact CG2-CG 4.05Å; E120-K124 VanDerWaalsContact O-CG 3.24Å; E120-K124 WeakPolarHBondContact O-CG 3.4Å; E120-K124 PolarHBondContact O-N 3.44Å; E120-K124 VanDerWaalsContact O-N 3.08Å; V121-K124 PolarHBondContact O-N 3.27Å; G122-K124 PolarHBondContact O-N 2.99Å; K124-H127 WeakPolarHBondContact O-CB 3.35Å; K124-H127 PolarHBondContact O-N 3.46Å; K124-L128 PolarHBondContact O-N 2.96Å
125	L	96.4	Very high	93.1	Very high	1 Å²	1	59.9 Å²	59.9	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-64.6	-42.1	177.3	-173.9	57.8	0	0	0	111.3	I47 V121 G122 H127 L128 L129 L139 L153 F157 I159	I47-L125 HydrophobicContact CD1-CD1 3.73Å; V121-L125 VanDerWaalsContact O-CB 3.28Å; V121-L125 WeakPolarHBondContact O-CB 3.48Å; V121-L125 PolarHBondContact O-N 2.87Å; G122-L125 PolarHBondContact O-N 3.48Å; L125-H127 VanDerWaalsContact C-N 3.28Å; L125-H127 PolarHBondContact O-N 2.89Å; L125-L128 HydrophobicContact CD1-CD2 4.4Å; L125-L128 PolarHBondContact O-N 3.03Å; L125-L129 HydrophobicContact CD1-CD1 4.29Å; L125-L129 HydrophobicContact CD1-CG 4.28Å; L125-L129 HydrophobicContact CG-CD1 4Å; L125-L129 HydrophobicContact CG-CG 4.43Å; L125-L129 WeakPolarHBondContact O-CB 3.36Å; L125-L129 VanDerWaalsContact O-CG 3.26Å; L125-L129 WeakPolarHBondContact O-CG 3.3Å; L125-L129 PolarHBondContact O-N 3.4Å; L125-L139 HydrophobicContact CD2-CD2 4.47Å; L125-L153 HydrophobicContact CD2-CB 4.19Å; L125-L153 HydrophobicContact CD2-CD2 4.43Å; L125-F157 HydrophobicContact CB-CE2 4.42Å; L125-F157 HydrophobicContact CD2-CD2 3.59Å; L125-F157 HydrophobicContact CD2-CE2 3.94Å; L125-F157 HydrophobicContact CD2-CG 4.18Å; L125-F157 HydrophobicContact CG-CD2 4.19Å; L125-F157 HydrophobicContact CG-CE2 4.38Å; L125-F157 HydrophobicContact CG-CG 4.43Å; L125-I159 HydrophobicContact CD1-CD1 4.19Å; L125-I159 HydrophobicContact CD2-CD1 4Å; L125-I159 HydrophobicContact CG-CD1 4.43Å
126	R	96.9	Very high	93.5	Very high	123 Å²	123	54.7 Å²	54.7	46%	0.464	27%	0.269	S	S	.	.	H	α-helix	trans	-57.7	-42.2	173.5	-170.6	-178.4	-56.5	-74	-4	112	G122 P123 R130 F157	G122-R126 WeakPolarHBondContact O-CB 3.39Å; G122-R126 PolarHBondContact O-N 3.35Å; P123-R126 PolarHBondContact O-N 3.33Å; R126-R130 PolarHBondContact O-N 3.03Å; R126-F157 HydrophobicContact CB-CE1 3.73Å; R126-F157 HydrophobicContact CB-CZ 4.22Å; R126-F157 HydrophobicContact CG-CE1 4.21Å
127	H	94.2	Very high	93.9	Very high	81 Å²	81	54.7 Å²	54.7	38%	0.375	27%	0.269	S	S	.	.	H	α-helix	trans	-63.1	-49.7	177.7	-176.9	68.4	0	0	0	111	L31 P123 K124 L125 L129 R130 H131	L31-H127 WeakPolarHBondContact CD1-NE2 3.4Å; P123-H127 PolarHBondContact O-N 2.87Å; K124-H127 WeakPolarHBondContact O-CB 3.35Å; K124-H127 PolarHBondContact O-N 3.46Å; L125-H127 VanDerWaalsContact C-N 3.28Å; L125-H127 PolarHBondContact O-N 2.89Å; H127-L129 VanDerWaalsContact C-N 3.33Å; H127-L129 PolarHBondContact O-N 3.48Å; H127-R130 WeakPolarHBondContact O-CB 3.41Å; H127-R130 PolarHBondContact O-N 3.03Å; H127-R130 VanDerWaalsContact O-N 3.13Å; H127-H131 PolarHBondContact O-CD2 3.24Å
128	L	94.3	Very high	94.4	Very high	3 Å²	3	52.4 Å²	52.4	2%	0.016	25%	0.253	C	S	.	.	H	α-helix	trans	-55.6	-45.4	176.2	177.3	62.6	0	0	0	112.5	L31 L34 I47 I73 L94 I96 K124 L125 R130 H131 V132	L31-L128 HydrophobicContact CD2-CD1 4.05Å; L34-L128 HydrophobicContact CD2-CD1 3.46Å; L34-L128 VanDerWaalsContact CD2-CD1 3.46Å; I47-L128 HydrophobicContact CD1-CD2 3.65Å; I47-L128 HydrophobicContact CG1-CD2 4Å; I73-L128 HydrophobicContact CD1-CD1 3.87Å; I73-L128 HydrophobicContact CD1-CD2 4.23Å; I73-L128 HydrophobicContact CG2-CD2 4.07Å; L94-L128 HydrophobicContact CD2-CD1 4.19Å; I96-L128 HydrophobicContact CD1-CB 4.2Å; I96-L128 HydrophobicContact CD1-CD1 4.3Å; I96-L128 HydrophobicContact CD1-CD2 4.41Å; K124-L128 PolarHBondContact O-N 2.96Å; L125-L128 HydrophobicContact CD1-CD2 4.4Å; L125-L128 PolarHBondContact O-N 3.03Å; L128-R130 PolarHBondContact O-N 2.94Å; L128-R130 VanDerWaalsContact O-N 3.09Å; L128-H131 WeakPolarHBondContact O-CB 3.48Å; L128-H131 PolarHBondContact O-N 3.29Å; L128-V132 HydrophobicContact CG-CG1 4.43Å
129	L	95.4	Very high	94.6	Very high	33 Å²	33	52.2 Å²	52.2	17%	0.173	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-1.3	-178.7	-66.8	173.7	0	0	0	114.6	L125 H127 H131 V132 A134 C137 F157 I159	L125-L129 HydrophobicContact CD1-CD1 4.29Å; L125-L129 HydrophobicContact CD1-CG 4.28Å; L125-L129 HydrophobicContact CG-CD1 4Å; L125-L129 HydrophobicContact CG-CG 4.43Å; L125-L129 WeakPolarHBondContact O-CB 3.36Å; L125-L129 VanDerWaalsContact O-CG 3.26Å; L125-L129 WeakPolarHBondContact O-CG 3.3Å; L125-L129 PolarHBondContact O-N 3.4Å; H127-L129 VanDerWaalsContact C-N 3.33Å; H127-L129 PolarHBondContact O-N 3.48Å; L129-H131 VanDerWaalsContact C-N 3.27Å; L129-V132 CarbonylContact C-O 3.52Å; L129-V132 WeakPolarHBondContact CA-O 3.42Å; L129-V132 HydrophobicContact CD2-CG1 4.45Å; L129-V132 VanDerWaalsContact O-O 3.08Å; L129-A134 HydrophobicContact CD2-CB 4.28Å; L129-C137 HydrophobicContact CD2-CB 4.49Å; L129-F157 HydrophobicContact CD1-CB 3.59Å; L129-F157 HydrophobicContact CD1-CD1 3.7Å; L129-F157 HydrophobicContact CD1-CG 3.82Å; L129-I159 HydrophobicContact CD1-CD1 4.2Å; L129-I159 HydrophobicContact CD1-CG1 4.35Å; L129-I159 HydrophobicContact CD2-CD1 4.49Å
130	R	94.1	Very high	94.9	Very high	174 Å²	174	46 Å²	46	66%	0.657	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-17.9	165.2	-66.1	174.4	-178.9	169.1	0.2	112.5	R126 H127 L128	R126-R130 PolarHBondContact O-N 3.03Å; H127-R130 WeakPolarHBondContact O-CB 3.41Å; H127-R130 PolarHBondContact O-N 3.03Å; H127-R130 VanDerWaalsContact O-N 3.13Å; L128-R130 PolarHBondContact O-N 2.94Å; L128-R130 VanDerWaalsContact O-N 3.09Å
131	H	92.9	Very high	95	Very high	43 Å²	43	43.5 Å²	43.5	20%	0.199	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.5	-22.5	-175.1	-62.5	-98.5	0	0	0	113.1	L31 L34 R35 H127 L128 L129	L31-H131 PolarHBondContact O-ND1 3.46Å; L34-H131 HydrophobicContact CD2-CB 4.33Å; R35-H131 HydrophobicContact CB-CB 4.21Å; H127-H131 PolarHBondContact O-CD2 3.24Å; L128-H131 WeakPolarHBondContact O-CB 3.48Å; L128-H131 PolarHBondContact O-N 3.29Å; L129-H131 VanDerWaalsContact C-N 3.27Å
132	V	92.1	Very high	94.9	Very high	5 Å²	5	44 Å²	44	3%	0.03	22%	0.218	C	C	.	.	S	Bend	trans	-136.2	140.3	178.7	57.5	0	0	0	0	109.9	L34 A38 C45 L128 L129 Q136 C137	L34-V132 HydrophobicContact CD2-CG1 4.47Å; A38-V132 HydrophobicContact CB-CB 4.36Å; A38-V132 HydrophobicContact CB-CG2 4.28Å; C45-V132 HydrophobicContact CB-CG2 4.48Å; L128-V132 HydrophobicContact CG-CG1 4.43Å; L129-V132 CarbonylContact C-O 3.52Å; L129-V132 WeakPolarHBondContact CA-O 3.42Å; L129-V132 HydrophobicContact CD2-CG1 4.45Å; L129-V132 VanDerWaalsContact O-O 3.08Å; V132-Q136 HydrophobicContact CG2-CB 3.9Å; V132-C137 VanDerWaalsContact CG1-SG 3.54Å
133	Q	92.8	Very high	94.6	Very high	128 Å²	128	43.8 Å²	43.8	60%	0.598	22%	0.215	S	C	*	.			trans	-68.9	141.1	178.8	-57.6	-175.4	25.4	0	0	110.2	S135 Q136	Q133-S135 PolarHBondContact O-N 2.71Å; Q133-S135 VanDerWaalsContact O-N 3.15Å; Q133-Q136 HydrophobicContact CB-CG 4.24Å; Q133-Q136 WeakPolarHBondContact O-CB 3.26Å; Q133-Q136 PolarHBondContact O-N 3.11Å
134	A	95.1	Very high	94.4	Very high	23 Å²	23	41.2 Å²	41.2	19%	0.19	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-57.4	-32.7	179.1	0	0	0	0	0	112.9	L129 Q136 C137 F157 K158 I159 P160	L129-A134 HydrophobicContact CD2-CB 4.28Å; A134-Q136 PolarHBondContact O-N 2.94Å; A134-C137 WeakPolarHBondContact O-CB 3.29Å; A134-C137 PolarHBondContact O-N 3.39Å; A134-C137 VanDerWaalsContact O-N 3.09Å; A134-F157 VanDerWaalsContact CB-O 3.29Å; A134-F157 WeakPolarHBondContact CB-O 3.45Å; A134-K158 WeakPolarHBondContact CB-O 3.18Å; A134-I159 HydrophobicContact CB-CG1 4.13Å; A134-P160 WeakPolarHBondContact O-CD 3.41Å
135	S	93.7	Very high	94.2	Very high	81 Å²	81	37.8 Å²	37.8	57%	0.566	18%	0.182	S	C	*	.	G	3₁₀ helix	trans	-64.4	-19.9	175	52.6	0	0	0	0	114.3	Q133	Q133-S135 PolarHBondContact O-N 2.71Å; Q133-S135 VanDerWaalsContact O-N 3.15Å
136	Q	92.3	Very high	94.1	Very high	32 Å²	32	37.8 Å²	37.8	15%	0.15	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-95.1	-1.1	176.4	-62	174.2	-64	0	0	112.1	A38 S43 R44 C45 V132 Q133 A134	A38-Q136 PolarHBondContact O-NE2 3.27Å; S43-Q136 PolarHBondContact O-NE2 3.37Å; R44-Q136 CarbonylContact C-O 3.56Å; R44-Q136 WeakPolarHBondContact CA-O 3.46Å; C45-Q136 PolarHBondContact N-O 3.37Å; V132-Q136 HydrophobicContact CG2-CB 3.9Å; Q133-Q136 HydrophobicContact CB-CG 4.24Å; Q133-Q136 WeakPolarHBondContact O-CB 3.26Å; Q133-Q136 PolarHBondContact O-N 3.11Å; A134-Q136 PolarHBondContact O-N 2.94Å
137	C	94.5	Very high	94	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.014	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	148.6	-178.3	-64	0	0	0	0	111.7	C45 I47 L129 V132 A134 I159	C45-C137 CarbonylContact O-C 3.5Å; C45-C137 WeakPolarHBondContact O-CA 3.37Å; I47-C137 HydrophobicContact CD1-CB 4.02Å; L129-C137 HydrophobicContact CD2-CB 4.49Å; V132-C137 VanDerWaalsContact CG1-SG 3.54Å; A134-C137 WeakPolarHBondContact O-CB 3.29Å; A134-C137 PolarHBondContact O-N 3.39Å; A134-C137 VanDerWaalsContact O-N 3.09Å; C137-I159 HydrophobicContact CB-CG2 4.02Å; C137-I159 WeakPolarHBondContact O-CG2 3.37Å
138	S	95	Very high	94	Very high	15 Å²	15	30.1 Å²	30.1	11%	0.105	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	130	162.6	-68.2	0	0	0	0	108.3	C45 I47 Q385 Y386	C45-S138 PolarHBondContact O-N 3.01Å; I47-S138 PolarHBondContact N-O 3.18Å; S138-Q385 PolarHBondContact OG-OE1 2.84Å; S138-Y386 WeakPolarHBondContact CB-OH 3.18Å; S138-Y386 PolarHBondContact N-OH 3.24Å; S138-Y386 PolarHBondContact OG-OH 3.21Å
139	L	96.6	Very high	94.1	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	117.7	174.4	177.4	62.1	0	0	0	109.1	I47 L49 L125 A150 L153 R154 I159	I47-L139 HydrophobicContact CB-CD1 4.06Å; I47-L139 HydrophobicContact CG2-CD1 3.72Å; I47-L139 WeakPolarHBondContact O-CA 3.43Å; L49-L139 HydrophobicContact CB-CD1 4.02Å; L125-L139 HydrophobicContact CD2-CD2 4.47Å; L139-A150 HydrophobicContact CD2-CB 4.05Å; L139-A150 HydrophobicContact CG-CB 4.21Å; L139-L153 HydrophobicContact CD2-CB 3.68Å; L139-L153 HydrophobicContact CD2-CD1 4.08Å; L139-R154 HydrophobicContact CB-CG 4.17Å; L139-R154 HydrophobicContact CD2-CG 4.31Å; L139-R154 PolarHBondContact O-NE 3.11Å; L139-R154 VanDerWaalsContact O-NE 3.11Å; L139-R154 PolarHBondContact O-NH2 3.26Å; L139-I159 HydrophobicContact CB-CD1 4.37Å; L139-I159 HydrophobicContact CB-CG2 4.32Å
140	V	96.4	Very high	94.2	Very high	9 Å²	9	29.2 Å²	29.2	6%	0.055	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	157.8	-179.8	-57.5	0	0	0	0	111.5	L46 I47 V48 L49 L382 Q385	L46-V140 HydrophobicContact CD1-CB 4.28Å; L46-V140 HydrophobicContact CD1-CG1 3.69Å; L46-V140 HydrophobicContact CD1-CG2 3.58Å; L46-V140 HydrophobicContact CG-CG2 4.23Å; I47-V140 PolarHBondContact O-N 3.4Å; V48-V140 HydrophobicContact CB-CG2 4.32Å; V48-V140 HydrophobicContact CG2-CG2 3.78Å; L49-V140 PolarHBondContact N-O 3.13Å; V140-L382 HydrophobicContact CG2-CB 4.48Å; V140-L382 HydrophobicContact CG2-CD2 3.78Å; V140-Q385 HydrophobicContact CG1-CG 4.47Å
141	V	96.1	Very high	94.3	Very high	9 Å²	9	20.9 Å²	20.9	6%	0.055	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	157.5	178.1	-67.1	0	0	0	0	109.1	L49 L146 V147 A150 H381	L49-V141 HydrophobicContact CB-CG1 3.92Å; L49-V141 HydrophobicContact CD2-CG1 4.29Å; L49-V141 HydrophobicContact CG-CG1 4.36Å; V141-L146 HydrophobicContact CB-CB 3.77Å; V141-L146 HydrophobicContact CG1-CB 3.45Å; V141-L146 VanDerWaalsContact CG1-CB 3.45Å; V141-L146 HydrophobicContact CG1-CD1 4.31Å; V141-L146 HydrophobicContact CG2-CB 4.21Å; V141-V147 HydrophobicContact CG2-CB 4.47Å; V141-V147 HydrophobicContact CG2-CG2 3.96Å; V141-A150 HydrophobicContact CG1-CB 3.74Å; V141-A150 HydrophobicContact CG2-CB 4.43Å; V141-H381 PolarHBondContact O-NE2 2.59Å
142	S	94.5	Very high	94.5	Very high	9 Å²	9	21.8 Å²	21.8	6%	0.063	12%	0.117	C	C	.	.	S	Bend	trans	-113	-9	172.3	73.1	0	0	0	0	113.4	K50 L360	K50-S142 VanDerWaalsContact CE-OG 3.24Å; K50-S142 WeakPolarHBondContact CE-OG 3.33Å; K50-S142 PolarHBondContact NZ-OG 3.32Å; S142-L360 PolarHBondContact O-N 3.24Å
143	E	91.5	Very high	94.8	Very high	5 Å²	5	21.6 Å²	21.6	2%	0.023	12%	0.116	C	C	.	.	S	Bend	trans	-109.4	137.3	-172.2	-51.8	-175.5	-131.4	0	0	110.5	K50 A51 R52 K53 P145 L146	K50-E143 HydrophobicContact CD-CG 4.47Å; A51-E143 PolarHBondContact N-OE1 3.25Å; R52-E143 PolarHBondContact N-OE1 2.89Å; R52-E143 VanDerWaalsContact N-OE1 3.15Å; K53-E143 HydrophobicContact CB-CG 4.12Å; K53-E143 WeakPolarHBondContact CB-OE2 3.32Å; K53-E143 HydrophobicContact CD-CG 4.45Å; K53-E143 WeakPolarHBondContact CG-OE2 3.39Å; K53-E143 VanDerWaalsContact N-CD 3.32Å; K53-E143 PolarHBondContact N-OE1 3.17Å; K53-E143 PolarHBondContact N-OE2 2.8Å; K53-E143 VanDerWaalsContact N-OE2 3.09Å; E143-P145 VanDerWaalsContact C-CD 3.49Å; E143-L146 HydrophobicContact CB-CD1 4.05Å; E143-L146 HydrophobicContact CB-CG 4.22Å; E143-L146 HydrophobicContact CG-CD1 4.27Å; E143-L146 PolarHBondContact O-N 2.84Å
144	E	91.8	Very high	95.1	Very high	16 Å²	16	16.3 Å²	16.3	8%	0.075	9%	0.09	C	C	.	.	H	α-helix	trans	-54.3	-46.3	-177.1	-146.7	170.5	142.9	0	0	114	L113 L146 V147 C233 R359	L113-E144 HydrophobicContact CD1-CG 4.12Å; L113-E144 HydrophobicContact CD2-CB 4.5Å; E144-L146 PolarHBondContact O-N 2.82Å; E144-V147 WeakPolarHBondContact O-CB 3.41Å; E144-V147 WeakPolarHBondContact O-CG2 3.38Å; E144-V147 PolarHBondContact O-N 3.21Å; E144-C233 HydrophobicContact CB-CB 4.42Å; E144-C233 HydrophobicContact CG-CB 4.22Å; E144-C233 WeakPolarHBondContact OE1-CB 3.38Å; E144-C233 WeakPolarHBondContact OE2-CB 3.35Å; E144-R359 HydrophobicContact CB-CG 4.24Å; E144-R359 HydrophobicContact CG-CG 4.22Å; E144-R359 IonicContact OE2-CZ 3.7Å; E144-R359 IonicContact OE2-NE 3.92Å; E144-R359 PolarHBondContact OE2-NE 3.02Å; E144-R359 IonicContact OE2-NH2 3.57Å; E144-R359 PolarHBondContact OE2-NH2 3Å
145	P	90.8	Very high	95.2	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.006	10%	0.101	C	C	.	.	H	α-helix	trans	-61.3	-20.6	179.9	-22.3	34.2	0	0	0	114.3	W110 L113 V116 E143	W110-P145 HydrophobicContact CD2-CG 3.5Å; W110-P145 VanDerWaalsContact CD2-CG 3.5Å; W110-P145 HydrophobicContact CE3-CG 3.15Å; W110-P145 HydrophobicContact CG-CG 4.28Å; W110-P145 HydrophobicContact CH2-CG 3.6Å; W110-P145 HydrophobicContact CZ2-CG 3.95Å; W110-P145 VanDerWaalsContact CZ3-CD 3.47Å; W110-P145 HydrophobicContact CZ3-CG 3.2Å; L113-P145 HydrophobicContact CD2-CB 3.88Å; L113-P145 HydrophobicContact CD2-CG 3.84Å; V116-P145 WeakPolarHBondContact CB-O 3.2Å; V116-P145 HydrophobicContact CG1-CB 4.32Å; V116-P145 WeakPolarHBondContact CG1-O 3.11Å; V116-P145 HydrophobicContact CG2-CB 3.86Å; E143-P145 VanDerWaalsContact C-CD 3.49Å
146	L	94.1	Very high	95.4	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-92.1	-11.5	-177.8	-56.6	177.4	0	0	0	112.3	L49 A51 Y118 V141 E143 E144 Y149 A150	L49-L146 HydrophobicContact CD2-CD2 4.44Å; L49-L146 HydrophobicContact CG-CD1 4.3Å; L49-L146 WeakPolarHBondContact O-CD1 3.46Å; A51-L146 HydrophobicContact CB-CD1 4.07Å; A51-L146 HydrophobicContact CB-CD2 3.89Å; A51-L146 HydrophobicContact CB-CG 4.49Å; Y118-L146 HydrophobicContact CD2-CD2 4.13Å; Y118-L146 HydrophobicContact CE2-CD2 3.45Å; Y118-L146 VanDerWaalsContact CE2-CD2 3.45Å; V141-L146 HydrophobicContact CB-CB 3.77Å; V141-L146 HydrophobicContact CG1-CB 3.45Å; V141-L146 VanDerWaalsContact CG1-CB 3.45Å; V141-L146 HydrophobicContact CG1-CD1 4.31Å; V141-L146 HydrophobicContact CG2-CB 4.21Å; E143-L146 HydrophobicContact CB-CD1 4.05Å; E143-L146 HydrophobicContact CB-CG 4.22Å; E143-L146 HydrophobicContact CG-CD1 4.27Å; E143-L146 PolarHBondContact O-N 2.84Å; E144-L146 PolarHBondContact O-N 2.82Å; L146-Y149 HydrophobicContact CD2-CD1 4.32Å; L146-Y149 PolarHBondContact O-N 3.01Å; L146-A150 WeakPolarHBondContact O-CB 3.21Å; L146-A150 PolarHBondContact O-N 2.93Å
147	V	95.4	Very high	95.7	Very high	6 Å²	6	21.6 Å²	21.6	4%	0.036	10%	0.097	C	C	.	.	H	α-helix	trans	-62.9	-55	-174.6	178.3	0	0	0	0	110.8	V141 E144 A151 I167 T171 I358 R359	V141-V147 HydrophobicContact CG2-CB 4.47Å; V141-V147 HydrophobicContact CG2-CG2 3.96Å; E144-V147 WeakPolarHBondContact O-CB 3.41Å; E144-V147 WeakPolarHBondContact O-CG2 3.38Å; E144-V147 PolarHBondContact O-N 3.21Å; V147-A151 PolarHBondContact O-N 2.84Å; V147-I167 HydrophobicContact CG1-CD1 4.16Å; V147-I167 HydrophobicContact CG1-CG2 3.66Å; V147-T171 HydrophobicContact CB-CG2 4.13Å; V147-T171 HydrophobicContact CG1-CG2 3.95Å; V147-I358 HydrophobicContact CG1-CD1 3.74Å; V147-I358 HydrophobicContact CG1-CG1 3.73Å; V147-R359 HydrophobicContact CG2-CB 4.26Å
148	Y	95.5	Very high	95.8	Very high	37 Å²	37	30 Å²	30	15%	0.145	13%	0.133	C	C	.	.	H	α-helix	trans	-68.6	-38.2	177.3	-170.8	-98.8	0	0	0	111.9	T114 A150 A151 K152 P164 I167 L168	T114-Y148 HydrophobicContact CG2-CD1 4.23Å; T114-Y148 HydrophobicContact CG2-CE1 4.18Å; T114-Y148 HydrophobicContact CG2-CG 4.48Å; Y148-A150 PolarHBondContact O-N 2.86Å; Y148-A151 WeakPolarHBondContact O-CB 3.46Å; Y148-A151 PolarHBondContact O-N 2.89Å; Y148-K152 HydrophobicContact CD1-CD 4.07Å; Y148-K152 HydrophobicContact CD1-CG 4.2Å; Y148-K152 HydrophobicContact CE1-CD 3.71Å; Y148-K152 HydrophobicContact CE1-CG 3.93Å; Y148-K152 PolarHBondContact O-N 2.92Å; Y148-P164 HydrophobicContact CE2-CB 3.8Å; Y148-I167 HydrophobicContact CD2-CG2 4.1Å; Y148-L168 HydrophobicContact CD2-CD2 4.1Å; Y148-L168 HydrophobicContact CE2-CD2 3.57Å; Y148-L168 HydrophobicContact CE2-CG 3.98Å
149	Y	95.5	Very high	95.9	Very high	16 Å²	16	29.4 Å²	29.4	6%	0.063	13%	0.129	C	C	.	.	H	α-helix	trans	-61.7	-44.1	176.7	-176.9	-132.1	0	0	0	112.6	L49 V116 Y118 V121 L146 A151 K152 L153	L49-Y149 HydrophobicContact CD2-CD1 4.08Å; L49-Y149 HydrophobicContact CD2-CE1 4.27Å; V116-Y149 VanDerWaalsContact O-CD2 3.31Å; V116-Y149 WeakPolarHBondContact O-CD2 3.28Å; Y118-Y149 AromaticContact CD2-CD1 4Å; Y118-Y149 HydrophobicContact CD2-CD1 4Å; Y118-Y149 AromaticContact CD2-CE1 3.73Å; Y118-Y149 HydrophobicContact CD2-CE1 3.73Å; Y118-Y149 HydrophobicContact CG-CE1 4.48Å; Y118-Y149 PolarHBondContact N-OH 3.05Å; Y118-Y149 PolarHBondContact O-OH 2.99Å; V121-Y149 HydrophobicContact CB-CE1 4.15Å; V121-Y149 HydrophobicContact CG1-CE1 3.95Å; V121-Y149 HydrophobicContact CG2-CE1 4.43Å; L146-Y149 HydrophobicContact CD2-CD1 4.32Å; L146-Y149 PolarHBondContact O-N 3.01Å; Y149-A151 VanDerWaalsContact C-N 3.27Å; Y149-A151 PolarHBondContact O-N 3.43Å; Y149-K152 WeakPolarHBondContact O-CB 3.38Å; Y149-K152 PolarHBondContact O-N 3.03Å; Y149-K152 VanDerWaalsContact O-N 3.13Å; Y149-L153 HydrophobicContact CD1-CD1 4.08Å; Y149-L153 HydrophobicContact CD2-CG 4.43Å; Y149-L153 HydrophobicContact CE1-CD1 3.77Å; Y149-L153 HydrophobicContact CE1-CG 4.44Å; Y149-L153 HydrophobicContact CE2-CD1 4.31Å; Y149-L153 HydrophobicContact CE2-CD2 4.17Å; Y149-L153 HydrophobicContact CE2-CG 4.09Å; Y149-L153 HydrophobicContact CG-CD1 4.5Å; Y149-L153 WeakPolarHBondContact O-CG 3.08Å; Y149-L153 PolarHBondContact O-N 3.33Å
150	A	96.8	Very high	95.8	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.3	-37	174.8	0	0	0	0	0	111.7	L139 V141 L146 Y148 L153 R154	L139-A150 HydrophobicContact CD2-CB 4.05Å; L139-A150 HydrophobicContact CG-CB 4.21Å; V141-A150 HydrophobicContact CG1-CB 3.74Å; V141-A150 HydrophobicContact CG2-CB 4.43Å; L146-A150 WeakPolarHBondContact O-CB 3.21Å; L146-A150 PolarHBondContact O-N 2.93Å; Y148-A150 PolarHBondContact O-N 2.86Å; A150-L153 PolarHBondContact O-N 3.24Å; A150-R154 WeakPolarHBondContact O-CG 3.47Å; A150-R154 PolarHBondContact O-N 3.43Å
151	A	97.3	Very high	95.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.8	-43.6	173.7	0	0	0	0	0	111.9	V147 Y148 Y149 L153 R154 R155 P164 I167	V147-A151 PolarHBondContact O-N 2.84Å; Y148-A151 WeakPolarHBondContact O-CB 3.46Å; Y148-A151 PolarHBondContact O-N 2.89Å; Y149-A151 VanDerWaalsContact C-N 3.27Å; Y149-A151 PolarHBondContact O-N 3.43Å; A151-L153 VanDerWaalsContact C-N 3.31Å; A151-L153 PolarHBondContact O-N 3.02Å; A151-R154 PolarHBondContact O-N 2.92Å; A151-R155 PolarHBondContact O-N 2.85Å; A151-P164 HydrophobicContact CB-CB 4.41Å; A151-P164 HydrophobicContact CB-CG 3.93Å; A151-P164 WeakPolarHBondContact O-CD 3.35Å; A151-I167 HydrophobicContact CB-CB 4.27Å; A151-I167 HydrophobicContact CB-CG1 3.75Å
152	K	97.5	Very high	95.6	Very high	62 Å²	62	34.4 Å²	34.4	27%	0.27	17%	0.17	S	C	.	.	H	α-helix	trans	-58.9	-43.3	174.1	-69.8	-173.7	-65	-170.9	0	111.1	T114 V116 Y148 Y149 R155 Q156 P164	T114-K152 PolarHBondContact O-NZ 2.82Å; V116-K152 PolarHBondContact O-NZ 2.89Å; Y148-K152 HydrophobicContact CD1-CD 4.07Å; Y148-K152 HydrophobicContact CD1-CG 4.2Å; Y148-K152 HydrophobicContact CE1-CD 3.71Å; Y148-K152 HydrophobicContact CE1-CG 3.93Å; Y148-K152 PolarHBondContact O-N 2.92Å; Y149-K152 WeakPolarHBondContact O-CB 3.38Å; Y149-K152 PolarHBondContact O-N 3.03Å; Y149-K152 VanDerWaalsContact O-N 3.13Å; K152-R155 PolarHBondContact O-N 2.77Å; K152-Q156 VanDerWaalsContact O-CB 3.3Å; K152-Q156 WeakPolarHBondContact O-CB 3.27Å; K152-Q156 PolarHBondContact O-N 3.1Å; K152-P164 HydrophobicContact CG-CG 4.23Å
153	L	97.9	Very high	95.7	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-64.6	-43.5	176.4	-66.9	170.9	0	0	0	111.9	L49 V121 L125 L139 Y149 A150 A151 R155 Q156 F157	L49-L153 HydrophobicContact CD2-CD1 3.98Å; V121-L153 HydrophobicContact CG1-CD1 3.57Å; V121-L153 HydrophobicContact CG1-CD2 4.35Å; L125-L153 HydrophobicContact CD2-CB 4.19Å; L125-L153 HydrophobicContact CD2-CD2 4.43Å; L139-L153 HydrophobicContact CD2-CB 3.68Å; L139-L153 HydrophobicContact CD2-CD1 4.08Å; Y149-L153 HydrophobicContact CD1-CD1 4.08Å; Y149-L153 HydrophobicContact CD2-CG 4.43Å; Y149-L153 HydrophobicContact CE1-CD1 3.77Å; Y149-L153 HydrophobicContact CE1-CG 4.44Å; Y149-L153 HydrophobicContact CE2-CD1 4.31Å; Y149-L153 HydrophobicContact CE2-CD2 4.17Å; Y149-L153 HydrophobicContact CE2-CG 4.09Å; Y149-L153 HydrophobicContact CG-CD1 4.5Å; Y149-L153 WeakPolarHBondContact O-CG 3.08Å; Y149-L153 PolarHBondContact O-N 3.33Å; A150-L153 PolarHBondContact O-N 3.24Å; A151-L153 VanDerWaalsContact C-N 3.31Å; A151-L153 PolarHBondContact O-N 3.02Å; L153-R155 PolarHBondContact O-N 3.04Å; L153-Q156 PolarHBondContact O-N 3.2Å; L153-F157 HydrophobicContact CB-CD2 4.45Å; L153-F157 HydrophobicContact CD2-CD2 4.25Å; L153-F157 HydrophobicContact CD2-CE2 3.86Å; L153-F157 WeakPolarHBondContact O-CB 3.44Å; L153-F157 WeakPolarHBondContact O-CD2 3.48Å; L153-F157 PolarHBondContact O-N 3.22Å
154	R	98	Very high	95.9	Very high	16 Å²	16	36.6 Å²	36.6	6%	0.06	18%	0.18	C	C	.	.	H	α-helix	trans	-56.2	-49.4	175.1	-74.4	-176.9	-152.5	112.6	3	111.4	L139 A150 A151 F157 K158 I159 A162	L139-R154 HydrophobicContact CB-CG 4.17Å; L139-R154 HydrophobicContact CD2-CG 4.31Å; L139-R154 PolarHBondContact O-NE 3.11Å; L139-R154 VanDerWaalsContact O-NE 3.11Å; L139-R154 PolarHBondContact O-NH2 3.26Å; A150-R154 WeakPolarHBondContact O-CG 3.47Å; A150-R154 PolarHBondContact O-N 3.43Å; A151-R154 PolarHBondContact O-N 2.92Å; R154-F157 PolarHBondContact O-N 3.07Å; R154-K158 CarbonylContact O-C 3.49Å; R154-K158 VanDerWaalsContact O-CA 3.3Å; R154-K158 WeakPolarHBondContact O-CA 3.33Å; R154-K158 PolarHBondContact O-N 3.5Å; R154-I159 HydrophobicContact CB-CB 4.44Å; R154-I159 WeakPolarHBondContact CB-O 3.49Å; R154-I159 HydrophobicContact CG-CB 4.2Å; R154-I159 HydrophobicContact CG-CG2 4.37Å; R154-I159 PolarHBondContact O-N 3.46Å; R154-A162 PolarHBondContact NH1-O 3.48Å
155	R	97.8	Very high	96.1	Very high	112 Å²	112	40.9 Å²	40.9	42%	0.423	20%	0.203	S	C	.	.	H	α-helix	trans	-58.8	-50.7	175.8	-174.5	-179.3	-74.8	168.9	-5.7	111.5	A151 K152 L153 F157 K158 P164 D165	A151-R155 PolarHBondContact O-N 2.85Å; K152-R155 PolarHBondContact O-N 2.77Å; L153-R155 PolarHBondContact O-N 3.04Å; R155-F157 VanDerWaalsContact C-N 3.34Å; R155-F157 PolarHBondContact O-N 2.84Å; R155-K158 PolarHBondContact O-N 3.01Å; R155-P164 HydrophobicContact CB-CG 4.4Å; R155-P164 VanDerWaalsContact CZ-CD 3.47Å; R155-P164 VanDerWaalsContact CZ-CG 3.49Å; R155-D165 IonicContact CZ-OD1 3.84Å; R155-D165 IonicContact NH1-OD1 3.6Å; R155-D165 IonicContact NH2-OD1 2.64Å; R155-D165 PolarHBondContact NH2-OD1 3.23Å; R155-D165 IonicContact NH2-OD2 3.61Å; R155-D165 PolarHBondContact NH2-OD2 3.26Å
156	Q	97.8	Very high	96.3	Very high	115 Å²	115	43.7 Å²	43.7	54%	0.537	22%	0.218	S	C	.	.	H	α-helix	trans	-60.8	-40.3	-177.6	-177.9	-178.9	8.2	0	0	112.9	K152 L153	K152-Q156 VanDerWaalsContact O-CB 3.3Å; K152-Q156 WeakPolarHBondContact O-CB 3.27Å; K152-Q156 PolarHBondContact O-N 3.1Å; L153-Q156 PolarHBondContact O-N 3.2Å
157	F	98	Very high	96.4	Very high	20 Å²	20	43.8 Å²	43.8	9%	0.088	22%	0.219	C	C	.	.	H	α-helix	trans	-102.8	5.4	-174.2	-69.7	-74.4	0	0	0	114	G122 L125 R126 L129 A134 L153 R154 R155 I159	G122-F157 WeakPolarHBondContact O-CZ 3.41Å; L125-F157 HydrophobicContact CB-CE2 4.42Å; L125-F157 HydrophobicContact CD2-CD2 3.59Å; L125-F157 HydrophobicContact CD2-CE2 3.94Å; L125-F157 HydrophobicContact CD2-CG 4.18Å; L125-F157 HydrophobicContact CG-CD2 4.19Å; L125-F157 HydrophobicContact CG-CE2 4.38Å; L125-F157 HydrophobicContact CG-CG 4.43Å; R126-F157 HydrophobicContact CB-CE1 3.73Å; R126-F157 HydrophobicContact CB-CZ 4.22Å; R126-F157 HydrophobicContact CG-CE1 4.21Å; L129-F157 HydrophobicContact CD1-CB 3.59Å; L129-F157 HydrophobicContact CD1-CD1 3.7Å; L129-F157 HydrophobicContact CD1-CG 3.82Å; A134-F157 VanDerWaalsContact CB-O 3.29Å; A134-F157 WeakPolarHBondContact CB-O 3.45Å; L153-F157 HydrophobicContact CB-CD2 4.45Å; L153-F157 HydrophobicContact CD2-CD2 4.25Å; L153-F157 HydrophobicContact CD2-CE2 3.86Å; L153-F157 WeakPolarHBondContact O-CB 3.44Å; L153-F157 WeakPolarHBondContact O-CD2 3.48Å; L153-F157 PolarHBondContact O-N 3.22Å; R154-F157 PolarHBondContact O-N 3.07Å; R155-F157 VanDerWaalsContact C-N 3.34Å; R155-F157 PolarHBondContact O-N 2.84Å; F157-I159 HydrophobicContact CB-CD1 4.2Å; F157-I159 HydrophobicContact CB-CG1 4.06Å; F157-I159 PolarHBondContact O-N 3.22Å
158	K	97.6	Very high	96.4	Very high	179 Å²	179	45.6 Å²	45.6	78%	0.778	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	34.5	-176.6	-52.8	-178	-180	-177.3	0	113.2	A134 R154 R155	A134-K158 WeakPolarHBondContact CB-O 3.18Å; R154-K158 CarbonylContact O-C 3.49Å; R154-K158 VanDerWaalsContact O-CA 3.3Å; R154-K158 WeakPolarHBondContact O-CA 3.33Å; R154-K158 PolarHBondContact O-N 3.5Å; R155-K158 PolarHBondContact O-N 3.01Å
159	I	96.7	Very high	96.4	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	23%	0.227	C	C	.	.			trans	-79.4	129.9	172.1	-58.3	172.1	0	0	0	107.6	L125 L129 A134 C137 L139 R154 F157	L125-I159 HydrophobicContact CD1-CD1 4.19Å; L125-I159 HydrophobicContact CD2-CD1 4Å; L125-I159 HydrophobicContact CG-CD1 4.43Å; L129-I159 HydrophobicContact CD1-CD1 4.2Å; L129-I159 HydrophobicContact CD1-CG1 4.35Å; L129-I159 HydrophobicContact CD2-CD1 4.49Å; A134-I159 HydrophobicContact CB-CG1 4.13Å; C137-I159 HydrophobicContact CB-CG2 4.02Å; C137-I159 WeakPolarHBondContact O-CG2 3.37Å; L139-I159 HydrophobicContact CB-CD1 4.37Å; L139-I159 HydrophobicContact CB-CG2 4.32Å; R154-I159 HydrophobicContact CB-CB 4.44Å; R154-I159 WeakPolarHBondContact CB-O 3.49Å; R154-I159 HydrophobicContact CG-CB 4.2Å; R154-I159 HydrophobicContact CG-CG2 4.37Å; R154-I159 PolarHBondContact O-N 3.46Å; F157-I159 HydrophobicContact CB-CD1 4.2Å; F157-I159 HydrophobicContact CB-CG1 4.06Å; F157-I159 PolarHBondContact O-N 3.22Å
160	P	94.7	Very high	96.5	Very high	65 Å²	65	44.9 Å²	44.9	42%	0.422	23%	0.225	S	C	.	.	S	Bend	trans	-54.8	150.4	176.1	-26.6	34.9	0	0	0	113.7	A134	A134-P160 WeakPolarHBondContact O-CD 3.41Å
161	G	94.3	Very high	96.4	Very high	39 Å²	39	45 Å²	45	40%	0.402	23%	0.226	S	C	.	.	S	Bend	trans	131.3	-176.6	175.7	0	0	0	0	0	113.2	Q163	G161-Q163 PolarHBondContact O-N 3.02Å; G161-Q163 PolarHBondContact O-NE2 2.8Å
162	A	94.2	Very high	96.3	Very high	20 Å²	20	45.7 Å²	45.7	17%	0.165	23%	0.229	C	C	.	.			trans	-60.2	132.9	-176.7	0	0	0	0	0	112.3	R154 D166 I167 P335	R154-A162 PolarHBondContact NH1-O 3.48Å; A162-D166 HydrophobicContact CB-CB 4.48Å; A162-I167 HydrophobicContact CB-CD1 3.7Å; A162-I167 HydrophobicContact CB-CG1 4.04Å; A162-P335 HydrophobicContact CB-CG 3.79Å
163	Q	96.2	Very high	96.2	Very high	60 Å²	60	43.2 Å²	43.2	28%	0.28	22%	0.218	S	C	.	.			trans	-88.2	160.2	-176.9	-60.2	-58.6	-50.4	0	0	110.9	G161 D165 D166 I167	G161-Q163 PolarHBondContact O-N 3.02Å; G161-Q163 PolarHBondContact O-NE2 2.8Å; Q163-D165 PolarHBondContact O-N 2.89Å; Q163-D165 VanDerWaalsContact O-N 3.13Å; Q163-D166 PolarHBondContact N-OD2 3.2Å; Q163-D166 WeakPolarHBondContact O-CB 3.29Å; Q163-D166 PolarHBondContact O-N 3.05Å; Q163-I167 VanDerWaalsContact O-CG1 3.28Å; Q163-I167 WeakPolarHBondContact O-CG1 3.45Å; Q163-I167 PolarHBondContact O-N 3.34Å
164	P	96.2	Very high	96	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-47.2	-42.8	178.4	-32.3	34.9	0	0	0	114.3	Y148 A151 K152 R155 D166 I167 L168	Y148-P164 HydrophobicContact CE2-CB 3.8Å; A151-P164 HydrophobicContact CB-CB 4.41Å; A151-P164 HydrophobicContact CB-CG 3.93Å; A151-P164 WeakPolarHBondContact O-CD 3.35Å; K152-P164 HydrophobicContact CG-CG 4.23Å; R155-P164 HydrophobicContact CB-CG 4.4Å; R155-P164 VanDerWaalsContact CZ-CD 3.47Å; R155-P164 VanDerWaalsContact CZ-CG 3.49Å; P164-D166 VanDerWaalsContact C-N 3.33Å; P164-D166 PolarHBondContact O-N 2.99Å; P164-I167 PolarHBondContact O-N 3.47Å; P164-I167 VanDerWaalsContact O-N 3.08Å; P164-L168 WeakPolarHBondContact O-CG 3.31Å; P164-L168 PolarHBondContact O-N 3.48Å; P164-L168 VanDerWaalsContact O-N 3.14Å
165	D	95.8	Very high	95.9	Very high	107 Å²	107	44 Å²	44	57%	0.572	23%	0.226	S	C	*	.	H	α-helix	trans	-68.1	-34.8	-176.9	-48.4	-13.3	0	0	0	111.5	R155 Q163 I167	R155-D165 IonicContact CZ-OD1 3.84Å; R155-D165 IonicContact NH1-OD1 3.6Å; R155-D165 IonicContact NH2-OD1 2.64Å; R155-D165 PolarHBondContact NH2-OD1 3.23Å; R155-D165 IonicContact NH2-OD2 3.61Å; R155-D165 PolarHBondContact NH2-OD2 3.26Å; Q163-D165 PolarHBondContact O-N 2.89Å; Q163-D165 VanDerWaalsContact O-N 3.13Å; D165-I167 VanDerWaalsContact C-N 3.31Å
166	D	94.8	Very high	95.9	Very high	60 Å²	60	38.9 Å²	38.9	32%	0.321	21%	0.208	S	C	.	.	H	α-helix	trans	-69.4	-30.8	172.6	-60.5	-55.5	0	0	0	112.4	A162 Q163 P164 R169 F170	A162-D166 HydrophobicContact CB-CB 4.48Å; Q163-D166 PolarHBondContact N-OD2 3.2Å; Q163-D166 WeakPolarHBondContact O-CB 3.29Å; Q163-D166 PolarHBondContact O-N 3.05Å; P164-D166 VanDerWaalsContact C-N 3.33Å; P164-D166 PolarHBondContact O-N 2.99Å; D166-R169 WeakPolarHBondContact O-CG 3.4Å; D166-R169 IonicContact OD1-NH1 3.73Å; D166-F170 WeakPolarHBondContact O-CE2 3.47Å
167	I	96.2	Very high	95.8	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-79.8	-25.3	-174.5	-67.5	-71.4	0	0	0	111.5	V147 Y148 A151 A162 Q163 P164 D165 R169 F170 T171 P335 I358	V147-I167 HydrophobicContact CG1-CD1 4.16Å; V147-I167 HydrophobicContact CG1-CG2 3.66Å; Y148-I167 HydrophobicContact CD2-CG2 4.1Å; A151-I167 HydrophobicContact CB-CB 4.27Å; A151-I167 HydrophobicContact CB-CG1 3.75Å; A162-I167 HydrophobicContact CB-CD1 3.7Å; A162-I167 HydrophobicContact CB-CG1 4.04Å; Q163-I167 VanDerWaalsContact O-CG1 3.28Å; Q163-I167 WeakPolarHBondContact O-CG1 3.45Å; Q163-I167 PolarHBondContact O-N 3.34Å; P164-I167 PolarHBondContact O-N 3.47Å; P164-I167 VanDerWaalsContact O-N 3.08Å; D165-I167 VanDerWaalsContact C-N 3.31Å; I167-R169 PolarHBondContact O-N 3.47Å; I167-F170 WeakPolarHBondContact O-CA 3.45Å; I167-F170 PolarHBondContact O-N 3.14Å; I167-T171 HydrophobicContact CG2-CG2 3.75Å; I167-T171 PolarHBondContact O-N 3.18Å; I167-T171 PolarHBondContact O-OG1 3.38Å; I167-P335 HydrophobicContact CD1-CG 4.36Å; I167-I358 HydrophobicContact CD1-CD1 3.35Å
168	L	95.7	Very high	95.7	Very high	44 Å²	44	36.1 Å²	36.1	23%	0.23	20%	0.196	C	C	.	.	H	α-helix	trans	-56.2	-35.6	-179.6	-74.4	174.4	0	0	0	112.8	Y148 P164 F170 T171 N172 S175	Y148-L168 HydrophobicContact CD2-CD2 4.1Å; Y148-L168 HydrophobicContact CE2-CD2 3.57Å; Y148-L168 HydrophobicContact CE2-CG 3.98Å; P164-L168 WeakPolarHBondContact O-CG 3.31Å; P164-L168 PolarHBondContact O-N 3.48Å; P164-L168 VanDerWaalsContact O-N 3.14Å; L168-F170 PolarHBondContact O-N 2.94Å; L168-T171 PolarHBondContact O-N 3.2Å; L168-N172 HydrophobicContact CB-CB 4.47Å; L168-N172 HydrophobicContact CD2-CB 4.04Å; L168-N172 WeakPolarHBondContact O-CA 3.33Å; L168-N172 WeakPolarHBondContact O-CB 3.38Å; L168-N172 PolarHBondContact O-N 3.22Å; L168-S175 WeakPolarHBondContact O-CB 3.34Å
169	R	96	Very high	95.6	Very high	37 Å²	37	29 Å²	29	14%	0.14	17%	0.168	C	C	.	.	H	α-helix	trans	-65.6	-4	175	73	-178.6	168.9	-99.4	-4	114.5	D166 I167 M176 T179 F331 P333 N356	D166-R169 WeakPolarHBondContact O-CG 3.4Å; D166-R169 IonicContact OD1-NH1 3.73Å; I167-R169 PolarHBondContact O-N 3.47Å; R169-M176 WeakPolarHBondContact O-CG 3.3Å; R169-T179 WeakPolarHBondContact CB-OG1 3.37Å; R169-F331 HydrophobicContact CB-CD1 4.23Å; R169-F331 HydrophobicContact CB-CE1 4.33Å; R169-F331 HydrophobicContact CG-CD1 4.18Å; R169-F331 PolarHBondContact NE-O 2.75Å; R169-F331 VanDerWaalsContact NE-O 3.11Å; R169-F331 VanDerWaalsContact O-CE1 3.25Å; R169-F331 WeakPolarHBondContact O-CE1 3.18Å; R169-P333 PolarHBondContact NH2-O 3.01Å; R169-N356 PolarHBondContact O-OD1 3.37Å
170	F	96.4	Very high	95.5	Very high	1 Å²	1	29.8 Å²	29.8	0%	0.004	17%	0.172	C	C	.	.	H	α-helix	trans	-122.7	-6.6	177.2	-50.5	-78.1	0	0	0	114.7	D166 I167 L168 M176 F331 I334 F339 N356 I358	D166-F170 WeakPolarHBondContact O-CE2 3.47Å; I167-F170 WeakPolarHBondContact O-CA 3.45Å; I167-F170 PolarHBondContact O-N 3.14Å; L168-F170 PolarHBondContact O-N 2.94Å; F170-M176 VanDerWaalsContact O-CE 3.23Å; F170-M176 WeakPolarHBondContact O-CE 3Å; F170-F331 HydrophobicContact CD1-CD1 4.49Å; F170-F331 HydrophobicContact CE1-CB 3.86Å; F170-F331 HydrophobicContact CE1-CD1 4.22Å; F170-F331 HydrophobicContact CE1-CG 4.36Å; F170-F331 HydrophobicContact CZ-CB 4.34Å; F170-F331 WeakPolarHBondContact CZ-O 3.38Å; F170-I334 HydrophobicContact CE1-CG1 4.14Å; F170-I334 HydrophobicContact CE1-CG2 4.47Å; F170-I334 HydrophobicContact CZ-CB 4.46Å; F170-I334 HydrophobicContact CZ-CG1 4.07Å; F170-I334 HydrophobicContact CZ-CG2 4.47Å; F170-F339 HydrophobicContact CD1-CD2 4.35Å; F170-F339 AromaticContact CD1-CE2 3.96Å; F170-F339 HydrophobicContact CD1-CE2 3.96Å; F170-F339 HydrophobicContact CE1-CD2 4.22Å; F170-F339 AromaticContact CE1-CE2 3.83Å; F170-F339 HydrophobicContact CE1-CE2 3.83Å; F170-N356 WeakPolarHBondContact CA-OD1 3.4Å; F170-I358 HydrophobicContact CB-CD1 3.92Å; F170-I358 HydrophobicContact CB-CG1 3.7Å; F170-I358 HydrophobicContact CB-CG2 4.27Å; F170-I358 HydrophobicContact CD1-CG2 3.56Å; F170-I358 HydrophobicContact CD2-CD1 3.65Å; F170-I358 HydrophobicContact CD2-CG1 4.28Å; F170-I358 HydrophobicContact CD2-CG2 4.34Å; F170-I358 HydrophobicContact CE1-CG2 3.83Å; F170-I358 HydrophobicContact CE2-CD1 4.29Å; F170-I358 HydrophobicContact CG-CD1 3.85Å; F170-I358 HydrophobicContact CG-CG1 3.95Å; F170-I358 HydrophobicContact CG-CG2 3.81Å; F170-I358 HydrophobicContact CZ-CG2 4.34Å
171	T	94.4	Very high	95.4	Very high	3 Å²	3	30 Å²	30	2%	0.018	18%	0.175	C	C	.	.	H	α-helix	trans	-127.8	-17.3	-178.9	60.6	0	0	0	0	113.4	V147 I167 L168	V147-T171 HydrophobicContact CB-CG2 4.13Å; V147-T171 HydrophobicContact CG1-CG2 3.95Å; I167-T171 HydrophobicContact CG2-CG2 3.75Å; I167-T171 PolarHBondContact O-N 3.18Å; I167-T171 PolarHBondContact O-OG1 3.38Å; L168-T171 PolarHBondContact O-N 3.2Å
172	N	95.1	Very high	95.3	Very high	15 Å²	15	37.7 Å²	37.7	8%	0.08	19%	0.191	C	C	.	.			trans	-114.8	115.2	178.9	177.5	-77.4	0	0	0	109.8	L168 A174 S175 M176 Q230 S231	L168-N172 HydrophobicContact CB-CB 4.47Å; L168-N172 HydrophobicContact CD2-CB 4.04Å; L168-N172 WeakPolarHBondContact O-CA 3.33Å; L168-N172 WeakPolarHBondContact O-CB 3.38Å; L168-N172 PolarHBondContact O-N 3.22Å; N172-A174 VanDerWaalsContact C-N 3.31Å; N172-A174 PolarHBondContact O-N 3.31Å; N172-A174 WeakPolarHBondContact OD1-CB 3.4Å; N172-A174 PolarHBondContact OD1-N 2.94Å; N172-S175 WeakPolarHBondContact O-CA 3.49Å; N172-S175 WeakPolarHBondContact O-CB 3.39Å; N172-S175 PolarHBondContact O-N 3.45Å; N172-S175 PolarHBondContact OD1-N 2.94Å; N172-S175 PolarHBondContact OD1-OG 3.4Å; N172-M176 WeakPolarHBondContact O-CG 3.22Å; N172-M176 PolarHBondContact O-N 2.98Å; N172-Q230 WeakPolarHBondContact CA-O 3.41Å; N172-Q230 WeakPolarHBondContact ND2-CB 3.37Å; N172-Q230 PolarHBondContact ND2-OE1 3.27Å; N172-S231 PolarHBondContact ND2-OG 2.99Å
173	K	95.5	Very high	95.3	Very high	9 Å²	9	39.5 Å²	39.5	4%	0.039	20%	0.196	C	C	.	.	H	α-helix	trans	-62.7	-33.7	-173.8	-65	-178.3	-170.6	70.3	0	113.3	M176 R177 K228 P229 Q230 S232 I262 E355	K173-M176 HydrophobicContact CG-SD 4.2Å; K173-M176 WeakPolarHBondContact O-CB 3.07Å; K173-M176 PolarHBondContact O-N 3.4Å; K173-R177 WeakPolarHBondContact O-CG 3.26Å; K173-R177 PolarHBondContact O-N 3.3Å; K173-R177 VanDerWaalsContact O-N 3.09Å; K173-K228 HydrophobicContact CD-CD 3.64Å; K173-K228 VanDerWaalsContact CD-CE 3.43Å; K173-K228 HydrophobicContact CD-CG 4.07Å; K173-P229 PolarHBondContact NZ-O 3.04Å; K173-Q230 WeakPolarHBondContact CG-O 3.43Å; K173-Q230 PolarHBondContact N-O 2.79Å; K173-S232 PolarHBondContact NZ-O 2.92Å; K173-I262 HydrophobicContact CB-CD1 4.49Å; K173-I262 HydrophobicContact CB-CG2 4.1Å; K173-E355 WeakPolarHBondContact CE-OE2 3.5Å
174	A	95.2	Very high	94.9	Very high	3 Å²	3	44.8 Å²	44.8	3%	0.025	22%	0.22	C	C	.	.	H	α-helix	trans	-66.2	-42.3	173.6	0	0	0	0	0	111.4	N172 M176 R177 I178 Q230 I262	N172-A174 VanDerWaalsContact C-N 3.31Å; N172-A174 PolarHBondContact O-N 3.31Å; N172-A174 WeakPolarHBondContact OD1-CB 3.4Å; N172-A174 PolarHBondContact OD1-N 2.94Å; A174-M176 VanDerWaalsContact C-N 3.32Å; A174-M176 PolarHBondContact O-N 3.08Å; A174-R177 PolarHBondContact O-N 3.08Å; A174-I178 VanDerWaalsContact O-CG1 3.28Å; A174-I178 WeakPolarHBondContact O-CG1 3.25Å; A174-I178 PolarHBondContact O-N 3.27Å; A174-Q230 HydrophobicContact CB-CG 4.46Å; A174-I262 HydrophobicContact CB-CD1 4.2Å
175	S	96.1	Very high	94.1	Very high	30 Å²	30	48.4 Å²	48.4	21%	0.21	24%	0.244	C	C	.	.	H	α-helix	trans	-64.5	-36.2	175.1	-57.4	0	0	0	0	111.8	L168 N172 I178 T179	L168-S175 WeakPolarHBondContact O-CB 3.34Å; N172-S175 WeakPolarHBondContact O-CA 3.49Å; N172-S175 WeakPolarHBondContact O-CB 3.39Å; N172-S175 PolarHBondContact O-N 3.45Å; N172-S175 PolarHBondContact OD1-N 2.94Å; N172-S175 PolarHBondContact OD1-OG 3.4Å; S175-I178 PolarHBondContact O-N 3.24Å; S175-T179 WeakPolarHBondContact O-CB 3.49Å; S175-T179 PolarHBondContact O-N 2.93Å; S175-T179 PolarHBondContact O-OG1 3.36Å
176	M	97.1	Very high	93.6	Very high	6 Å²	6	46.9 Å²	46.9	3%	0.03	25%	0.246	C	C	.	.	H	α-helix	trans	-60	-47	173.1	-64.8	168.5	-173.6	0	0	111.6	R169 F170 N172 K173 A174 T179 L180 F331 F353 E355 N356	R169-M176 WeakPolarHBondContact O-CG 3.3Å; F170-M176 VanDerWaalsContact O-CE 3.23Å; F170-M176 WeakPolarHBondContact O-CE 3Å; N172-M176 WeakPolarHBondContact O-CG 3.22Å; N172-M176 PolarHBondContact O-N 2.98Å; K173-M176 HydrophobicContact CG-SD 4.2Å; K173-M176 WeakPolarHBondContact O-CB 3.07Å; K173-M176 PolarHBondContact O-N 3.4Å; A174-M176 VanDerWaalsContact C-N 3.32Å; A174-M176 PolarHBondContact O-N 3.08Å; M176-T179 PolarHBondContact O-N 3.19Å; M176-L180 PolarHBondContact O-N 3.36Å; M176-F331 HydrophobicContact CB-CE1 4.26Å; M176-F331 HydrophobicContact CB-CZ 4.23Å; M176-F331 HydrophobicContact CG-CE1 4.43Å; M176-F353 HydrophobicContact CB-CE1 3.83Å; M176-F353 HydrophobicContact CB-CZ 4.23Å; M176-F353 HydrophobicContact SD-CE1 4.41Å; M176-F353 HydrophobicContact SD-CZ 4.43Å; M176-E355 HydrophobicContact SD-CB 4.16Å; M176-N356 WeakPolarHBondContact CE-O 3.32Å; M176-N356 WeakPolarHBondContact CE-OD1 3.09Å
177	R	96	Very high	93.2	Very high	14 Å²	14	49.1 Å²	49.1	5%	0.053	27%	0.273	C	S	.	.	H	α-helix	trans	-63	-47	177.7	-66.3	-70.8	179.8	-161.7	-1.3	112.2	K173 A174 T179 L180 S181 F197 I262 E264 F353	K173-R177 WeakPolarHBondContact O-CG 3.26Å; K173-R177 PolarHBondContact O-N 3.3Å; K173-R177 VanDerWaalsContact O-N 3.09Å; A174-R177 PolarHBondContact O-N 3.08Å; R177-T179 VanDerWaalsContact C-N 3.28Å; R177-T179 PolarHBondContact O-N 3.21Å; R177-L180 PolarHBondContact O-N 2.93Å; R177-S181 PolarHBondContact O-N 2.7Å; R177-F197 HydrophobicContact CB-CD1 3.64Å; R177-F197 HydrophobicContact CB-CD2 4.04Å; R177-F197 HydrophobicContact CB-CE1 3.46Å; R177-F197 VanDerWaalsContact CB-CE1 3.46Å; R177-F197 HydrophobicContact CB-CE2 3.86Å; R177-F197 HydrophobicContact CB-CG 3.94Å; R177-F197 HydrophobicContact CB-CZ 3.57Å; R177-F197 HydrophobicContact CG-CB 4.45Å; R177-F197 HydrophobicContact CG-CD1 3.98Å; R177-F197 HydrophobicContact CG-CD2 4.26Å; R177-F197 HydrophobicContact CG-CE1 4.31Å; R177-F197 HydrophobicContact CG-CG 3.96Å; R177-I262 HydrophobicContact CG-CD1 4.07Å; R177-E264 IonicContact CZ-OE1 3.05Å; R177-E264 IonicContact CZ-OE2 3.66Å; R177-E264 VanDerWaalsContact NE-CD 3.33Å; R177-E264 IonicContact NE-OE1 2.79Å; R177-E264 PolarHBondContact NE-OE1 3.41Å; R177-E264 IonicContact NE-OE2 3.66Å; R177-E264 VanDerWaalsContact NH2-CD 3.34Å; R177-E264 IonicContact NH2-OE1 3.69Å; R177-E264 PolarHBondContact NH2-OE1 3.25Å; R177-E264 IonicContact NH2-OE2 2.79Å; R177-E264 PolarHBondContact NH2-OE2 2.93Å; R177-F353 VanDerWaalsContact CZ-O 3.28Å; R177-F353 PolarHBondContact NH1-O 2.81Å; R177-F353 PolarHBondContact NH2-O 2.84Å
178	I	95.2	Very high	92.8	Very high	62 Å²	62	57 Å²	57	32%	0.318	32%	0.315	S	S	.	.	H	α-helix	trans	-60.9	-37.3	177.3	-67.3	165.7	0	0	0	111.6	A174 S175 L180 S181 R182 F197	A174-I178 VanDerWaalsContact O-CG1 3.28Å; A174-I178 WeakPolarHBondContact O-CG1 3.25Å; A174-I178 PolarHBondContact O-N 3.27Å; S175-I178 PolarHBondContact O-N 3.24Å; I178-L180 VanDerWaalsContact C-N 3.35Å; I178-S181 PolarHBondContact O-OG 2.98Å; I178-R182 WeakPolarHBondContact O-CG 3.46Å; I178-R182 PolarHBondContact O-N 3.03Å; I178-F197 HydrophobicContact CG1-CE2 4.26Å; I178-F197 HydrophobicContact CG1-CZ 3.83Å
179	T	95.6	Very high	92.5	Very high	31 Å²	31	56.3 Å²	56.3	19%	0.19	32%	0.318	C	S	.	.	H	α-helix	trans	-62	-46	177.3	-57.9	0	0	0	0	110.2	R169 S175 M176 R177 F183 A330 F331	R169-T179 WeakPolarHBondContact CB-OG1 3.37Å; S175-T179 WeakPolarHBondContact O-CB 3.49Å; S175-T179 PolarHBondContact O-N 2.93Å; S175-T179 PolarHBondContact O-OG1 3.36Å; M176-T179 PolarHBondContact O-N 3.19Å; R177-T179 VanDerWaalsContact C-N 3.28Å; R177-T179 PolarHBondContact O-N 3.21Å; T179-F183 PolarHBondContact O-N 2.85Å; T179-A330 WeakPolarHBondContact CG2-O 3.32Å; T179-F331 HydrophobicContact CG2-CD1 3.8Å; T179-F331 HydrophobicContact CG2-CE1 3.82Å; T179-F331 HydrophobicContact CG2-CG 4.45Å; T179-F331 HydrophobicContact CG2-CZ 4.5Å
180	L	94.9	Very high	92.3	Very high	18 Å²	18	55.6 Å²	55.6	9%	0.094	32%	0.319	C	S	.	.	H	α-helix	trans	-70.2	-40.6	179.3	-75.4	168.7	0	0	0	113.4	M176 R177 I178 R182 F183 Y326 L327 A330 F331 F353	M176-L180 PolarHBondContact O-N 3.36Å; R177-L180 PolarHBondContact O-N 2.93Å; I178-L180 VanDerWaalsContact C-N 3.35Å; L180-R182 PolarHBondContact O-N 3.44Å; L180-F183 PolarHBondContact O-N 3.13Å; L180-F183 VanDerWaalsContact O-N 3.08Å; L180-Y326 HydrophobicContact CD2-CE1 3.99Å; L180-L327 HydrophobicContact CD1-CD2 4.47Å; L180-L327 HydrophobicContact CD2-CD2 3.88Å; L180-A330 HydrophobicContact CD2-CB 3.73Å; L180-F331 HydrophobicContact CD1-CE2 3.92Å; L180-F331 HydrophobicContact CD1-CZ 3.96Å; L180-F331 HydrophobicContact CD2-CE2 3.79Å; L180-F331 HydrophobicContact CD2-CZ 4.33Å; L180-F331 HydrophobicContact CG-CE2 3.74Å; L180-F331 HydrophobicContact CG-CZ 3.78Å; L180-F353 HydrophobicContact CD1-CB 3.45Å; L180-F353 VanDerWaalsContact CD1-CB 3.45Å; L180-F353 HydrophobicContact CD1-CD1 3.26Å; L180-F353 HydrophobicContact CD1-CD2 3.65Å; L180-F353 HydrophobicContact CD1-CE1 3.78Å; L180-F353 HydrophobicContact CD1-CE2 4.11Å; L180-F353 HydrophobicContact CD1-CG 3.16Å; L180-F353 HydrophobicContact CD1-CZ 4.16Å
181	S	92.2	Very high	92.2	Very high	69 Å²	69	59.8 Å²	59.8	48%	0.483	35%	0.345	S	S	.	.	H	α-helix	trans	-66.9	-21.9	-179.4	68.8	0	0	0	0	113.4	R177 I178	R177-S181 PolarHBondContact O-N 2.7Å; I178-S181 PolarHBondContact O-OG 2.98Å
182	R	92.5	Very high	92.2	Very high	201 Å²	201	61.7 Å²	61.7	76%	0.758	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-10.6	174.9	-69	177.4	176.8	-178.9	0.1	113.6	I178 L180	I178-R182 WeakPolarHBondContact O-CG 3.46Å; I178-R182 PolarHBondContact O-N 3.03Å; L180-R182 PolarHBondContact O-N 3.44Å
183	F	94	Very high	92.1	Very high	57 Å²	57	62.6 Å²	62.6	25%	0.25	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-84.3	125.2	-176.8	-174.9	-105.3	0	0	0	110.6	T179 L180 P185 Y326 T329 A330	T179-F183 PolarHBondContact O-N 2.85Å; L180-F183 PolarHBondContact O-N 3.13Å; L180-F183 VanDerWaalsContact O-N 3.08Å; F183-P185 WeakPolarHBondContact O-CD 3.38Å; F183-Y326 HydrophobicContact CD1-CD2 4.18Å; F183-Y326 AromaticContact CD1-CE2 3.44Å; F183-Y326 HydrophobicContact CD1-CE2 3.44Å; F183-Y326 VanDerWaalsContact CD1-CE2 3.44Å; F183-Y326 AromaticContact CD1-CZ 3.74Å; F183-Y326 AromaticContact CE1-CD2 3.74Å; F183-Y326 HydrophobicContact CE1-CD2 3.74Å; F183-Y326 AromaticContact CE1-CE2 3.45Å; F183-Y326 HydrophobicContact CE1-CE2 3.45Å; F183-Y326 VanDerWaalsContact CE1-CE2 3.45Å; F183-T329 HydrophobicContact CE2-CG2 3.9Å; F183-T329 HydrophobicContact CZ-CG2 3.56Å; F183-A330 HydrophobicContact CB-CB 4.02Å; F183-A330 HydrophobicContact CD1-CB 3.6Å; F183-A330 HydrophobicContact CD2-CB 3.94Å; F183-A330 HydrophobicContact CE1-CB 4Å; F183-A330 HydrophobicContact CE2-CB 4.31Å; F183-A330 HydrophobicContact CG-CB 3.56Å; F183-A330 HydrophobicContact CZ-CB 4.34Å
184	Q	87.7	Confident	91.8	Very high	172 Å²	172	68.2 Å²	68.2	80%	0.804	39%	0.391	S	S	*	.	P	Polyproline II helix	trans	-89.8	116.2	175.9	-69.3	-179.2	-7.8	0	0	109.5
185	P	79.7	Confident	91.7	Very high	75 Å²	75	68.3 Å²	68.3	49%	0.487	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-63.3	150.7	176.2	23.9	-30.8	0	0	0	111.1	F183 Y326	F183-P185 WeakPolarHBondContact O-CD 3.38Å; P185-Y326 HydrophobicContact CB-CD2 4.37Å; P185-Y326 HydrophobicContact CB-CE2 3.85Å
186	A	85.7	Confident	91.6	Very high	76 Å²	76	70.8 Å²	70.8	63%	0.628	40%	0.399	S	S	*	.	P	Polyproline II helix	trans	-61	149	161.5	0	0	0	0	0	109.7	N188 G189	A186-N188 PolarHBondContact O-N 3.08Å; A186-G189 PolarHBondContact O-N 3.14Å
187	A	86.8	Confident	91.6	Very high	107 Å²	107	73 Å²	73	88%	0.884	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-29	-174.3	0	0	0	0	0	114.6
188	N	86.8	Confident	91.6	Very high	167 Å²	167	73 Å²	73	89%	0.893	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	24.4	178.6	-60.7	-29.5	0	0	0	112.6	A186	A186-N188 PolarHBondContact O-N 3.08Å
189	G	89.1	Confident	91.6	Very high	29 Å²	29	73.1 Å²	73.1	30%	0.299	42%	0.417	S	S	.	.	S	Bend	trans	-73.4	167.8	178.2	0	0	0	0	0	113.2	A186	A186-G189 PolarHBondContact O-N 3.14Å
190	P	93.1	Very high	91.3	Very high	23 Å²	23	72.5 Å²	72.5	15%	0.149	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-59.6	146.6	169.8	29.8	-37.3	0	0	0	110.4	V192 Y323 Y326 F351	P190-V192 HydrophobicContact CG-CG2 4.41Å; P190-V192 PolarHBondContact O-N 3.28Å; P190-Y323 HydrophobicContact CB-CD2 4.12Å; P190-Y323 HydrophobicContact CG-CD2 3.89Å; P190-Y326 HydrophobicContact CG-CD2 4.31Å; P190-Y326 HydrophobicContact CG-CG 3.95Å; P190-F351 HydrophobicContact CB-CD2 3.93Å; P190-F351 HydrophobicContact CB-CE2 4.05Å
191	T	93.3	Very high	91	Very high	89 Å²	89	75.3 Å²	75.3	55%	0.546	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-76.4	123.4	172.1	-50.4	0	0	0	0	109.7	N350 F351	T191-N350 WeakPolarHBondContact CG2-OD1 3.21Å; T191-F351 PolarHBondContact O-N 2.9Å
192	V	94.2	Very high	90.5	Very high	43 Å²	43	72.5 Å²	72.5	26%	0.261	40%	0.403	S	S	.	.	B	Isolated β-bridge	trans	-120.8	124.5	-177.3	-170.9	0	0	0	0	108.3	P190 Y323 Y326 F351	P190-V192 HydrophobicContact CG-CG2 4.41Å; P190-V192 PolarHBondContact O-N 3.28Å; V192-Y323 HydrophobicContact CB-CE2 4.48Å; V192-Y323 HydrophobicContact CG1-CE2 4.11Å; V192-Y323 HydrophobicContact CG2-CD2 3.99Å; V192-Y323 HydrophobicContact CG2-CE2 3.57Å; V192-Y326 HydrophobicContact CG1-CE1 4.41Å; V192-Y326 HydrophobicContact CG2-CD1 4.07Å; V192-Y326 HydrophobicContact CG2-CE1 3.71Å; V192-Y326 HydrophobicContact CG2-CE2 4.44Å; V192-F351 WeakPolarHBondContact CA-O 3.28Å
193	D	92.8	Very high	89.9	Confident	33 Å²	33	64 Å²	64	18%	0.176	38%	0.378	C	S	.	.			trans	-72.1	134.9	174.6	-75.8	-10	0	0	0	109.6	V195 R346 N350 F351 Q352	D193-V195 PolarHBondContact O-N 3.01Å; D193-V195 VanDerWaalsContact O-N 3.14Å; D193-R346 WeakPolarHBondContact OD2-CD 3.34Å; D193-R346 IonicContact OD2-CZ 3.17Å; D193-R346 IonicContact OD2-NE 3.91Å; D193-R346 IonicContact OD2-NH1 3.49Å; D193-R346 PolarHBondContact OD2-NH1 2.93Å; D193-N350 WeakPolarHBondContact OD1-CB 3.37Å; D193-N350 PolarHBondContact OD1-ND2 2.78Å; D193-F351 PolarHBondContact N-O 3.3Å; D193-Q352 HydrophobicContact CB-CG 3.94Å
194	D	89.2	Confident	88.7	Confident	127 Å²	127	70.3 Å²	70.3	68%	0.679	40%	0.4	S	S	*	.			trans	-76.1	98.8	169.1	-171	22.4	0	0	0	109.4	K196	D194-K196 PolarHBondContact O-N 2.86Å
195	V	93	Very high	87.7	Confident	5 Å²	5	65.6 Å²	65.6	3%	0.03	38%	0.383	C	S	.	.			trans	-76.3	116.6	178.8	176.5	0	0	0	0	108.6	D193 E265 L267 Q352	D193-V195 PolarHBondContact O-N 3.01Å; D193-V195 VanDerWaalsContact O-N 3.14Å; V195-E265 HydrophobicContact CG1-CB 4.39Å; V195-L267 HydrophobicContact CB-CD2 4.27Å; V195-L267 HydrophobicContact CG1-CD2 3.63Å; V195-L267 HydrophobicContact CG2-CD2 3.58Å; V195-Q352 HydrophobicContact CG2-CB 4.09Å; V195-Q352 HydrophobicContact CG2-CG 4.24Å
196	K	95.6	Very high	87.8	Confident	83 Å²	83	69 Å²	69	36%	0.361	40%	0.403	S	S	.	.			trans	-66.9	143.3	178.7	-61.3	178.6	-170.9	160.1	0	110.7	D194 G220 L221 E265	D194-K196 PolarHBondContact O-N 2.86Å; K196-G220 WeakPolarHBondContact CD-O 3.37Å; K196-G220 PolarHBondContact NZ-O 2.78Å; K196-L221 HydrophobicContact CB-CD2 3.8Å; K196-L221 VanDerWaalsContact O-CD2 3.31Å; K196-L221 WeakPolarHBondContact O-CD2 3.24Å; K196-E265 HydrophobicContact CB-CG 4.12Å; K196-E265 PolarHBondContact N-OE2 3.44Å; K196-E265 VanDerWaalsContact N-OE2 3.12Å; K196-E265 PolarHBondContact O-N 3.37Å
197	F	96.7	Very high	88	Confident	51 Å²	51	67.2 Å²	67.2	22%	0.224	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	155.3	178.1	72.1	-78.7	0	0	0	111.6	R177 I178 I262 A263 E264	R177-F197 HydrophobicContact CB-CD1 3.64Å; R177-F197 HydrophobicContact CB-CD2 4.04Å; R177-F197 HydrophobicContact CB-CE1 3.46Å; R177-F197 VanDerWaalsContact CB-CE1 3.46Å; R177-F197 HydrophobicContact CB-CE2 3.86Å; R177-F197 HydrophobicContact CB-CG 3.94Å; R177-F197 HydrophobicContact CB-CZ 3.57Å; R177-F197 HydrophobicContact CG-CB 4.45Å; R177-F197 HydrophobicContact CG-CD1 3.98Å; R177-F197 HydrophobicContact CG-CD2 4.26Å; R177-F197 HydrophobicContact CG-CE1 4.31Å; R177-F197 HydrophobicContact CG-CG 3.96Å; I178-F197 HydrophobicContact CG1-CE2 4.26Å; I178-F197 HydrophobicContact CG1-CZ 3.83Å; F197-I262 HydrophobicContact CB-CD1 4.02Å; F197-I262 HydrophobicContact CB-CG1 4.2Å; F197-I262 HydrophobicContact CD2-CD1 3.69Å; F197-I262 HydrophobicContact CD2-CG1 4.23Å; F197-I262 HydrophobicContact CG-CD1 4.16Å; F197-A263 CarbonylContact C-O 3.37Å; F197-A263 WeakPolarHBondContact CA-O 3.3Å; F197-E264 HydrophobicContact CB-CG 3.92Å
198	C	95.6	Very high	88.2	Confident	15 Å²	15	65.8 Å²	65.8	10%	0.101	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	124.5	172.1	-175.9	0	0	0	0	109	M200 L216 A219 L221 I262 A263	C198-M200 HydrophobicContact CB-CE 3.89Å; C198-M200 VanDerWaalsContact O-CE 3.27Å; C198-M200 WeakPolarHBondContact O-CE 3.32Å; C198-L216 HydrophobicContact CB-CD2 4.24Å; C198-A219 HydrophobicContact CB-CB 3.85Å; C198-L221 HydrophobicContact CB-CD1 3.85Å; C198-I262 WeakPolarHBondContact O-CA 3.44Å; C198-A263 HydrophobicContact CB-CB 4.48Å; C198-A263 PolarHBondContact N-O 3.14Å; C198-A263 PolarHBondContact O-N 3.08Å
199	S	94.2	Very high	88.5	Confident	65 Å²	65	59.2 Å²	59.2	46%	0.455	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	130.8	173.9	174.6	0	0	0	0	109.3	Q230	S199-Q230 PolarHBondContact OG-NE2 3.19Å
200	M	91.1	Very high	88.8	Confident	18 Å²	18	60 Å²	60	9%	0.089	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	155	-176.8	62.9	-150.4	57.1	0	0	112	C198 F212 L216 L227 P260 Y261 A263	C198-M200 HydrophobicContact CB-CE 3.89Å; C198-M200 VanDerWaalsContact O-CE 3.27Å; C198-M200 WeakPolarHBondContact O-CE 3.32Å; M200-F212 HydrophobicContact SD-CE2 3.39Å; M200-F212 WeakPolarHBondContact SD-CE2 3.24Å; M200-F212 HydrophobicContact SD-CZ 3.6Å; M200-L216 HydrophobicContact CE-CD2 3.47Å; M200-L216 VanDerWaalsContact CE-CD2 3.47Å; M200-L216 HydrophobicContact SD-CD2 4.38Å; M200-L227 HydrophobicContact SD-CD2 4.38Å; M200-P260 WeakPolarHBondContact O-CA 3.32Å; M200-Y261 PolarHBondContact N-O 3.34Å; M200-Y261 PolarHBondContact O-N 2.86Å; M200-Y261 VanDerWaalsContact O-O 3.05Å; M200-A263 HydrophobicContact CE-CB 3.7Å
201	F	88.3	Confident	88.8	Confident	77 Å²	77	63.9 Å²	63.9	34%	0.338	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	109.9	172.5	-164.3	-76.1	0	0	0	108.2	R204 C258 P260	F201-R204 HydrophobicContact CD1-CB 4Å; F201-R204 HydrophobicContact CD1-CG 3.39Å; F201-R204 HydrophobicContact CE1-CG 3.69Å; F201-R204 VanDerWaalsContact CE1-NE 3.33Å; F201-R204 HydrophobicContact CG-CG 4.35Å; F201-C258 HydrophobicContact CE1-CB 4.34Å; F201-C258 VanDerWaalsContact CZ-O 3.3Å; F201-C258 WeakPolarHBondContact CZ-O 3.23Å; F201-P260 HydrophobicContact CD2-CB 4.19Å
202	T	81.4	Confident	88.9	Confident	9 Å²	9	59.9 Å²	59.9	6%	0.055	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	161.2	179	63.7	0	0	0	0	110.5	R204 W250 H254 C258 K259 Y261	T202-R204 PolarHBondContact O-N 3.21Å; T202-W250 HydrophobicContact CG2-CH2 3.98Å; T202-W250 HydrophobicContact CG2-CZ3 4.31Å; T202-H254 WeakPolarHBondContact CB-O 3.48Å; T202-H254 PolarHBondContact OG1-O 3.06Å; T202-C258 WeakPolarHBondContact O-CA 3.48Å; T202-C258 PolarHBondContact OG1-N 3.25Å; T202-K259 PolarHBondContact N-O 2.72Å; T202-K259 PolarHBondContact OG1-N 2.88Å; T202-K259 VanDerWaalsContact OG1-N 3.07Å; T202-K259 PolarHBondContact OG1-O 3.23Å; T202-Y261 HydrophobicContact CG2-CD2 3.63Å; T202-Y261 HydrophobicContact CG2-CE2 3.98Å
203	G	79	Confident	88.9	Confident	22 Å²	22	58.9 Å²	58.9	23%	0.227	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	-10.3	174.7	0	0	0	0	0	116.4	G255	G203-G255 VanDerWaalsContact CA-O 3.26Å; G203-G255 WeakPolarHBondContact CA-O 3.16Å; G203-G255 PolarHBondContact N-O 2.84Å
204	R	70.4	Confident	89	Confident	191 Å²	191	64.3 Å²	64.3	72%	0.721	34%	0.335	S	S	*	.	S	Bend	trans	-85.1	-16.7	173.9	-83.3	-176.9	-172.7	-158.6	-0.1	114.1	F201 T202	F201-R204 HydrophobicContact CD1-CB 4Å; F201-R204 HydrophobicContact CD1-CG 3.39Å; F201-R204 HydrophobicContact CE1-CG 3.69Å; F201-R204 VanDerWaalsContact CE1-NE 3.33Å; F201-R204 HydrophobicContact CG-CG 4.35Å; T202-R204 PolarHBondContact O-N 3.21Å
205	T	66.8	Low	89.3	Confident	73 Å²	73	61.8 Å²	61.8	45%	0.448	32%	0.321	S	S	.	.	S	Bend	trans	-123.7	137.5	-175.2	57.2	0	0	0	0	110.4	M207	T205-M207 PolarHBondContact O-N 3.42Å; T205-M207 WeakPolarHBondContact OG1-CB 3.42Å
206	T	81.8	Confident	89.4	Confident	146 Å²	146	61.6 Å²	61.6	90%	0.896	32%	0.32	S	S	*	.			trans	-74.3	35.5	167.9	49.6	0	0	0	0	111.9
207	M	88.2	Confident	89.4	Confident	39 Å²	39	61 Å²	61	19%	0.192	32%	0.32	C	S	.	.			trans	-73.3	133.1	-173.2	-166.9	164.2	51.9	0	0	109.7	T205 Q211 F212 L215 H251	T205-M207 PolarHBondContact O-N 3.42Å; T205-M207 WeakPolarHBondContact OG1-CB 3.42Å; M207-Q211 HydrophobicContact CG-CB 3.21Å; M207-Q211 HydrophobicContact CG-CG 4.36Å; M207-Q211 VanDerWaalsContact SD-C 3.54Å; M207-Q211 HydrophobicContact SD-CB 3.89Å; M207-F212 HydrophobicContact CE-CB 3.75Å; M207-F212 HydrophobicContact CE-CD2 3.55Å; M207-F212 HydrophobicContact CE-CG 4.14Å; M207-F212 HydrophobicContact CG-CB 4.48Å; M207-F212 HydrophobicContact SD-CB 4.39Å; M207-L215 HydrophobicContact CE-CD2 4.06Å; M207-L215 HydrophobicContact SD-CD2 4.45Å; M207-H251 PolarHBondContact O-CE1 3.27Å
208	T	92.5	Very high	89.3	Confident	76 Å²	76	63.5 Å²	63.5	47%	0.466	34%	0.336	S	S	.	.			trans	-74.6	160.1	172.3	68.2	0	0	0	0	110.4	A210 Q211 F212	T208-A210 PolarHBondContact O-N 3.13Å; T208-A210 VanDerWaalsContact O-N 3.16Å; T208-Q211 PolarHBondContact O-N 3Å; T208-Q211 WeakPolarHBondContact OG1-CG 3.41Å; T208-Q211 PolarHBondContact OG1-N 3.37Å; T208-Q211 PolarHBondContact OG1-OE1 3.29Å; T208-F212 PolarHBondContact O-N 3.21Å
209	S	93	Very high	89.3	Confident	30 Å²	30	64.7 Å²	64.7	21%	0.21	35%	0.347	C	S	.	.	H	α-helix	trans	-56.8	-31.5	175.5	-58	0	0	0	0	113.1	F212 E213 H251	S209-F212 PolarHBondContact O-N 2.87Å; S209-E213 WeakPolarHBondContact O-CB 3.37Å; S209-E213 PolarHBondContact O-N 2.77Å; S209-H251 WeakPolarHBondContact CA-ND1 3.28Å; S209-H251 PolarHBondContact OG-ND1 2.97Å
210	A	94.5	Very high	89.4	Confident	46 Å²	46	62.8 Å²	62.8	38%	0.38	34%	0.338	S	S	.	.	H	α-helix	trans	-71.5	-38.7	175.7	0	0	0	0	0	112.7	T208 R214	T208-A210 PolarHBondContact O-N 3.13Å; T208-A210 VanDerWaalsContact O-N 3.16Å; A210-R214 WeakPolarHBondContact O-CB 3.36Å; A210-R214 PolarHBondContact O-N 2.89Å
211	Q	93.8	Very high	89.7	Confident	104 Å²	104	62.1 Å²	62.1	49%	0.486	33%	0.334	S	S	.	.	H	α-helix	trans	-69.1	-37.1	173.3	-72.2	169.5	-33.9	0	0	111.2	M207 T208 R214 L215	M207-Q211 HydrophobicContact CG-CB 3.21Å; M207-Q211 HydrophobicContact CG-CG 4.36Å; M207-Q211 VanDerWaalsContact SD-C 3.54Å; M207-Q211 HydrophobicContact SD-CB 3.89Å; T208-Q211 PolarHBondContact O-N 3Å; T208-Q211 WeakPolarHBondContact OG1-CG 3.41Å; T208-Q211 PolarHBondContact OG1-N 3.37Å; T208-Q211 PolarHBondContact OG1-OE1 3.29Å; Q211-R214 PolarHBondContact O-N 3.18Å; Q211-L215 PolarHBondContact O-N 3.46Å
212	F	93.9	Very high	90	Very high	4 Å²	4	64.9 Å²	64.9	2%	0.018	35%	0.348	C	S	.	.	H	α-helix	trans	-60.9	-49.6	173.4	179.5	-104.3	0	0	0	111.2	M200 M207 T208 S209 R214 L215 L216 L227 V247 W250 H251	M200-F212 HydrophobicContact SD-CE2 3.39Å; M200-F212 WeakPolarHBondContact SD-CE2 3.24Å; M200-F212 HydrophobicContact SD-CZ 3.6Å; M207-F212 HydrophobicContact CE-CB 3.75Å; M207-F212 HydrophobicContact CE-CD2 3.55Å; M207-F212 HydrophobicContact CE-CG 4.14Å; M207-F212 HydrophobicContact CG-CB 4.48Å; M207-F212 HydrophobicContact SD-CB 4.39Å; T208-F212 PolarHBondContact O-N 3.21Å; S209-F212 PolarHBondContact O-N 2.87Å; F212-R214 VanDerWaalsContact C-N 3.31Å; F212-R214 PolarHBondContact O-N 3.4Å; F212-L215 WeakPolarHBondContact O-CB 3.38Å; F212-L215 PolarHBondContact O-N 3.39Å; F212-L216 HydrophobicContact CD1-CD1 4.19Å; F212-L216 HydrophobicContact CE1-CD1 3.71Å; F212-L216 HydrophobicContact CE1-CG 4.42Å; F212-L216 HydrophobicContact CZ-CD1 4.11Å; F212-L216 HydrophobicContact CZ-CD2 4.42Å; F212-L216 WeakPolarHBondContact O-CG 3.49Å; F212-L216 PolarHBondContact O-N 3.23Å; F212-L227 HydrophobicContact CZ-CD2 4.24Å; F212-V247 HydrophobicContact CD1-CG1 3.79Å; F212-V247 HydrophobicContact CE1-CG1 3.98Å; F212-W250 AromaticContact CE1-CE3 3.82Å; F212-W250 HydrophobicContact CE1-CE3 3.82Å; F212-W250 AromaticContact CE1-CZ3 3.95Å; F212-W250 HydrophobicContact CE1-CZ3 3.95Å; F212-W250 HydrophobicContact CE2-CZ3 4.05Å; F212-W250 AromaticContact CZ-CE3 3.77Å; F212-W250 HydrophobicContact CZ-CE3 3.77Å; F212-W250 HydrophobicContact CZ-CH2 4.39Å; F212-W250 AromaticContact CZ-CZ3 3.41Å; F212-W250 HydrophobicContact CZ-CZ3 3.41Å; F212-W250 VanDerWaalsContact CZ-CZ3 3.41Å; F212-H251 HydrophobicContact CD1-CB 3.86Å; F212-H251 AromaticContact CD1-CD2 3.86Å; F212-H251 AromaticContact CD2-CD2 3.69Å; F212-H251 HydrophobicContact CE1-CB 4.31Å; F212-H251 HydrophobicContact CG-CB 4.3Å; F212-H251 AromaticContact CG-CD2 3.42Å; F212-H251 VanDerWaalsContact CG-CD2 3.42Å; F212-H251 WeakPolarHBondContact CG-CD2 3.41Å; F212-H251 AromaticContact CG-CG 4Å
213	E	95.4	Very high	90.7	Very high	22 Å²	22	67.8 Å²	67.8	10%	0.103	36%	0.359	C	S	.	.	H	α-helix	trans	-55.3	-46.7	173	176.9	-174.1	-166.3	0	0	111.4	S209 L215 L216 L217 R244 V247 H248	S209-E213 WeakPolarHBondContact O-CB 3.37Å; S209-E213 PolarHBondContact O-N 2.77Å; E213-L215 VanDerWaalsContact C-N 3.33Å; E213-L215 PolarHBondContact O-N 3.08Å; E213-L216 WeakPolarHBondContact O-CB 3.31Å; E213-L216 PolarHBondContact O-N 3.29Å; E213-L216 VanDerWaalsContact O-N 3.1Å; E213-L217 HydrophobicContact CG-CD1 4.06Å; E213-L217 HydrophobicContact CG-CG 4.46Å; E213-L217 WeakPolarHBondContact O-CG 3.45Å; E213-L217 PolarHBondContact O-N 3.39Å; E213-R244 WeakPolarHBondContact OE1-CD 3.31Å; E213-R244 WeakPolarHBondContact OE1-CG 3.4Å; E213-R244 IonicContact OE1-NE 3.99Å; E213-R244 PolarHBondContact OE1-NE 3.34Å; E213-R244 WeakPolarHBondContact OE2-CG 3.47Å; E213-R244 IonicContact OE2-CZ 2.83Å; E213-R244 IonicContact OE2-NE 3.99Å; E213-R244 PolarHBondContact OE2-NE 2.93Å; E213-R244 IonicContact OE2-NH2 3.09Å; E213-V247 HydrophobicContact CB-CG1 4.2Å; E213-H248 IonicContact OE2-CD2 2.93Å; E213-H248 IonicContact OE2-CE1 3.44Å; E213-H248 IonicContact OE2-NE2 2.8Å; E213-H248 PolarHBondContact OE2-NE2 2.67Å
214	R	95.1	Very high	91.5	Very high	148 Å²	148	69.3 Å²	69.3	56%	0.558	37%	0.365	S	S	*	.	H	α-helix	trans	-60.6	-41.8	-179.9	-174.9	65.2	-162.5	-170	6.8	112.2	A210 Q211 F212 L216 L217 D218	A210-R214 WeakPolarHBondContact O-CB 3.36Å; A210-R214 PolarHBondContact O-N 2.89Å; Q211-R214 PolarHBondContact O-N 3.18Å; F212-R214 VanDerWaalsContact C-N 3.31Å; F212-R214 PolarHBondContact O-N 3.4Å; R214-L216 VanDerWaalsContact C-N 3.29Å; R214-L216 PolarHBondContact O-N 3.36Å; R214-L217 PolarHBondContact O-N 2.89Å; R214-D218 WeakPolarHBondContact CG-OD2 3.46Å; R214-D218 IonicContact CZ-OD1 3.02Å; R214-D218 IonicContact CZ-OD2 3.31Å; R214-D218 VanDerWaalsContact NE-CG 3.32Å; R214-D218 IonicContact NE-OD1 3.42Å; R214-D218 PolarHBondContact NE-OD1 2.9Å; R214-D218 IonicContact NE-OD2 2.79Å; R214-D218 PolarHBondContact NE-OD2 3.36Å; R214-D218 VanDerWaalsContact NE-OD2 3.09Å; R214-D218 IonicContact NH2-OD1 3.45Å; R214-D218 PolarHBondContact NH2-OD1 2.88Å; R214-D218 IonicContact NH2-OD2 3.8Å; R214-D218 WeakPolarHBondContact O-CB 3.24Å; R214-D218 PolarHBondContact O-N 2.96Å
215	L	94.2	Very high	92.8	Very high	73 Å²	73	60.3 Å²	60.3	38%	0.382	33%	0.331	S	S	.	.	H	α-helix	trans	-56.8	-41.9	174.4	179.4	71.6	0	0	0	111.9	M207 Q211 F212 E213 A219	M207-L215 HydrophobicContact CE-CD2 4.06Å; M207-L215 HydrophobicContact SD-CD2 4.45Å; Q211-L215 PolarHBondContact O-N 3.46Å; F212-L215 WeakPolarHBondContact O-CB 3.38Å; F212-L215 PolarHBondContact O-N 3.39Å; E213-L215 VanDerWaalsContact C-N 3.33Å; E213-L215 PolarHBondContact O-N 3.08Å; L215-A219 PolarHBondContact O-N 3.06Å
216	L	96	Very high	94.1	Very high	2 Å²	2	58 Å²	58	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-66.3	-44.6	178	-59	179.8	0	0	0	111.5	C198 M200 F212 E213 R214 A219 L221 L225 V247 A263	C198-L216 HydrophobicContact CB-CD2 4.24Å; M200-L216 HydrophobicContact CE-CD2 3.47Å; M200-L216 VanDerWaalsContact CE-CD2 3.47Å; M200-L216 HydrophobicContact SD-CD2 4.38Å; F212-L216 HydrophobicContact CD1-CD1 4.19Å; F212-L216 HydrophobicContact CE1-CD1 3.71Å; F212-L216 HydrophobicContact CE1-CG 4.42Å; F212-L216 HydrophobicContact CZ-CD1 4.11Å; F212-L216 HydrophobicContact CZ-CD2 4.42Å; F212-L216 WeakPolarHBondContact O-CG 3.49Å; F212-L216 PolarHBondContact O-N 3.23Å; E213-L216 WeakPolarHBondContact O-CB 3.31Å; E213-L216 PolarHBondContact O-N 3.29Å; E213-L216 VanDerWaalsContact O-N 3.1Å; R214-L216 VanDerWaalsContact C-N 3.29Å; R214-L216 PolarHBondContact O-N 3.36Å; L216-A219 WeakPolarHBondContact O-CB 3.31Å; L216-A219 PolarHBondContact O-N 2.93Å; L216-L221 HydrophobicContact CB-CD1 4.2Å; L216-L221 HydrophobicContact CD2-CD1 4.09Å; L216-L221 VanDerWaalsContact O-CB 3.31Å; L216-L221 WeakPolarHBondContact O-CB 3.43Å; L216-L221 PolarHBondContact O-N 3.42Å; L216-L225 HydrophobicContact CB-CD1 4.47Å; L216-L225 HydrophobicContact CD1-CD1 3.8Å; L216-V247 HydrophobicContact CD1-CG1 4.2Å; L216-V247 HydrophobicContact CD1-CG2 4.41Å; L216-A263 HydrophobicContact CD2-CB 3.57Å
217	L	95.5	Very high	94.8	Very high	71 Å²	71	51 Å²	51	37%	0.372	27%	0.274	S	S	.	.	H	α-helix	trans	-68.2	-38.2	179.8	-63.3	176.8	0	0	0	112.3	E213 R214 A219 G220	E213-L217 HydrophobicContact CG-CD1 4.06Å; E213-L217 HydrophobicContact CG-CG 4.46Å; E213-L217 WeakPolarHBondContact O-CG 3.45Å; E213-L217 PolarHBondContact O-N 3.39Å; R214-L217 PolarHBondContact O-N 2.89Å; L217-A219 PolarHBondContact O-N 2.89Å; L217-G220 WeakPolarHBondContact O-CA 3.26Å; L217-G220 PolarHBondContact O-N 2.82Å
218	D	95.9	Very high	95	Very high	102 Å²	102	49.5 Å²	49.5	55%	0.545	27%	0.266	S	S	.	.	H	α-helix	trans	-67.7	-24.5	175.6	-73.5	-24.3	0	0	0	112.1	R214 G220	R214-D218 WeakPolarHBondContact CG-OD2 3.46Å; R214-D218 IonicContact CZ-OD1 3.02Å; R214-D218 IonicContact CZ-OD2 3.31Å; R214-D218 VanDerWaalsContact NE-CG 3.32Å; R214-D218 IonicContact NE-OD1 3.42Å; R214-D218 PolarHBondContact NE-OD1 2.9Å; R214-D218 IonicContact NE-OD2 2.79Å; R214-D218 PolarHBondContact NE-OD2 3.36Å; R214-D218 VanDerWaalsContact NE-OD2 3.09Å; R214-D218 IonicContact NH2-OD1 3.45Å; R214-D218 PolarHBondContact NH2-OD1 2.88Å; R214-D218 IonicContact NH2-OD2 3.8Å; R214-D218 WeakPolarHBondContact O-CB 3.24Å; R214-D218 PolarHBondContact O-N 2.96Å; D218-G220 PolarHBondContact O-N 2.81Å
219	A	95	Very high	95	Very high	40 Å²	40	46.3 Å²	46.3	33%	0.331	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	3.6	167.5	0	0	0	0	0	113.3	C198 L215 L216 L217 L221	C198-A219 HydrophobicContact CB-CB 3.85Å; L215-A219 PolarHBondContact O-N 3.06Å; L216-A219 WeakPolarHBondContact O-CB 3.31Å; L216-A219 PolarHBondContact O-N 2.93Å; L217-A219 PolarHBondContact O-N 2.89Å; A219-L221 VanDerWaalsContact C-N 3.3Å; A219-L221 HydrophobicContact CB-CG 4.41Å; A219-L221 PolarHBondContact O-N 2.82Å
220	G	95.8	Very high	95.1	Very high	26 Å²	26	45.6 Å²	45.6	27%	0.268	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.6	10.9	177.5	0	0	0	0	0	114.7	K196 L217 D218	K196-G220 WeakPolarHBondContact CD-O 3.37Å; K196-G220 PolarHBondContact NZ-O 2.78Å; L217-G220 WeakPolarHBondContact O-CA 3.26Å; L217-G220 PolarHBondContact O-N 2.82Å; D218-G220 PolarHBondContact O-N 2.81Å
221	L	97	Very high	94.9	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.016	22%	0.223	C	C	.	.			trans	-73.3	145.5	179.5	-63.6	173.9	0	0	0	111.5	K196 C198 L216 A219 L225 A263 E265	K196-L221 HydrophobicContact CB-CD2 3.8Å; K196-L221 VanDerWaalsContact O-CD2 3.31Å; K196-L221 WeakPolarHBondContact O-CD2 3.24Å; C198-L221 HydrophobicContact CB-CD1 3.85Å; L216-L221 HydrophobicContact CB-CD1 4.2Å; L216-L221 HydrophobicContact CD2-CD1 4.09Å; L216-L221 VanDerWaalsContact O-CB 3.31Å; L216-L221 WeakPolarHBondContact O-CB 3.43Å; L216-L221 PolarHBondContact O-N 3.42Å; A219-L221 VanDerWaalsContact C-N 3.3Å; A219-L221 HydrophobicContact CB-CG 4.41Å; A219-L221 PolarHBondContact O-N 2.82Å; L221-L225 HydrophobicContact CB-CD2 3.61Å; L221-L225 HydrophobicContact CD1-CD2 4.4Å; L221-L225 HydrophobicContact CG-CD2 4.42Å; L221-A263 HydrophobicContact CD1-CB 3.73Å; L221-E265 HydrophobicContact CD2-CG 3.89Å
222	Q	95.3	Very high	94.5	Very high	135 Å²	135	38.7 Å²	38.7	63%	0.631	20%	0.201	S	C	*	.			trans	-127.6	147.5	177.2	-62.3	-176.7	0.4	0	0	110.8	L225	Q222-L225 WeakPolarHBondContact O-CD2 3.44Å
223	Y	96.2	Very high	94	Very high	71 Å²	71	39.2 Å²	39.2	28%	0.278	20%	0.204	S	C	.	.	S	Bend	trans	-64.1	147.4	175.1	-64.6	-73	0	0	0	112.4	L225 R242 D243 R244 V247	Y223-L225 HydrophobicContact CD1-CD1 4.25Å; Y223-L225 HydrophobicContact CD1-CG 4.11Å; Y223-L225 HydrophobicContact CE1-CD1 4.05Å; Y223-L225 HydrophobicContact CE1-CG 4.41Å; Y223-R242 WeakPolarHBondContact CB-O 3.46Å; Y223-D243 VanDerWaalsContact CE1-O 3.26Å; Y223-D243 WeakPolarHBondContact CE1-O 3.42Å; Y223-R244 WeakPolarHBondContact OH-CA 3.41Å; Y223-V247 HydrophobicContact CE1-CB 4.49Å; Y223-V247 HydrophobicContact CE1-CG2 3.55Å
224	P	96.1	Very high	93.1	Very high	53 Å²	53	40.1 Å²	40.1	34%	0.344	22%	0.219	S	C	.	.	S	Bend	cis	-74.4	147.2	-7.4	29.9	-33.3	0	0	0	112.8	I240 V241 R242 M266	P224-I240 HydrophobicContact CB-CG2 4.16Å; P224-V241 CarbonylContact C-O 3.48Å; P224-V241 WeakPolarHBondContact CA-O 3.27Å; P224-R242 HydrophobicContact CB-CG 4.39Å; P224-M266 HydrophobicContact CB-CB 4.4Å; P224-M266 HydrophobicContact CB-SD 4.12Å; P224-M266 HydrophobicContact CG-CB 3.85Å; P224-M266 HydrophobicContact CG-CG 4.31Å; P224-M266 HydrophobicContact CG-SD 3.58Å; P224-M266 VanDerWaalsContact CG-SD 3.58Å; P224-M266 VanDerWaalsContact O-CB 3.3Å; P224-M266 WeakPolarHBondContact O-CB 3.02Å; P224-M266 PolarHBondContact O-N 3.07Å
225	L	96.1	Very high	92.3	Very high	3 Å²	3	36 Å²	36	2%	0.016	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	150.9	178.9	-50.7	171.9	0	0	0	111.1	L216 L221 Q222 Y223 I240 V241 V247 E264	L216-L225 HydrophobicContact CB-CD1 4.47Å; L216-L225 HydrophobicContact CD1-CD1 3.8Å; L221-L225 HydrophobicContact CB-CD2 3.61Å; L221-L225 HydrophobicContact CD1-CD2 4.4Å; L221-L225 HydrophobicContact CG-CD2 4.42Å; Q222-L225 WeakPolarHBondContact O-CD2 3.44Å; Y223-L225 HydrophobicContact CD1-CD1 4.25Å; Y223-L225 HydrophobicContact CD1-CG 4.11Å; Y223-L225 HydrophobicContact CE1-CD1 4.05Å; Y223-L225 HydrophobicContact CE1-CG 4.41Å; L225-I240 CarbonylContact O-C 3.52Å; L225-I240 WeakPolarHBondContact O-CA 3.18Å; L225-V241 HydrophobicContact CB-CG2 3.65Å; L225-V241 HydrophobicContact CD1-CG2 4.25Å; L225-V241 HydrophobicContact CG-CG2 4.31Å; L225-V241 PolarHBondContact N-O 3Å; L225-V241 PolarHBondContact O-N 2.87Å; L225-V247 HydrophobicContact CD1-CG2 4.18Å; L225-E264 WeakPolarHBondContact CA-O 3.11Å
226	V	95.7	Very high	91.6	Very high	23 Å²	23	36.4 Å²	36.4	14%	0.139	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	116	169.2	-178	0	0	0	0	108.9	K228 V238 Q239 I240 A263 E264 M266	V226-K228 HydrophobicContact CG1-CD 4.24Å; V226-V238 HydrophobicContact CG1-CG1 3.76Å; V226-Q239 WeakPolarHBondContact CA-O 3.29Å; V226-I240 HydrophobicContact CG2-CG1 4.46Å; V226-A263 CarbonylContact O-C 3.58Å; V226-A263 WeakPolarHBondContact O-CA 3.43Å; V226-E264 PolarHBondContact N-O 2.78Å; V226-E264 PolarHBondContact O-N 2.88Å; V226-M266 HydrophobicContact CG2-CB 4.15Å; V226-M266 HydrophobicContact CG2-CG 4.34Å
227	L	95.3	Very high	91	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	128.6	173.2	-71.5	156.4	0	0	0	108.8	M200 F212 V238 Q239 V241 W250 I262 A263	M200-L227 HydrophobicContact SD-CD2 4.38Å; F212-L227 HydrophobicContact CZ-CD2 4.24Å; L227-V238 WeakPolarHBondContact O-CA 3.34Å; L227-Q239 PolarHBondContact N-O 3.01Å; L227-Q239 PolarHBondContact O-N 2.83Å; L227-V241 HydrophobicContact CD1-CB 4.35Å; L227-V241 HydrophobicContact CD1-CG1 3.75Å; L227-V241 HydrophobicContact CD1-CG2 3.6Å; L227-V241 HydrophobicContact CG-CG2 4.35Å; L227-W250 HydrophobicContact CB-CZ2 4.29Å; L227-W250 HydrophobicContact CD1-CB 4.24Å; L227-W250 HydrophobicContact CD1-CD2 3.65Å; L227-W250 HydrophobicContact CD1-CE3 4.09Å; L227-W250 HydrophobicContact CD1-CG 3.67Å; L227-W250 HydrophobicContact CD2-CH2 4.42Å; L227-W250 HydrophobicContact CD2-CZ2 4.45Å; L227-W250 HydrophobicContact CD2-CZ3 4.45Å; L227-W250 HydrophobicContact CG-CD2 4.5Å; L227-I262 WeakPolarHBondContact CA-O 3.5Å; L227-A263 HydrophobicContact CD2-CB 3.68Å
228	K	93.3	Very high	90.7	Very high	7 Å²	7	37.5 Å²	37.5	3%	0.03	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	150.2	-178.8	59.4	-168.5	178.4	-178.5	0	111.8	K173 V226 V238 Y261 I262 E264	K173-K228 HydrophobicContact CD-CD 3.64Å; K173-K228 VanDerWaalsContact CD-CE 3.43Å; K173-K228 HydrophobicContact CD-CG 4.07Å; V226-K228 HydrophobicContact CG1-CD 4.24Å; K228-V238 HydrophobicContact CB-CB 4.36Å; K228-V238 HydrophobicContact CB-CG1 4.37Å; K228-V238 HydrophobicContact CB-CG2 3.79Å; K228-Y261 VanDerWaalsContact C-CD1 3.47Å; K228-Y261 WeakPolarHBondContact O-CA 3.12Å; K228-I262 HydrophobicContact CD-CG2 4.25Å; K228-I262 HydrophobicContact CG-CG2 3.48Å; K228-I262 VanDerWaalsContact CG-CG2 3.48Å; K228-I262 PolarHBondContact N-O 2.9Å; K228-I262 WeakPolarHBondContact O-CG2 3.45Å; K228-I262 PolarHBondContact O-N 3.37Å; K228-E264 VanDerWaalsContact CE-CD 3.45Å; K228-E264 VanDerWaalsContact CE-OE2 3.27Å; K228-E264 WeakPolarHBondContact CE-OE2 3.26Å; K228-E264 VanDerWaalsContact NZ-CD 3.28Å; K228-E264 IonicContact NZ-OE1 3.68Å; K228-E264 PolarHBondContact NZ-OE1 2.86Å; K228-E264 IonicContact NZ-OE2 3.64Å; K228-E264 PolarHBondContact NZ-OE2 3.27Å
229	P	92.5	Very high	90.4	Very high	10 Å²	10	34.6 Å²	34.6	7%	0.065	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	140.5	171.9	-20	28.5	0	0	0	110.9	K173 S231 D237 Y261	K173-P229 PolarHBondContact NZ-O 3.04Å; P229-S231 VanDerWaalsContact C-N 3.25Å; P229-S231 PolarHBondContact O-N 3.27Å; P229-D237 VanDerWaalsContact CD-O 3.31Å; P229-D237 WeakPolarHBondContact CD-O 3.29Å; P229-D237 HydrophobicContact CG-CB 3.89Å; P229-Y261 HydrophobicContact CB-CE1 4.41Å; P229-Y261 HydrophobicContact CG-CD1 4.33Å; P229-Y261 HydrophobicContact CG-CE1 3.82Å
230	Q	94.3	Very high	90.4	Very high	15 Å²	15	34.5 Å²	34.5	7%	0.07	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-36.5	-178.7	-64.4	-171.1	14.4	0	0	112	N172 K173 A174 S199 P260 Y261 I262	N172-Q230 WeakPolarHBondContact CA-O 3.41Å; N172-Q230 WeakPolarHBondContact ND2-CB 3.37Å; N172-Q230 PolarHBondContact ND2-OE1 3.27Å; K173-Q230 WeakPolarHBondContact CG-O 3.43Å; K173-Q230 PolarHBondContact N-O 2.79Å; A174-Q230 HydrophobicContact CB-CG 4.46Å; S199-Q230 PolarHBondContact OG-NE2 3.19Å; Q230-P260 HydrophobicContact CB-CB 4.25Å; Q230-P260 HydrophobicContact CG-CB 4.04Å; Q230-P260 PolarHBondContact N-O 2.91Å; Q230-Y261 VanDerWaalsContact CG-C 3.46Å; Q230-Y261 WeakPolarHBondContact CG-O 3.23Å; Q230-Y261 PolarHBondContact NE2-O 3.23Å; Q230-I262 HydrophobicContact CG-CB 4.17Å; Q230-I262 HydrophobicContact CG-CG2 4.49Å
231	S	90.7	Very high	90.4	Very high	3 Å²	3	33.3 Å²	33.3	2%	0.021	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-117.7	31.9	-170.5	-54	0	0	0	0	112	D112 L113 N172 P229	D112-S231 CarbonylContact C-O 3.55Å; D112-S231 WeakPolarHBondContact CA-O 3.41Å; D112-S231 VanDerWaalsContact OD1-CB 3.22Å; D112-S231 WeakPolarHBondContact OD1-CB 3.36Å; L113-S231 VanDerWaalsContact CB-O 3.3Å; L113-S231 WeakPolarHBondContact CB-O 3.35Å; L113-S231 WeakPolarHBondContact CD1-O 3.36Å; L113-S231 WeakPolarHBondContact CG-O 3.33Å; L113-S231 PolarHBondContact N-O 3.49Å; N172-S231 PolarHBondContact ND2-OG 2.99Å; P229-S231 VanDerWaalsContact C-N 3.25Å; P229-S231 PolarHBondContact O-N 3.27Å
232	S	85.3	Confident	90.4	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.014	21%	0.207	C	C	.	.			trans	-100.8	170.9	173.2	69.3	0	0	0	0	112.6	C111 K173 F236	C111-S232 WeakPolarHBondContact O-CB 3.43Å; K173-S232 PolarHBondContact NZ-O 2.92Å; S232-F236 PolarHBondContact OG-O 3.3Å
233	C	83.7	Confident	90.5	Very high	14 Å²	14	36 Å²	36	10%	0.095	19%	0.194	C	C	.	.			trans	-134.2	166.5	173.5	69.2	0	0	0	0	112.1	L113 E144 S235 F236	L113-C233 HydrophobicContact CD1-CB 4.35Å; L113-C233 HydrophobicContact CD2-CB 4.4Å; E144-C233 HydrophobicContact CB-CB 4.42Å; E144-C233 HydrophobicContact CG-CB 4.22Å; E144-C233 WeakPolarHBondContact OE1-CB 3.38Å; E144-C233 WeakPolarHBondContact OE2-CB 3.35Å; C233-S235 PolarHBondContact O-N 2.77Å; C233-F236 WeakPolarHBondContact O-CB 3.46Å; C233-F236 PolarHBondContact O-N 2.94Å
234	G	75.9	Confident	90.5	Very high	41 Å²	41	39.1 Å²	39.1	42%	0.423	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.7	27.2	171.6	0	0	0	0	0	115.3	F236	G234-F236 PolarHBondContact O-N 3.19Å
235	S	78.6	Confident	90.6	Very high	62 Å²	62	41.7 Å²	41.7	43%	0.434	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	19.6	-174.4	-52.8	0	0	0	0	114.4	C233 D237 V238	C233-S235 PolarHBondContact O-N 2.77Å; S235-D237 PolarHBondContact O-N 3.38Å; S235-V238 PolarHBondContact O-N 3.3Å
236	F	79.4	Confident	90.7	Very high	82 Å²	82	43.4 Å²	43.4	36%	0.36	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	125.7	175.2	-177.6	-89.4	0	0	0	110.6	C111 S232 C233 G234 V238	C111-F236 HydrophobicContact CB-CD1 4.32Å; C111-F236 HydrophobicContact CB-CE1 3.82Å; C111-F236 HydrophobicContact CB-CZ 4.44Å; C111-F236 WeakPolarHBondContact SG-CE1 3.39Å; C111-F236 WeakPolarHBondContact SG-CZ 3.17Å; S232-F236 PolarHBondContact OG-O 3.3Å; C233-F236 WeakPolarHBondContact O-CB 3.46Å; C233-F236 PolarHBondContact O-N 2.94Å; G234-F236 PolarHBondContact O-N 3.19Å; F236-V238 PolarHBondContact O-N 3.05Å
237	D	83.6	Confident	90.7	Very high	40 Å²	40	42.3 Å²	42.3	21%	0.214	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	32.6	178.5	-164.5	24.4	0	0	0	114.3	P229 S235 Q239 H254 Y261	P229-D237 VanDerWaalsContact CD-O 3.31Å; P229-D237 WeakPolarHBondContact CD-O 3.29Å; P229-D237 HydrophobicContact CG-CB 3.89Å; S235-D237 PolarHBondContact O-N 3.38Å; D237-Q239 PolarHBondContact OD1-NE2 3.29Å; D237-H254 IonicContact OD1-NE2 3.69Å; D237-H254 IonicContact OD2-CD2 3.62Å; D237-Y261 PolarHBondContact OD2-OH 3.48Å
238	V	88.4	Confident	90.8	Very high	56 Å²	56	44.7 Å²	44.7	34%	0.339	23%	0.232	S	C	.	.			trans	-85.1	121.4	169.4	-179.6	0	0	0	0	108.6	V226 L227 K228 S235 F236	V226-V238 HydrophobicContact CG1-CG1 3.76Å; L227-V238 WeakPolarHBondContact O-CA 3.34Å; K228-V238 HydrophobicContact CB-CB 4.36Å; K228-V238 HydrophobicContact CB-CG1 4.37Å; K228-V238 HydrophobicContact CB-CG2 3.79Å; S235-V238 PolarHBondContact O-N 3.3Å; F236-V238 PolarHBondContact O-N 3.05Å
239	Q	91.3	Very high	91	Very high	40 Å²	40	49.5 Å²	49.5	19%	0.187	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	137.4	-179.8	-58.7	-170.2	40.2	0	0	110.5	V226 L227 D237 W250 H254	V226-Q239 WeakPolarHBondContact CA-O 3.29Å; L227-Q239 PolarHBondContact N-O 3.01Å; L227-Q239 PolarHBondContact O-N 2.83Å; D237-Q239 PolarHBondContact OD1-NE2 3.29Å; Q239-W250 VanDerWaalsContact CD-CD1 3.49Å; Q239-W250 VanDerWaalsContact OE1-CD1 3.28Å; Q239-H254 PolarHBondContact NE2-CE1 2.99Å; Q239-H254 PolarHBondContact NE2-NE2 2.83Å
240	I	94	Very high	91.1	Very high	38 Å²	38	49 Å²	49	20%	0.195	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	119.7	172.1	-58.6	173.5	0	0	0	106.7	P224 L225 V226 M266	P224-I240 HydrophobicContact CB-CG2 4.16Å; L225-I240 CarbonylContact O-C 3.52Å; L225-I240 WeakPolarHBondContact O-CA 3.18Å; V226-I240 HydrophobicContact CG2-CG1 4.46Å; I240-M266 HydrophobicContact CD1-CE 4.22Å; I240-M266 HydrophobicContact CD1-SD 4.46Å; I240-M266 HydrophobicContact CG2-SD 4.06Å
241	V	95.9	Very high	91.1	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.006	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121.9	175.9	-63.2	0	0	0	0	109.8	P224 L225 L227 E246 V247 W250	P224-V241 CarbonylContact C-O 3.48Å; P224-V241 WeakPolarHBondContact CA-O 3.27Å; L225-V241 HydrophobicContact CB-CG2 3.65Å; L225-V241 HydrophobicContact CD1-CG2 4.25Å; L225-V241 HydrophobicContact CG-CG2 4.31Å; L225-V241 PolarHBondContact N-O 3Å; L225-V241 PolarHBondContact O-N 2.87Å; L227-V241 HydrophobicContact CD1-CB 4.35Å; L227-V241 HydrophobicContact CD1-CG1 3.75Å; L227-V241 HydrophobicContact CD1-CG2 3.6Å; L227-V241 HydrophobicContact CG-CG2 4.35Å; V241-E246 VanDerWaalsContact CA-OE2 3.27Å; V241-E246 WeakPolarHBondContact CA-OE2 3.47Å; V241-E246 HydrophobicContact CB-CB 3.88Å; V241-E246 HydrophobicContact CG1-CB 4.05Å; V241-V247 HydrophobicContact CB-CG2 3.98Å; V241-V247 HydrophobicContact CG2-CG2 3.47Å; V241-V247 VanDerWaalsContact CG2-CG2 3.47Å; V241-W250 HydrophobicContact CG1-CB 4.2Å
242	R	96.3	Very high	91.2	Very high	128 Å²	128	53 Å²	53	48%	0.483	28%	0.275	S	S	.	.			trans	-94.6	-19.6	-169.2	-64.9	178.4	-176.3	76.4	1.1	113.9	Y223 P224 E246	Y223-R242 WeakPolarHBondContact CB-O 3.46Å; P224-R242 HydrophobicContact CB-CG 4.39Å; R242-E246 PolarHBondContact N-OE2 2.9Å; R242-E246 IonicContact NH1-OE1 2.81Å; R242-E246 PolarHBondContact NH1-OE1 3.37Å; R242-E246 IonicContact NH1-OE2 2.93Å
243	D	97.6	Very high	91.6	Very high	67 Å²	67	57.2 Å²	57.2	36%	0.358	29%	0.294	S	S	.	.	S	Bend	trans	-155.9	178.9	-175.5	59.2	47.9	0	0	0	111.3	Y223 T245 E246 V247	Y223-D243 VanDerWaalsContact CE1-O 3.26Å; Y223-D243 WeakPolarHBondContact CE1-O 3.42Å; D243-T245 VanDerWaalsContact C-N 3.3Å; D243-T245 PolarHBondContact O-N 2.81Å; D243-T245 WeakPolarHBondContact OD1-CA 3.32Å; D243-T245 VanDerWaalsContact OD1-CB 3.27Å; D243-T245 WeakPolarHBondContact OD1-CB 3.35Å; D243-T245 PolarHBondContact OD1-N 2.91Å; D243-E246 PolarHBondContact O-N 2.77Å; D243-E246 PolarHBondContact OD1-N 3.45Å; D243-V247 PolarHBondContact O-N 3.35Å
244	R	97.5	Very high	91.9	Very high	136 Å²	136	57.3 Å²	57.3	51%	0.513	29%	0.293	S	S	.	.	H	α-helix	trans	-54.5	-43.6	176.8	179	170.3	-162.5	-153.5	-0.5	113.1	E213 Y223 V247 H248	E213-R244 WeakPolarHBondContact OE1-CD 3.31Å; E213-R244 WeakPolarHBondContact OE1-CG 3.4Å; E213-R244 IonicContact OE1-NE 3.99Å; E213-R244 PolarHBondContact OE1-NE 3.34Å; E213-R244 WeakPolarHBondContact OE2-CG 3.47Å; E213-R244 IonicContact OE2-CZ 2.83Å; E213-R244 IonicContact OE2-NE 3.99Å; E213-R244 PolarHBondContact OE2-NE 2.93Å; E213-R244 IonicContact OE2-NH2 3.09Å; Y223-R244 WeakPolarHBondContact OH-CA 3.41Å; R244-V247 PolarHBondContact O-N 2.97Å; R244-H248 WeakPolarHBondContact O-CB 3.28Å; R244-H248 PolarHBondContact O-CD2 2.58Å; R244-H248 PolarHBondContact O-N 3.47Å
245	T	97.7	Very high	92.5	Very high	107 Å²	107	55.5 Å²	55.5	66%	0.656	28%	0.275	S	S	*	.	H	α-helix	trans	-63.6	-45.6	-177.8	-55.1	0	0	0	0	110.4	D243 H248 R249	D243-T245 VanDerWaalsContact C-N 3.3Å; D243-T245 PolarHBondContact O-N 2.81Å; D243-T245 WeakPolarHBondContact OD1-CA 3.32Å; D243-T245 VanDerWaalsContact OD1-CB 3.27Å; D243-T245 WeakPolarHBondContact OD1-CB 3.35Å; D243-T245 PolarHBondContact OD1-N 2.91Å; T245-H248 PolarHBondContact O-N 3.26Å; T245-R249 WeakPolarHBondContact O-CB 3.39Å; T245-R249 PolarHBondContact O-N 3.14Å
246	E	97.7	Very high	92.8	Very high	40 Å²	40	59.5 Å²	59.5	19%	0.187	29%	0.286	C	S	.	.	H	α-helix	trans	-65.7	-37.7	177.2	-70.2	-172.1	173	0	0	112.3	V241 R242 D243 W250	V241-E246 VanDerWaalsContact CA-OE2 3.27Å; V241-E246 WeakPolarHBondContact CA-OE2 3.47Å; V241-E246 HydrophobicContact CB-CB 3.88Å; V241-E246 HydrophobicContact CG1-CB 4.05Å; R242-E246 PolarHBondContact N-OE2 2.9Å; R242-E246 IonicContact NH1-OE1 2.81Å; R242-E246 PolarHBondContact NH1-OE1 3.37Å; R242-E246 IonicContact NH1-OE2 2.93Å; D243-E246 PolarHBondContact O-N 2.77Å; D243-E246 PolarHBondContact OD1-N 3.45Å; E246-W250 WeakPolarHBondContact O-CB 3.5Å; E246-W250 PolarHBondContact O-N 3.45Å
247	V	96.8	Very high	93.1	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.6	-45.1	172.6	163	0	0	0	0	111.8	F212 E213 L216 Y223 L225 V241 D243 R244 R249 W250 H251	F212-V247 HydrophobicContact CD1-CG1 3.79Å; F212-V247 HydrophobicContact CE1-CG1 3.98Å; E213-V247 HydrophobicContact CB-CG1 4.2Å; L216-V247 HydrophobicContact CD1-CG1 4.2Å; L216-V247 HydrophobicContact CD1-CG2 4.41Å; Y223-V247 HydrophobicContact CE1-CB 4.49Å; Y223-V247 HydrophobicContact CE1-CG2 3.55Å; L225-V247 HydrophobicContact CD1-CG2 4.18Å; V241-V247 HydrophobicContact CB-CG2 3.98Å; V241-V247 HydrophobicContact CG2-CG2 3.47Å; V241-V247 VanDerWaalsContact CG2-CG2 3.47Å; D243-V247 PolarHBondContact O-N 3.35Å; R244-V247 PolarHBondContact O-N 2.97Å; V247-R249 VanDerWaalsContact C-N 3.34Å; V247-R249 PolarHBondContact O-N 3.41Å; V247-W250 PolarHBondContact O-N 2.91Å; V247-H251 WeakPolarHBondContact O-CB 3.37Å; V247-H251 PolarHBondContact O-N 2.9Å
248	H	96.6	Very high	93.2	Very high	49 Å²	49	60.9 Å²	60.9	23%	0.227	30%	0.302	C	S	.	.	H	α-helix	trans	-65.5	-40.9	-179	-77.5	-148.5	0	0	0	111.4	E213 R244 T245 H251 S252	E213-H248 IonicContact OE2-CD2 2.93Å; E213-H248 IonicContact OE2-CE1 3.44Å; E213-H248 IonicContact OE2-NE2 2.8Å; E213-H248 PolarHBondContact OE2-NE2 2.67Å; R244-H248 WeakPolarHBondContact O-CB 3.28Å; R244-H248 PolarHBondContact O-CD2 2.58Å; R244-H248 PolarHBondContact O-N 3.47Å; T245-H248 PolarHBondContact O-N 3.26Å; H248-H251 PolarHBondContact O-N 2.98Å; H248-S252 PolarHBondContact O-N 2.95Å
249	R	96.6	Very high	93.1	Very high	108 Å²	108	61.8 Å²	61.8	41%	0.408	30%	0.301	S	S	.	.	H	α-helix	trans	-61.4	-50	173.1	-177.9	178.3	59.5	75.1	2.9	111	T245 V247 H251 S252 E253	T245-R249 WeakPolarHBondContact O-CB 3.39Å; T245-R249 PolarHBondContact O-N 3.14Å; V247-R249 VanDerWaalsContact C-N 3.34Å; V247-R249 PolarHBondContact O-N 3.41Å; R249-H251 VanDerWaalsContact C-N 3.29Å; R249-H251 PolarHBondContact O-N 2.88Å; R249-S252 WeakPolarHBondContact O-CB 3.42Å; R249-S252 PolarHBondContact O-N 2.95Å; R249-S252 VanDerWaalsContact O-N 3.08Å; R249-S252 PolarHBondContact O-OG 3.26Å; R249-E253 VanDerWaalsContact CG-OE1 3.24Å; R249-E253 WeakPolarHBondContact CG-OE1 3.45Å; R249-E253 IonicContact NH1-OE1 3.1Å; R249-E253 PolarHBondContact NH1-OE1 2.98Å; R249-E253 IonicContact NH1-OE2 2.9Å; R249-E253 PolarHBondContact NH1-OE2 3.12Å; R249-E253 WeakPolarHBondContact O-CG 2.99Å; R249-E253 PolarHBondContact O-N 3.09Å; R249-E253 VanDerWaalsContact O-N 3.1Å
250	W	95.7	Very high	93.1	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-55.4	-46.4	177.2	-176	92.6	0	0	0	111.7	T202 F212 L227 Q239 V241 E246 V247 S252 E253 H254 Y261	T202-W250 HydrophobicContact CG2-CH2 3.98Å; T202-W250 HydrophobicContact CG2-CZ3 4.31Å; F212-W250 AromaticContact CE1-CE3 3.82Å; F212-W250 HydrophobicContact CE1-CE3 3.82Å; F212-W250 AromaticContact CE1-CZ3 3.95Å; F212-W250 HydrophobicContact CE1-CZ3 3.95Å; F212-W250 HydrophobicContact CE2-CZ3 4.05Å; F212-W250 AromaticContact CZ-CE3 3.77Å; F212-W250 HydrophobicContact CZ-CE3 3.77Å; F212-W250 HydrophobicContact CZ-CH2 4.39Å; F212-W250 AromaticContact CZ-CZ3 3.41Å; F212-W250 HydrophobicContact CZ-CZ3 3.41Å; F212-W250 VanDerWaalsContact CZ-CZ3 3.41Å; L227-W250 HydrophobicContact CB-CZ2 4.29Å; L227-W250 HydrophobicContact CD1-CB 4.24Å; L227-W250 HydrophobicContact CD1-CD2 3.65Å; L227-W250 HydrophobicContact CD1-CE3 4.09Å; L227-W250 HydrophobicContact CD1-CG 3.67Å; L227-W250 HydrophobicContact CD2-CH2 4.42Å; L227-W250 HydrophobicContact CD2-CZ2 4.45Å; L227-W250 HydrophobicContact CD2-CZ3 4.45Å; L227-W250 HydrophobicContact CG-CD2 4.5Å; Q239-W250 VanDerWaalsContact CD-CD1 3.49Å; Q239-W250 VanDerWaalsContact OE1-CD1 3.28Å; V241-W250 HydrophobicContact CG1-CB 4.2Å; E246-W250 WeakPolarHBondContact O-CB 3.5Å; E246-W250 PolarHBondContact O-N 3.45Å; V247-W250 PolarHBondContact O-N 2.91Å; W250-S252 VanDerWaalsContact C-N 3.31Å; W250-S252 PolarHBondContact O-N 3.49Å; W250-E253 PolarHBondContact O-N 3.22Å; W250-E253 VanDerWaalsContact O-N 3.15Å; W250-H254 AromaticContact CD1-CE1 3.8Å; W250-H254 AromaticContact CD1-ND1 3.59Å; W250-H254 HydrophobicContact CD2-CB 4.13Å; W250-H254 AromaticContact CD2-ND1 3.83Å; W250-H254 AromaticContact CE2-CG 3.6Å; W250-H254 AromaticContact CE2-ND1 3.66Å; W250-H254 HydrophobicContact CE3-CB 4.23Å; W250-H254 AromaticContact CG-ND1 3.79Å; W250-H254 HydrophobicContact CH2-CB 3.76Å; W250-H254 HydrophobicContact CZ2-CB 3.64Å; W250-H254 AromaticContact CZ2-CG 3.79Å; W250-H254 HydrophobicContact CZ3-CB 4.06Å; W250-H254 AromaticContact NE1-CE1 3.74Å; W250-H254 AromaticContact NE1-CG 3.73Å; W250-H254 AromaticContact NE1-ND1 3.48Å; W250-H254 PolarHBondContact NE1-ND1 3.34Å; W250-H254 PolarHBondContact O-N 3.45Å; W250-H254 PolarHBondContact O-ND1 2.92Å; W250-Y261 AromaticContact CH2-CD1 3.95Å; W250-Y261 HydrophobicContact CH2-CD1 3.95Å; W250-Y261 AromaticContact CH2-CD2 4Å; W250-Y261 HydrophobicContact CH2-CD2 4Å; W250-Y261 HydrophobicContact CH2-CE1 4.29Å; W250-Y261 HydrophobicContact CH2-CE2 4.27Å; W250-Y261 AromaticContact CH2-CG 3.81Å; W250-Y261 HydrophobicContact CH2-CG 3.81Å; W250-Y261 AromaticContact CZ2-CD1 3.52Å; W250-Y261 HydrophobicContact CZ2-CD1 3.52Å; W250-Y261 HydrophobicContact CZ2-CD2 4.27Å; W250-Y261 AromaticContact CZ2-CE1 3.6Å; W250-Y261 HydrophobicContact CZ2-CE1 3.6Å; W250-Y261 HydrophobicContact CZ2-CE2 4.3Å; W250-Y261 AromaticContact CZ2-CG 3.89Å; W250-Y261 HydrophobicContact CZ2-CG 3.89Å; W250-Y261 AromaticContact CZ2-CZ 3.98Å
251	H	94.7	Very high	93.1	Very high	18 Å²	18	59.2 Å²	59.2	8%	0.083	29%	0.29	C	S	.	.	H	α-helix	trans	-62	-38.6	178.3	-179.2	-96.8	0	0	0	112.1	M207 S209 F212 V247 H248 R249 E253 G255	M207-H251 PolarHBondContact O-CE1 3.27Å; S209-H251 WeakPolarHBondContact CA-ND1 3.28Å; S209-H251 PolarHBondContact OG-ND1 2.97Å; F212-H251 HydrophobicContact CD1-CB 3.86Å; F212-H251 AromaticContact CD1-CD2 3.86Å; F212-H251 AromaticContact CD2-CD2 3.69Å; F212-H251 HydrophobicContact CE1-CB 4.31Å; F212-H251 HydrophobicContact CG-CB 4.3Å; F212-H251 AromaticContact CG-CD2 3.42Å; F212-H251 VanDerWaalsContact CG-CD2 3.42Å; F212-H251 WeakPolarHBondContact CG-CD2 3.41Å; F212-H251 AromaticContact CG-CG 4Å; V247-H251 WeakPolarHBondContact O-CB 3.37Å; V247-H251 PolarHBondContact O-N 2.9Å; H248-H251 PolarHBondContact O-N 2.98Å; R249-H251 VanDerWaalsContact C-N 3.29Å; R249-H251 PolarHBondContact O-N 2.88Å; H251-E253 VanDerWaalsContact C-N 3.29Å; H251-E253 PolarHBondContact O-N 3.02Å; H251-G255 WeakPolarHBondContact O-CA 3.43Å; H251-G255 PolarHBondContact O-N 3.06Å
252	S	93	Very high	93.1	Very high	84 Å²	84	59.1 Å²	59.1	59%	0.587	29%	0.29	S	S	*	.	H	α-helix	trans	-63.7	-35.1	175.7	76.3	0	0	0	0	112.9	H248 R249 W250	H248-S252 PolarHBondContact O-N 2.95Å; R249-S252 WeakPolarHBondContact O-CB 3.42Å; R249-S252 PolarHBondContact O-N 2.95Å; R249-S252 VanDerWaalsContact O-N 3.08Å; R249-S252 PolarHBondContact O-OG 3.26Å; W250-S252 VanDerWaalsContact C-N 3.31Å; W250-S252 PolarHBondContact O-N 3.49Å
253	E	92.2	Very high	93.1	Very high	91 Å²	91	53 Å²	53	43%	0.425	27%	0.267	S	S	.	.	H	α-helix	trans	-81.2	-34	-178.5	-68.4	166.9	-171.6	0	0	112.4	R249 W250 H251	R249-E253 VanDerWaalsContact CG-OE1 3.24Å; R249-E253 WeakPolarHBondContact CG-OE1 3.45Å; R249-E253 IonicContact NH1-OE1 3.1Å; R249-E253 PolarHBondContact NH1-OE1 2.98Å; R249-E253 IonicContact NH1-OE2 2.9Å; R249-E253 PolarHBondContact NH1-OE2 3.12Å; R249-E253 WeakPolarHBondContact O-CG 2.99Å; R249-E253 PolarHBondContact O-N 3.09Å; R249-E253 VanDerWaalsContact O-N 3.1Å; W250-E253 PolarHBondContact O-N 3.22Å; W250-E253 VanDerWaalsContact O-N 3.15Å; H251-E253 VanDerWaalsContact C-N 3.29Å; H251-E253 PolarHBondContact O-N 3.02Å
254	H	91.5	Very high	93	Very high	16 Å²	16	50 Å²	50	7%	0.074	25%	0.251	C	S	.	.	H	α-helix	trans	-116.7	-16.5	-168.7	-56.1	76.5	0	0	0	114.4	T202 D237 Q239 W250 Q256 L257	T202-H254 WeakPolarHBondContact CB-O 3.48Å; T202-H254 PolarHBondContact OG1-O 3.06Å; D237-H254 IonicContact OD1-NE2 3.69Å; D237-H254 IonicContact OD2-CD2 3.62Å; Q239-H254 PolarHBondContact NE2-CE1 2.99Å; Q239-H254 PolarHBondContact NE2-NE2 2.83Å; W250-H254 AromaticContact CD1-CE1 3.8Å; W250-H254 AromaticContact CD1-ND1 3.59Å; W250-H254 HydrophobicContact CD2-CB 4.13Å; W250-H254 AromaticContact CD2-ND1 3.83Å; W250-H254 AromaticContact CE2-CG 3.6Å; W250-H254 AromaticContact CE2-ND1 3.66Å; W250-H254 HydrophobicContact CE3-CB 4.23Å; W250-H254 AromaticContact CG-ND1 3.79Å; W250-H254 HydrophobicContact CH2-CB 3.76Å; W250-H254 HydrophobicContact CZ2-CB 3.64Å; W250-H254 AromaticContact CZ2-CG 3.79Å; W250-H254 HydrophobicContact CZ3-CB 4.06Å; W250-H254 AromaticContact NE1-CE1 3.74Å; W250-H254 AromaticContact NE1-CG 3.73Å; W250-H254 AromaticContact NE1-ND1 3.48Å; W250-H254 PolarHBondContact NE1-ND1 3.34Å; W250-H254 PolarHBondContact O-N 3.45Å; W250-H254 PolarHBondContact O-ND1 2.92Å; H254-Q256 PolarHBondContact O-N 3.34Å; H254-L257 HydrophobicContact CB-CD1 4.02Å; H254-L257 WeakPolarHBondContact O-CB 3.37Å; H254-L257 PolarHBondContact O-N 2.73Å
255	G	87	Confident	93	Very high	3 Å²	3	45.5 Å²	45.5	3%	0.031	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-19.5	-171.8	0	0	0	0	0	114.2	G203 H251	G203-G255 VanDerWaalsContact CA-O 3.26Å; G203-G255 WeakPolarHBondContact CA-O 3.16Å; G203-G255 PolarHBondContact N-O 2.84Å; H251-G255 WeakPolarHBondContact O-CA 3.43Å; H251-G255 PolarHBondContact O-N 3.06Å
256	Q	86.2	Confident	92.8	Very high	145 Å²	145	44.3 Å²	44.3	68%	0.678	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-0.1	178.8	-59.2	-57.3	-34	0	0	114.3	H254 C258	H254-Q256 PolarHBondContact O-N 3.34Å; Q256-C258 PolarHBondContact O-N 2.79Å
257	L	84.3	Confident	92.7	Very high	78 Å²	78	43.2 Å²	43.2	41%	0.408	22%	0.219	S	C	.	.	S	Bend	trans	-74.7	-4.6	-170.9	-65.8	178.2	0	0	0	115.1	H254 K259	H254-L257 HydrophobicContact CB-CD1 4.02Å; H254-L257 WeakPolarHBondContact O-CB 3.37Å; H254-L257 PolarHBondContact O-N 2.73Å; L257-K259 HydrophobicContact CB-CD 4.26Å; L257-K259 WeakPolarHBondContact O-CG 3.46Å; L257-K259 PolarHBondContact O-N 3.02Å
258	C	85.7	Confident	92.5	Very high	73 Å²	73	45.4 Å²	45.4	49%	0.493	24%	0.237	S	C	.	.			trans	54	44.9	-178.1	-73.4	0	0	0	0	113.9	F201 T202 Q256	F201-C258 HydrophobicContact CE1-CB 4.34Å; F201-C258 VanDerWaalsContact CZ-O 3.3Å; F201-C258 WeakPolarHBondContact CZ-O 3.23Å; T202-C258 WeakPolarHBondContact O-CA 3.48Å; T202-C258 PolarHBondContact OG1-N 3.25Å; Q256-C258 PolarHBondContact O-N 2.79Å
259	K	86.6	Confident	92.5	Very high	75 Å²	75	44.9 Å²	44.9	33%	0.326	24%	0.244	S	C	.	.			trans	-129	149.4	-173	-78.3	174.4	-173.2	-179.4	0	113.5	T202 L257 Y261	T202-K259 PolarHBondContact N-O 2.72Å; T202-K259 PolarHBondContact OG1-N 2.88Å; T202-K259 VanDerWaalsContact OG1-N 3.07Å; T202-K259 PolarHBondContact OG1-O 3.23Å; L257-K259 HydrophobicContact CB-CD 4.26Å; L257-K259 WeakPolarHBondContact O-CG 3.46Å; L257-K259 PolarHBondContact O-N 3.02Å; K259-Y261 HydrophobicContact CB-CD2 4.26Å; K259-Y261 HydrophobicContact CB-CE2 3.71Å; K259-Y261 WeakPolarHBondContact O-CD2 3.44Å
260	P	91.4	Very high	92.5	Very high	22 Å²	22	42.5 Å²	42.5	14%	0.143	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	122.5	174.9	31.1	-33.2	0	0	0	111.6	M200 F201 Q230	M200-P260 WeakPolarHBondContact O-CA 3.32Å; F201-P260 HydrophobicContact CD2-CB 4.19Å; Q230-P260 HydrophobicContact CB-CB 4.25Å; Q230-P260 HydrophobicContact CG-CB 4.04Å; Q230-P260 PolarHBondContact N-O 2.91Å
261	Y	93.7	Very high	92.6	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.008	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	161.1	173.7	-74.3	-93.8	0	0	0	111.7	M200 T202 K228 P229 Q230 D237 W250 K259	M200-Y261 PolarHBondContact N-O 3.34Å; M200-Y261 PolarHBondContact O-N 2.86Å; M200-Y261 VanDerWaalsContact O-O 3.05Å; T202-Y261 HydrophobicContact CG2-CD2 3.63Å; T202-Y261 HydrophobicContact CG2-CE2 3.98Å; K228-Y261 VanDerWaalsContact C-CD1 3.47Å; K228-Y261 WeakPolarHBondContact O-CA 3.12Å; P229-Y261 HydrophobicContact CB-CE1 4.41Å; P229-Y261 HydrophobicContact CG-CD1 4.33Å; P229-Y261 HydrophobicContact CG-CE1 3.82Å; Q230-Y261 VanDerWaalsContact CG-C 3.46Å; Q230-Y261 WeakPolarHBondContact CG-O 3.23Å; Q230-Y261 PolarHBondContact NE2-O 3.23Å; D237-Y261 PolarHBondContact OD2-OH 3.48Å; W250-Y261 AromaticContact CH2-CD1 3.95Å; W250-Y261 HydrophobicContact CH2-CD1 3.95Å; W250-Y261 AromaticContact CH2-CD2 4Å; W250-Y261 HydrophobicContact CH2-CD2 4Å; W250-Y261 HydrophobicContact CH2-CE1 4.29Å; W250-Y261 HydrophobicContact CH2-CE2 4.27Å; W250-Y261 AromaticContact CH2-CG 3.81Å; W250-Y261 HydrophobicContact CH2-CG 3.81Å; W250-Y261 AromaticContact CZ2-CD1 3.52Å; W250-Y261 HydrophobicContact CZ2-CD1 3.52Å; W250-Y261 HydrophobicContact CZ2-CD2 4.27Å; W250-Y261 AromaticContact CZ2-CE1 3.6Å; W250-Y261 HydrophobicContact CZ2-CE1 3.6Å; W250-Y261 HydrophobicContact CZ2-CE2 4.3Å; W250-Y261 AromaticContact CZ2-CG 3.89Å; W250-Y261 HydrophobicContact CZ2-CG 3.89Å; W250-Y261 AromaticContact CZ2-CZ 3.98Å; K259-Y261 HydrophobicContact CB-CD2 4.26Å; K259-Y261 HydrophobicContact CB-CE2 3.71Å; K259-Y261 WeakPolarHBondContact O-CD2 3.44Å
262	I	95.6	Very high	92.7	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	134.4	167.2	-173.7	168.3	0	0	0	108.6	K173 A174 R177 F197 C198 L227 K228 Q230 E264	K173-I262 HydrophobicContact CB-CD1 4.49Å; K173-I262 HydrophobicContact CB-CG2 4.1Å; A174-I262 HydrophobicContact CB-CD1 4.2Å; R177-I262 HydrophobicContact CG-CD1 4.07Å; F197-I262 HydrophobicContact CB-CD1 4.02Å; F197-I262 HydrophobicContact CB-CG1 4.2Å; F197-I262 HydrophobicContact CD2-CD1 3.69Å; F197-I262 HydrophobicContact CD2-CG1 4.23Å; F197-I262 HydrophobicContact CG-CD1 4.16Å; C198-I262 WeakPolarHBondContact O-CA 3.44Å; L227-I262 WeakPolarHBondContact CA-O 3.5Å; K228-I262 HydrophobicContact CD-CG2 4.25Å; K228-I262 HydrophobicContact CG-CG2 3.48Å; K228-I262 VanDerWaalsContact CG-CG2 3.48Å; K228-I262 PolarHBondContact N-O 2.9Å; K228-I262 WeakPolarHBondContact O-CG2 3.45Å; K228-I262 PolarHBondContact O-N 3.37Å; Q230-I262 HydrophobicContact CG-CB 4.17Å; Q230-I262 HydrophobicContact CG-CG2 4.49Å; I262-E264 HydrophobicContact CD1-CG 3.96Å; I262-E264 VanDerWaalsContact CD1-OE1 3.25Å; I262-E264 WeakPolarHBondContact CD1-OE1 3.38Å; I262-E264 HydrophobicContact CG1-CG 3.79Å
263	A	97	Very high	92.9	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	135.2	164.3	0	0	0	0	0	108.6	F197 C198 M200 L216 L221 V226 L227	F197-A263 CarbonylContact C-O 3.37Å; F197-A263 WeakPolarHBondContact CA-O 3.3Å; C198-A263 HydrophobicContact CB-CB 4.48Å; C198-A263 PolarHBondContact N-O 3.14Å; C198-A263 PolarHBondContact O-N 3.08Å; M200-A263 HydrophobicContact CE-CB 3.7Å; L216-A263 HydrophobicContact CD2-CB 3.57Å; L221-A263 HydrophobicContact CD1-CB 3.73Å; V226-A263 CarbonylContact O-C 3.58Å; V226-A263 WeakPolarHBondContact O-CA 3.43Å; L227-A263 HydrophobicContact CD2-CB 3.68Å
264	E	96.8	Very high	93.2	Very high	3 Å²	3	33.7 Å²	33.7	1%	0.014	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	158.6	177.8	-54.2	-176.2	159.6	0	0	109.9	R177 F197 L225 V226 K228 I262	R177-E264 IonicContact CZ-OE1 3.05Å; R177-E264 IonicContact CZ-OE2 3.66Å; R177-E264 VanDerWaalsContact NE-CD 3.33Å; R177-E264 IonicContact NE-OE1 2.79Å; R177-E264 PolarHBondContact NE-OE1 3.41Å; R177-E264 IonicContact NE-OE2 3.66Å; R177-E264 VanDerWaalsContact NH2-CD 3.34Å; R177-E264 IonicContact NH2-OE1 3.69Å; R177-E264 PolarHBondContact NH2-OE1 3.25Å; R177-E264 IonicContact NH2-OE2 2.79Å; R177-E264 PolarHBondContact NH2-OE2 2.93Å; F197-E264 HydrophobicContact CB-CG 3.92Å; L225-E264 WeakPolarHBondContact CA-O 3.11Å; V226-E264 PolarHBondContact N-O 2.78Å; V226-E264 PolarHBondContact O-N 2.88Å; K228-E264 VanDerWaalsContact CE-CD 3.45Å; K228-E264 VanDerWaalsContact CE-OE2 3.27Å; K228-E264 WeakPolarHBondContact CE-OE2 3.26Å; K228-E264 VanDerWaalsContact NZ-CD 3.28Å; K228-E264 IonicContact NZ-OE1 3.68Å; K228-E264 PolarHBondContact NZ-OE1 2.86Å; K228-E264 IonicContact NZ-OE2 3.64Å; K228-E264 PolarHBondContact NZ-OE2 3.27Å; I262-E264 HydrophobicContact CD1-CG 3.96Å; I262-E264 VanDerWaalsContact CD1-OE1 3.25Å; I262-E264 WeakPolarHBondContact CD1-OE1 3.38Å; I262-E264 HydrophobicContact CG1-CG 3.79Å
265	E	95.4	Very high	93.5	Very high	41 Å²	41	33.4 Å²	33.4	19%	0.192	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	142.7	165	-65.4	174.2	140.9	0	0	110.2	V195 K196 L221 L267	V195-E265 HydrophobicContact CG1-CB 4.39Å; K196-E265 HydrophobicContact CB-CG 4.12Å; K196-E265 PolarHBondContact N-OE2 3.44Å; K196-E265 VanDerWaalsContact N-OE2 3.12Å; K196-E265 PolarHBondContact O-N 3.37Å; L221-E265 HydrophobicContact CD2-CG 3.89Å; E265-L267 PolarHBondContact O-N 2.81Å
266	M	95.1	Very high	94	Very high	82 Å²	82	33.3 Å²	33.3	40%	0.404	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-66.6	119.1	170.5	-175.1	170.1	175.4	0	0	110.1	P224 V226 I240	P224-M266 HydrophobicContact CB-CB 4.4Å; P224-M266 HydrophobicContact CB-SD 4.12Å; P224-M266 HydrophobicContact CG-CB 3.85Å; P224-M266 HydrophobicContact CG-CG 4.31Å; P224-M266 HydrophobicContact CG-SD 3.58Å; P224-M266 VanDerWaalsContact CG-SD 3.58Å; P224-M266 VanDerWaalsContact O-CB 3.3Å; P224-M266 WeakPolarHBondContact O-CB 3.02Å; P224-M266 PolarHBondContact O-N 3.07Å; V226-M266 HydrophobicContact CG2-CB 4.15Å; V226-M266 HydrophobicContact CG2-CG 4.34Å; I240-M266 HydrophobicContact CD1-CE 4.22Å; I240-M266 HydrophobicContact CD1-SD 4.46Å; I240-M266 HydrophobicContact CG2-SD 4.06Å
267	L	94.8	Very high	94.4	Very high	18 Å²	18	26.5 Å²	26.5	9%	0.094	16%	0.155	C	C	.	.	P	Polyproline II helix	trans	-68.4	148.7	178.3	-52.8	-173.3	0	0	0	111.3	V195 E265 F344 Q352 F353 L354	V195-L267 HydrophobicContact CB-CD2 4.27Å; V195-L267 HydrophobicContact CG1-CD2 3.63Å; V195-L267 HydrophobicContact CG2-CD2 3.58Å; E265-L267 PolarHBondContact O-N 2.81Å; L267-F344 HydrophobicContact CB-CD1 4.43Å; L267-F344 HydrophobicContact CB-CD2 3.63Å; L267-F344 HydrophobicContact CB-CE2 3.84Å; L267-F344 HydrophobicContact CB-CG 3.96Å; L267-F344 HydrophobicContact CB-CZ 4.33Å; L267-F344 HydrophobicContact CD1-CD2 3.52Å; L267-F344 HydrophobicContact CD1-CE2 3.81Å; L267-F344 HydrophobicContact CD1-CG 4.47Å; L267-F344 HydrophobicContact CG-CD2 4.22Å; L267-F344 HydrophobicContact CG-CE2 4.4Å; L267-Q352 HydrophobicContact CD1-CB 4.42Å; L267-Q352 HydrophobicContact CD2-CB 4.16Å; L267-F353 WeakPolarHBondContact CD1-O 3.45Å; L267-L354 HydrophobicContact CD1-CB 3.94Å; L267-L354 HydrophobicContact CD1-CD1 3.78Å; L267-L354 HydrophobicContact CD1-CG 4.47Å
268	A	93	Very high	94.8	Very high	46 Å²	46	23 Å²	23	38%	0.38	14%	0.137	S	C	.	.			trans	-125.6	154.4	-175.8	0	0	0	0	0	111.8	R346 Q352	A268-R346 WeakPolarHBondContact O-CG 3.2Å; A268-Q352 PolarHBondContact O-OE1 3.05Å; A268-Q352 VanDerWaalsContact O-OE1 3.13Å
269	G	95.6	Very high	95.1	Very high	37 Å²	37	20.4 Å²	20.4	38%	0.381	12%	0.117	S	C	.	.	S	Bend	trans	100.9	-160.5	178.8	0	0	0	0	0	113.7	F344 R345	G269-F344 WeakPolarHBondContact O-CD1 3.25Å; G269-R345 WeakPolarHBondContact CA-O 3.31Å
270	D	96.6	Very high	95.2	Very high	59 Å²	59	23.8 Å²	23.8	32%	0.316	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	133.7	-178.3	-77	-46.5	0	0	0	110.8	Y272 R290 F344 R345	D270-Y272 HydrophobicContact CB-CD2 4.42Å; D270-Y272 HydrophobicContact CB-CE2 3.51Å; D270-Y272 WeakPolarHBondContact O-CD2 3.49Å; D270-Y272 VanDerWaalsContact O-CE2 3.23Å; D270-Y272 WeakPolarHBondContact O-CE2 3.09Å; D270-R290 IonicContact OD1-NH2 3.29Å; D270-R290 IonicContact OD2-CZ 3.91Å; D270-R290 IonicContact OD2-NE 3.39Å; D270-R290 IonicContact OD2-NH2 3.9Å; D270-R290 PolarHBondContact OD2-NH2 2.93Å; D270-F344 CarbonylContact O-C 3.57Å; D270-F344 WeakPolarHBondContact O-CA 3.45Å; D270-R345 PolarHBondContact N-O 3.3Å; D270-R345 PolarHBondContact O-N 3.37Å
271	Q	97.6	Very high	95.1	Very high	7 Å²	7	25.4 Å²	25.4	3%	0.033	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	135.6	179.4	-168.6	-175.4	-0.4	0	0	110.8	N291 P294 I295 E342 Y343 F344	Q271-N291 HydrophobicContact CB-CB 4.22Å; Q271-N291 WeakPolarHBondContact CG-ND2 3.19Å; Q271-N291 VanDerWaalsContact O-CB 3.3Å; Q271-N291 WeakPolarHBondContact O-CB 3.4Å; Q271-N291 PolarHBondContact O-N 3.08Å; Q271-N291 PolarHBondContact OE1-ND2 3.29Å; Q271-P294 VanDerWaalsContact OE1-CA 3.26Å; Q271-I295 VanDerWaalsContact NE2-CD1 3.35Å; Q271-E342 PolarHBondContact NE2-OE2 2.97Å; Q271-E342 VanDerWaalsContact NE2-OE2 3.1Å; Q271-Y343 CarbonylContact C-O 3.41Å; Q271-Y343 WeakPolarHBondContact CA-O 3.41Å; Q271-F344 HydrophobicContact CB-CD1 4.07Å; Q271-F344 HydrophobicContact CB-CE1 3.73Å; Q271-F344 HydrophobicContact CB-CE2 4.36Å; Q271-F344 HydrophobicContact CB-CZ 3.89Å; Q271-F344 HydrophobicContact CG-CD2 4.38Å; Q271-F344 HydrophobicContact CG-CE1 4.23Å; Q271-F344 HydrophobicContact CG-CE2 3.95Å; Q271-F344 HydrophobicContact CG-CZ 3.87Å
272	Y	98.1	Very high	95.1	Very high	1 Å²	1	32 Å²	32	0%	0.004	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	159.7	177.2	-59.6	-103.9	0	0	0	110.5	D270 Y289 R290 L310 E316 H320 E342 Y343 R345	D270-Y272 HydrophobicContact CB-CD2 4.42Å; D270-Y272 HydrophobicContact CB-CE2 3.51Å; D270-Y272 WeakPolarHBondContact O-CD2 3.49Å; D270-Y272 VanDerWaalsContact O-CE2 3.23Å; D270-Y272 WeakPolarHBondContact O-CE2 3.09Å; Y272-Y289 CarbonylContact C-O 3.58Å; Y272-Y289 WeakPolarHBondContact CA-O 3.35Å; Y272-Y289 WeakPolarHBondContact CB-O 3.08Å; Y272-R290 HydrophobicContact CD1-CB 3.7Å; Y272-R290 HydrophobicContact CD1-CG 4.05Å; Y272-R290 HydrophobicContact CE1-CB 3.55Å; Y272-R290 HydrophobicContact CE1-CG 3.59Å; Y272-L310 HydrophobicContact CD1-CD1 3.93Å; Y272-L310 HydrophobicContact CE1-CD1 3.78Å; Y272-E316 PolarHBondContact OH-OE2 3.22Å; Y272-H320 AromaticContact CD1-CE1 3.47Å; Y272-H320 VanDerWaalsContact CD1-CE1 3.47Å; Y272-H320 WeakPolarHBondContact CD1-CE1 3.49Å; Y272-H320 AromaticContact CD1-ND1 3.93Å; Y272-H320 AromaticContact CD1-NE2 3.99Å; Y272-H320 AromaticContact CD2-CE1 3.66Å; Y272-H320 AromaticContact CE1-CE1 3.31Å; Y272-H320 WeakPolarHBondContact CE1-CE1 3.37Å; Y272-H320 AromaticContact CE1-NE2 3.41Å; Y272-H320 WeakPolarHBondContact CE1-NE2 3.5Å; Y272-H320 AromaticContact CE2-CE1 3.56Å; Y272-H320 AromaticContact CG-CE1 3.64Å; Y272-H320 AromaticContact CZ-CE1 3.36Å; Y272-H320 AromaticContact CZ-NE2 3.46Å; Y272-E342 WeakPolarHBondContact O-CA 3.43Å; Y272-Y343 HydrophobicContact CD2-CD2 4.42Å; Y272-Y343 HydrophobicContact CD2-CE2 4.09Å; Y272-Y343 AromaticContact CG-CE2 3.95Å; Y272-Y343 HydrophobicContact CG-CE2 3.95Å; Y272-Y343 PolarHBondContact N-O 2.83Å; Y272-Y343 PolarHBondContact O-N 2.91Å; Y272-R345 HydrophobicContact CD2-CB 4.26Å; Y272-R345 HydrophobicContact CE2-CB 3.7Å
273	A	97.9	Very high	95	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	128.8	168.9	0	0	0	0	0	109.8	Y275 Y289 A341 E342	A273-Y275 HydrophobicContact CB-CE2 3.84Å; A273-Y289 PolarHBondContact N-O 3.15Å; A273-Y289 PolarHBondContact O-N 3.02Å; A273-A341 CarbonylContact C-O 3.53Å; A273-A341 WeakPolarHBondContact CA-O 3.37Å; A273-E342 HydrophobicContact CB-CG 4.21Å
274	A	98.4	Very high	94.7	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	129.2	171	0	0	0	0	0	109.9	M276 R287 I288 V324 T340 A341 Y343	A274-M276 HydrophobicContact CB-CE 4.2Å; A274-R287 CarbonylContact C-O 3.49Å; A274-R287 WeakPolarHBondContact CA-O 3.38Å; A274-I288 HydrophobicContact CB-CG1 4.33Å; A274-V324 HydrophobicContact CB-CG1 4.29Å; A274-V324 HydrophobicContact CB-CG2 3.37Å; A274-T340 CarbonylContact O-C 3.52Å; A274-T340 VanDerWaalsContact O-CA 3.31Å; A274-T340 WeakPolarHBondContact O-CA 3.45Å; A274-A341 PolarHBondContact N-O 3.26Å; A274-A341 PolarHBondContact O-N 3.15Å; A274-Y343 HydrophobicContact CB-CE1 4.08Å
275	Y	97.7	Very high	94.5	Very high	10 Å²	10	38 Å²	38	4%	0.039	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	125	176.3	-57.5	-83.5	0	0	0	107.7	A273 F286 R287 Y289 K307 T340 P361 L365	A273-Y275 HydrophobicContact CB-CE2 3.84Å; Y275-F286 CarbonylContact O-C 3.57Å; Y275-F286 WeakPolarHBondContact O-CA 3.33Å; Y275-F286 WeakPolarHBondContact O-CB 3.44Å; Y275-R287 PolarHBondContact N-O 2.79Å; Y275-R287 PolarHBondContact O-N 2.66Å; Y275-Y289 AromaticContact CD2-CD2 3.64Å; Y275-Y289 HydrophobicContact CD2-CD2 3.64Å; Y275-Y289 AromaticContact CD2-CE2 3.85Å; Y275-Y289 HydrophobicContact CD2-CE2 3.85Å; Y275-Y289 AromaticContact CE2-CD2 3.61Å; Y275-Y289 HydrophobicContact CE2-CD2 3.61Å; Y275-Y289 HydrophobicContact CE2-CE2 4.07Å; Y275-Y289 HydrophobicContact CE2-CG 4.37Å; Y275-K307 PolarHBondContact OH-NZ 2.82Å; Y275-T340 HydrophobicContact CD1-CG2 3.54Å; Y275-T340 WeakPolarHBondContact CD1-OG1 3.2Å; Y275-T340 HydrophobicContact CE1-CG2 3.44Å; Y275-T340 VanDerWaalsContact CE1-CG2 3.44Å; Y275-T340 HydrophobicContact CG-CG2 4.47Å; Y275-P361 HydrophobicContact CD1-CB 3.72Å; Y275-P361 HydrophobicContact CD1-CG 4.27Å; Y275-P361 HydrophobicContact CE1-CB 3.57Å; Y275-L365 HydrophobicContact CD1-CD2 3.32Å; Y275-L365 HydrophobicContact CD2-CD2 3.39Å; Y275-L365 HydrophobicContact CE1-CD2 3.39Å; Y275-L365 HydrophobicContact CE2-CD2 3.46Å; Y275-L365 VanDerWaalsContact CE2-CD2 3.46Å; Y275-L365 HydrophobicContact CG-CD2 3.31Å; Y275-L365 VanDerWaalsContact CZ-CD2 3.45Å
276	M	96.7	Very high	94.5	Very high	1 Å²	1	38.7 Å²	38.7	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	143	-176.4	-65.1	152.9	-82.3	0	0	109.6	A274 I278 I283 W285 F286 V324 A328 M338 F339 A341	A274-M276 HydrophobicContact CB-CE 4.2Å; M276-I278 HydrophobicContact CB-CD1 4.02Å; M276-I283 HydrophobicContact CB-CG2 4.4Å; M276-I283 HydrophobicContact CG-CD1 4.48Å; M276-I283 HydrophobicContact CG-CG2 4.31Å; M276-I283 HydrophobicContact SD-CD1 4.26Å; M276-W285 CarbonylContact C-O 3.58Å; M276-W285 WeakPolarHBondContact CA-O 3.46Å; M276-F286 HydrophobicContact CB-CB 4.41Å; M276-F286 HydrophobicContact CG-CB 3.78Å; M276-V324 HydrophobicContact CE-CG1 4.34Å; M276-V324 HydrophobicContact CG-CG1 3.99Å; M276-V324 HydrophobicContact SD-CG1 3.43Å; M276-V324 WeakPolarHBondContact SD-CG1 3.15Å; M276-A328 HydrophobicContact SD-CB 4.42Å; M276-M338 CarbonylContact O-C 3.5Å; M276-M338 WeakPolarHBondContact O-CA 3.31Å; M276-F339 HydrophobicContact CB-CB 4.41Å; M276-F339 HydrophobicContact CE-CD1 3.21Å; M276-F339 HydrophobicContact CE-CE1 3.57Å; M276-F339 HydrophobicContact CE-CG 4.03Å; M276-F339 PolarHBondContact N-O 2.99Å; M276-F339 PolarHBondContact O-N 2.83Å; M276-F339 HydrophobicContact SD-CD1 3.62Å; M276-F339 HydrophobicContact SD-CE1 4.08Å; M276-A341 HydrophobicContact CE-CB 4.18Å
277	L	94.6	Very high	94.5	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	113.6	163.7	-172.5	71.8	0	0	0	107.9	Q284 W285 M338 A380 P389	L277-Q284 PolarHBondContact O-N 3.05Å; L277-W285 HydrophobicContact CB-CB 4.04Å; L277-W285 HydrophobicContact CB-CE3 4.37Å; L277-W285 PolarHBondContact N-O 3.1Å; L277-M338 HydrophobicContact CB-SD 4.43Å; L277-M338 HydrophobicContact CD1-SD 3.98Å; L277-A380 HydrophobicContact CD1-CB 4.1Å; L277-A380 HydrophobicContact CD2-CB 3.96Å; L277-P389 HydrophobicContact CD2-CG 3.48Å; L277-P389 VanDerWaalsContact CD2-CG 3.48Å
278	I	93.5	Very high	94.7	Very high	5 Å²	5	35.8 Å²	35.8	3%	0.026	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	132.5	178.4	-51.7	-58.1	0	0	0	109	M276 K282 I283 I334 D336 G337 F339	M276-I278 HydrophobicContact CB-CD1 4.02Å; I278-K282 WeakPolarHBondContact CA-O 3.39Å; I278-I283 HydrophobicContact CD1-CB 4.21Å; I278-I283 HydrophobicContact CD1-CG1 3.47Å; I278-I283 VanDerWaalsContact CD1-CG1 3.47Å; I278-I334 HydrophobicContact CB-CG2 4.39Å; I278-I334 HydrophobicContact CG1-CB 4.42Å; I278-I334 HydrophobicContact CG1-CD1 4.44Å; I278-I334 HydrophobicContact CG1-CG2 4.01Å; I278-I334 HydrophobicContact CG2-CB 4.36Å; I278-D336 WeakPolarHBondContact O-CA 3.46Å; I278-G337 PolarHBondContact N-O 3Å; I278-G337 PolarHBondContact O-N 3.43Å; I278-F339 HydrophobicContact CG1-CB 3.89Å
279	F	90.5	Very high	95	Very high	18 Å²	18	33.7 Å²	33.7	8%	0.079	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	127.2	171	-174.4	-100.9	0	0	0	109.6	G281 K282 Q284 D336 G384 F387 S388	F279-G281 PolarHBondContact O-N 2.89Å; F279-K282 PolarHBondContact N-O 2.78Å; F279-K282 PolarHBondContact O-N 2.79Å; F279-Q284 HydrophobicContact CB-CG 3.7Å; F279-D336 WeakPolarHBondContact CA-OD1 3.47Å; F279-D336 HydrophobicContact CD2-CB 4.43Å; F279-G384 WeakPolarHBondContact CD2-O 3.31Å; F279-G384 WeakPolarHBondContact CE2-O 3.5Å; F279-F387 WeakPolarHBondContact CE2-O 3.07Å; F279-S388 VanDerWaalsContact CE2-N 3.31Å
280	Q	89	Confident	95.1	Very high	145 Å²	145	35.5 Å²	35.5	68%	0.678	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.3	42.7	-177.9	-64.9	176.4	-19.5	0	0	112.1	K282 D336	Q280-K282 PolarHBondContact O-N 3.06Å; Q280-D336 PolarHBondContact N-OD1 2.99Å
281	G	90.7	Very high	95.1	Very high	57 Å²	57	32.7 Å²	32.7	59%	0.588	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.8	9	-179.4	0	0	0	0	0	115.3	F279	F279-G281 PolarHBondContact O-N 2.89Å
282	K	92.1	Very high	95	Very high	139 Å²	139	38 Å²	38	60%	0.604	18%	0.18	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-114.8	139.9	179.5	-62.8	178.7	-177.5	177.8	0	111.3	I278 F279 Q280 Q284	I278-K282 WeakPolarHBondContact CA-O 3.39Å; F279-K282 PolarHBondContact N-O 2.78Å; F279-K282 PolarHBondContact O-N 2.79Å; Q280-K282 PolarHBondContact O-N 3.06Å; K282-Q284 PolarHBondContact O-N 2.72Å
283	I	93.9	Very high	94.8	Very high	43 Å²	43	41.1 Å²	41.1	22%	0.221	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	110.2	168.9	-58	170.5	0	0	0	108.1	M276 I278 F286 V324 N325 A328	M276-I283 HydrophobicContact CB-CG2 4.4Å; M276-I283 HydrophobicContact CG-CD1 4.48Å; M276-I283 HydrophobicContact CG-CG2 4.31Å; M276-I283 HydrophobicContact SD-CD1 4.26Å; I278-I283 HydrophobicContact CD1-CB 4.21Å; I278-I283 HydrophobicContact CD1-CG1 3.47Å; I278-I283 VanDerWaalsContact CD1-CG1 3.47Å; I283-F286 HydrophobicContact CG2-CB 3.86Å; I283-F286 HydrophobicContact CG2-CD1 3.81Å; I283-F286 HydrophobicContact CG2-CG 4.2Å; I283-V324 HydrophobicContact CD1-CG1 4.45Å; I283-N325 WeakPolarHBondContact CD1-OD1 3.31Å; I283-A328 HydrophobicContact CD1-CB 3.9Å; I283-A328 HydrophobicContact CG1-CB 4.39Å
284	Q	90.5	Very high	94.4	Very high	71 Å²	71	43.8 Å²	43.8	33%	0.332	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-27.6	178.2	-63	-61.3	-27.3	0	0	112.6	L277 F279 K282	L277-Q284 PolarHBondContact O-N 3.05Å; F279-Q284 HydrophobicContact CB-CG 3.7Å; K282-Q284 PolarHBondContact O-N 2.72Å
285	W	92.8	Very high	94	Very high	16 Å²	16	44.6 Å²	44.6	6%	0.061	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	141.6	178.6	174.2	95.5	0	0	0	108.4	M276 L277 R287 M338 V369 E373 M375 L377	M276-W285 CarbonylContact C-O 3.58Å; M276-W285 WeakPolarHBondContact CA-O 3.46Å; L277-W285 HydrophobicContact CB-CB 4.04Å; L277-W285 HydrophobicContact CB-CE3 4.37Å; L277-W285 PolarHBondContact N-O 3.1Å; W285-R287 HydrophobicContact CH2-CB 4.04Å; W285-R287 HydrophobicContact CH2-CG 3.59Å; W285-R287 HydrophobicContact CZ2-CB 4.17Å; W285-R287 HydrophobicContact CZ2-CG 3.21Å; W285-R287 HydrophobicContact CZ3-CG 4.42Å; W285-M338 HydrophobicContact CZ3-CE 4.22Å; W285-V369 HydrophobicContact CH2-CG2 3.95Å; W285-V369 HydrophobicContact CZ2-CB 4.5Å; W285-V369 HydrophobicContact CZ2-CG1 3.86Å; W285-V369 HydrophobicContact CZ2-CG2 3.76Å; W285-E373 PolarHBondContact NE1-OE1 3.13Å; W285-E373 PolarHBondContact NE1-OE2 2.95Å; W285-M375 HydrophobicContact CD2-CE 3.72Å; W285-M375 VanDerWaalsContact CE2-CE 3.46Å; W285-M375 HydrophobicContact CE3-CE 4.48Å; W285-M375 HydrophobicContact CG-CE 3.78Å; W285-M375 HydrophobicContact CZ2-CE 4Å; W285-L377 HydrophobicContact CE3-CD2 4.3Å; W285-L377 HydrophobicContact CH2-CD1 4.02Å; W285-L377 HydrophobicContact CH2-CD2 4.35Å; W285-L377 HydrophobicContact CZ3-CD1 4.4Å; W285-L377 HydrophobicContact CZ3-CD2 4.18Å
286	F	95.3	Very high	93.5	Very high	56 Å²	56	46.9 Å²	46.9	25%	0.246	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	155.2	168.4	73.3	-80.6	0	0	0	112.9	Y275 M276 I283 I288	Y275-F286 CarbonylContact O-C 3.57Å; Y275-F286 WeakPolarHBondContact O-CA 3.33Å; Y275-F286 WeakPolarHBondContact O-CB 3.44Å; M276-F286 HydrophobicContact CB-CB 4.41Å; M276-F286 HydrophobicContact CG-CB 3.78Å; I283-F286 HydrophobicContact CG2-CB 3.86Å; I283-F286 HydrophobicContact CG2-CD1 3.81Å; I283-F286 HydrophobicContact CG2-CG 4.2Å; F286-I288 HydrophobicContact CD2-CD1 4.38Å; F286-I288 HydrophobicContact CD2-CG1 4.08Å; F286-I288 HydrophobicContact CE2-CD1 4.14Å; F286-I288 HydrophobicContact CE2-CG1 4.25Å
287	R	96.4	Very high	93.3	Very high	38 Å²	38	47.1 Å²	47.1	14%	0.143	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	142.1	171.6	-64.7	-68.9	178.5	-100.7	5	109.7	A274 Y275 W285 Y289 E309 E373	A274-R287 CarbonylContact C-O 3.49Å; A274-R287 WeakPolarHBondContact CA-O 3.38Å; Y275-R287 PolarHBondContact N-O 2.79Å; Y275-R287 PolarHBondContact O-N 2.66Å; W285-R287 HydrophobicContact CH2-CB 4.04Å; W285-R287 HydrophobicContact CH2-CG 3.59Å; W285-R287 HydrophobicContact CZ2-CB 4.17Å; W285-R287 HydrophobicContact CZ2-CG 3.21Å; W285-R287 HydrophobicContact CZ3-CG 4.42Å; R287-Y289 HydrophobicContact CB-CD2 4.28Å; R287-Y289 HydrophobicContact CB-CE2 3.62Å; R287-E309 WeakPolarHBondContact CD-OE1 3.29Å; R287-E309 IonicContact NE-OE1 2.71Å; R287-E373 IonicContact CZ-OE1 3.11Å; R287-E373 IonicContact CZ-OE2 3.96Å; R287-E373 IonicContact NE-OE1 3.53Å; R287-E373 PolarHBondContact NE-OE1 2.84Å; R287-E373 IonicContact NH2-OE1 2.69Å; R287-E373 PolarHBondContact NH2-OE1 2.87Å; R287-E373 IonicContact NH2-OE2 3.17Å; R287-E373 PolarHBondContact NH2-OE2 2.9Å; R287-E373 VanDerWaalsContact NH2-OE2 3.17Å
288	I	98.2	Very high	93.2	Very high	1 Å²	1	47.1 Å²	47.1	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.4	177.6	-52.1	-179.5	0	0	0	107	A274 F286 E309 L310 H320 V324 Y343	A274-I288 HydrophobicContact CB-CG1 4.33Å; F286-I288 HydrophobicContact CD2-CD1 4.38Å; F286-I288 HydrophobicContact CD2-CG1 4.08Å; F286-I288 HydrophobicContact CE2-CD1 4.14Å; F286-I288 HydrophobicContact CE2-CG1 4.25Å; I288-E309 CarbonylContact O-C 3.59Å; I288-E309 WeakPolarHBondContact O-CA 3.23Å; I288-L310 HydrophobicContact CB-CB 4.41Å; I288-L310 HydrophobicContact CB-CD1 4.45Å; I288-L310 HydrophobicContact CG2-CD1 3.84Å; I288-L310 HydrophobicContact CG2-CG 4.31Å; I288-L310 PolarHBondContact O-N 3.09Å; I288-H320 HydrophobicContact CD1-CB 3.69Å; I288-H320 HydrophobicContact CG2-CB 4.32Å; I288-V324 HydrophobicContact CD1-CG2 3.73Å; I288-V324 HydrophobicContact CG1-CG2 4.14Å; I288-Y343 WeakPolarHBondContact CG2-OH 3.36Å
289	Y	98.4	Very high	93	Very high	1 Å²	1	48.8 Å²	48.8	0%	0.004	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	134.2	177	-69.6	-101.9	0	0	0	109.9	Y272 A273 Y275 R287 K307 L308 E309 L365 L368 T400	Y272-Y289 CarbonylContact C-O 3.58Å; Y272-Y289 WeakPolarHBondContact CA-O 3.35Å; Y272-Y289 WeakPolarHBondContact CB-O 3.08Å; A273-Y289 PolarHBondContact N-O 3.15Å; A273-Y289 PolarHBondContact O-N 3.02Å; Y275-Y289 AromaticContact CD2-CD2 3.64Å; Y275-Y289 HydrophobicContact CD2-CD2 3.64Å; Y275-Y289 AromaticContact CD2-CE2 3.85Å; Y275-Y289 HydrophobicContact CD2-CE2 3.85Å; Y275-Y289 AromaticContact CE2-CD2 3.61Å; Y275-Y289 HydrophobicContact CE2-CD2 3.61Å; Y275-Y289 HydrophobicContact CE2-CE2 4.07Å; Y275-Y289 HydrophobicContact CE2-CG 4.37Å; R287-Y289 HydrophobicContact CB-CD2 4.28Å; R287-Y289 HydrophobicContact CB-CE2 3.62Å; Y289-K307 HydrophobicContact CD1-CB 3.88Å; Y289-K307 HydrophobicContact CG-CB 4.31Å; Y289-L308 CarbonylContact C-O 3.59Å; Y289-L308 VanDerWaalsContact CA-O 3.26Å; Y289-L308 WeakPolarHBondContact CA-O 3.18Å; Y289-E309 HydrophobicContact CD1-CB 4.06Å; Y289-E309 HydrophobicContact CE1-CB 3.81Å; Y289-L365 HydrophobicContact CE2-CD1 3.78Å; Y289-L365 WeakPolarHBondContact OH-CD1 3.47Å; Y289-L368 HydrophobicContact CE1-CD2 4.36Å; Y289-T400 PolarHBondContact OH-OG1 3.27Å
290	R	98	Very high	92.9	Very high	75 Å²	75	53.9 Å²	53.9	28%	0.283	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	128.7	166.1	-176.4	174.3	178.7	178.2	2.4	109.4	D270 Y272 K307 L308 L310	D270-R290 IonicContact OD1-NH2 3.29Å; D270-R290 IonicContact OD2-CZ 3.91Å; D270-R290 IonicContact OD2-NE 3.39Å; D270-R290 IonicContact OD2-NH2 3.9Å; D270-R290 PolarHBondContact OD2-NH2 2.93Å; Y272-R290 HydrophobicContact CD1-CB 3.7Å; Y272-R290 HydrophobicContact CD1-CG 4.05Å; Y272-R290 HydrophobicContact CE1-CB 3.55Å; Y272-R290 HydrophobicContact CE1-CG 3.59Å; R290-K307 WeakPolarHBondContact O-CA 3.18Å; R290-L308 PolarHBondContact N-O 3.04Å; R290-L308 PolarHBondContact O-N 3.31Å; R290-L310 HydrophobicContact CB-CD2 4.03Å
291	N	97	Very high	93.1	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	136.2	168.7	-61	-11.5	0	0	0	109	Q271 R293 I295 A306 K307	Q271-N291 HydrophobicContact CB-CB 4.22Å; Q271-N291 WeakPolarHBondContact CG-ND2 3.19Å; Q271-N291 VanDerWaalsContact O-CB 3.3Å; Q271-N291 WeakPolarHBondContact O-CB 3.4Å; Q271-N291 PolarHBondContact O-N 3.08Å; Q271-N291 PolarHBondContact OE1-ND2 3.29Å; N291-R293 WeakPolarHBondContact CB-O 3.34Å; N291-R293 PolarHBondContact O-N 2.9Å; N291-I295 WeakPolarHBondContact ND2-CG1 3.3Å; N291-A306 CarbonylContact C-O 3.49Å; N291-A306 VanDerWaalsContact CA-O 3.32Å; N291-A306 WeakPolarHBondContact CA-O 3.42Å; N291-K307 WeakPolarHBondContact OD1-CD 3.15Å; N291-K307 WeakPolarHBondContact OD1-CE 3.38Å; N291-K307 VanDerWaalsContact OD1-CG 3.29Å; N291-K307 WeakPolarHBondContact OD1-CG 3.34Å
292	R	96	Very high	93.3	Very high	120 Å²	120	52.7 Å²	52.7	45%	0.453	24%	0.236	S	C	.	.	S	Bend	trans	-65.1	-31.4	174.2	179.8	53.8	-178.1	139.1	-3.4	112.4	A306 F467 M471	R292-A306 HydrophobicContact CB-CB 4.08Å; R292-A306 PolarHBondContact N-O 2.94Å; R292-F467 HydrophobicContact CB-CE1 4.08Å; R292-F467 HydrophobicContact CB-CZ 3.97Å; R292-F467 HydrophobicContact CG-CE1 4.47Å; R292-M471 HydrophobicContact CB-CE 4.37Å; R292-M471 HydrophobicContact CG-CE 4Å
293	R	93.5	Very high	93.4	Very high	66 Å²	66	49 Å²	49	25%	0.249	22%	0.222	C	C	.	.	S	Bend	trans	-145.4	156.8	178.7	-59.5	-175.7	-176.7	98.7	0.9	108.9	N291 A297	N291-R293 WeakPolarHBondContact CB-O 3.34Å; N291-R293 PolarHBondContact O-N 2.9Å; R293-A297 HydrophobicContact CB-CB 4.16Å
294	P	90.2	Very high	93.6	Very high	56 Å²	56	47.8 Å²	47.8	36%	0.364	22%	0.217	S	C	.	.			trans	-54.1	142.8	171.3	-26.9	36	0	0	0	111.7	Q271 V296 A297	Q271-P294 VanDerWaalsContact OE1-CA 3.26Å; P294-V296 HydrophobicContact CB-CG1 4.17Å; P294-V296 PolarHBondContact O-N 2.87Å; P294-V296 VanDerWaalsContact O-N 3.08Å; P294-A297 VanDerWaalsContact O-CB 3.27Å; P294-A297 WeakPolarHBondContact O-CB 3.03Å; P294-A297 PolarHBondContact O-N 2.97Å
295	I	89.9	Confident	93.8	Very high	16 Å²	16	44.9 Å²	44.9	8%	0.082	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-34	-174.8	-67.2	175.6	0	0	0	112.2	Q271 N291 A297 F298 L305 E342 L444	Q271-I295 VanDerWaalsContact NE2-CD1 3.35Å; N291-I295 WeakPolarHBondContact ND2-CG1 3.3Å; I295-A297 PolarHBondContact O-N 3.32Å; I295-A297 VanDerWaalsContact O-N 3.14Å; I295-F298 WeakPolarHBondContact O-CB 3.45Å; I295-F298 PolarHBondContact O-N 3.38Å; I295-F298 VanDerWaalsContact O-N 3.1Å; I295-L305 HydrophobicContact CB-CD1 4.39Å; I295-L305 HydrophobicContact CG1-CD1 3.85Å; I295-E342 WeakPolarHBondContact CD1-OE2 3.31Å; I295-L444 HydrophobicContact CG2-CD1 3.19Å; I295-L444 HydrophobicContact CG2-CD2 3.61Å; I295-L444 HydrophobicContact CG2-CG 3.99Å
296	V	87.2	Confident	94.1	Very high	59 Å²	59	44.1 Å²	44.1	36%	0.358	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-25.2	179.1	70.7	0	0	0	0	113.4	P294 F298 V299 R300	P294-V296 HydrophobicContact CB-CG1 4.17Å; P294-V296 PolarHBondContact O-N 2.87Å; P294-V296 VanDerWaalsContact O-N 3.08Å; V296-F298 PolarHBondContact O-N 2.95Å; V296-V299 PolarHBondContact O-N 2.88Å; V296-V299 VanDerWaalsContact O-N 3.15Å; V296-R300 HydrophobicContact CG2-CB 4.49Å; V296-R300 WeakPolarHBondContact O-CB 3.29Å; V296-R300 PolarHBondContact O-N 3.44Å
297	A	91.9	Very high	94.2	Very high	6 Å²	6	41.7 Å²	41.7	5%	0.05	19%	0.19	C	C	.	.	H	α-helix	trans	-63.8	-23.8	178.1	0	0	0	0	0	112.9	R293 P294 I295 V299 D301 R302 L303	R293-A297 HydrophobicContact CB-CB 4.16Å; P294-A297 VanDerWaalsContact O-CB 3.27Å; P294-A297 WeakPolarHBondContact O-CB 3.03Å; P294-A297 PolarHBondContact O-N 2.97Å; I295-A297 PolarHBondContact O-N 3.32Å; I295-A297 VanDerWaalsContact O-N 3.14Å; A297-V299 VanDerWaalsContact C-N 3.35Å; A297-D301 WeakPolarHBondContact CB-OD2 3.09Å; A297-D301 CarbonylContact O-C 3.52Å; A297-D301 WeakPolarHBondContact O-CA 3.5Å; A297-D301 WeakPolarHBondContact O-CB 3.43Å; A297-D301 PolarHBondContact O-N 3.5Å; A297-R302 PolarHBondContact O-N 3.14Å; A297-R302 VanDerWaalsContact O-N 3.15Å; A297-L303 PolarHBondContact O-N 3.04Å
298	F	92.6	Very high	94.3	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.009	19%	0.186	C	C	.	.	H	α-helix	trans	-63.8	-42	174.4	-177	-87.8	0	0	0	112.1	I295 V296 R302 L303 L305 R404 P406 P441 L444 Y448 V449	I295-F298 WeakPolarHBondContact O-CB 3.45Å; I295-F298 PolarHBondContact O-N 3.38Å; I295-F298 VanDerWaalsContact O-N 3.1Å; V296-F298 PolarHBondContact O-N 2.95Å; F298-R302 WeakPolarHBondContact O-CA 3.3Å; F298-L303 VanDerWaalsContact CA-O 3.31Å; F298-L303 WeakPolarHBondContact CA-O 3.21Å; F298-L305 HydrophobicContact CB-CB 4.25Å; F298-L305 HydrophobicContact CD2-CB 3.72Å; F298-L305 HydrophobicContact CE2-CB 4.48Å; F298-L305 HydrophobicContact CG-CB 4.3Å; F298-R404 HydrophobicContact CE2-CB 4.2Å; F298-R404 WeakPolarHBondContact CE2-O 3.13Å; F298-P406 HydrophobicContact CD2-CB 4.06Å; F298-P406 HydrophobicContact CD2-CG 4.33Å; F298-P406 HydrophobicContact CE1-CB 4.1Å; F298-P406 HydrophobicContact CE2-CB 3.57Å; F298-P406 HydrophobicContact CE2-CG 4.15Å; F298-P406 HydrophobicContact CZ-CB 3.6Å; F298-P441 HydrophobicContact CD1-CB 4.06Å; F298-P441 HydrophobicContact CD1-CG 4.44Å; F298-P441 HydrophobicContact CE1-CB 3.82Å; F298-P441 HydrophobicContact CE1-CG 4.39Å; F298-P441 WeakPolarHBondContact O-CG 3.43Å; F298-L444 HydrophobicContact CB-CD2 3.87Å; F298-L444 HydrophobicContact CD1-CD2 3.72Å; F298-L444 HydrophobicContact CG-CD2 3.98Å; F298-Y448 WeakPolarHBondContact CZ-O 3.09Å; F298-V449 HydrophobicContact CZ-CG2 4.06Å
299	V	89.7	Confident	94.3	Very high	40 Å²	40	40.4 Å²	40.4	24%	0.242	19%	0.186	C	C	.	.	H	α-helix	trans	-83.7	-53.1	-178.7	179.6	0	0	0	0	110	V296 A297 L444	V296-V299 PolarHBondContact O-N 2.88Å; V296-V299 VanDerWaalsContact O-N 3.15Å; A297-V299 VanDerWaalsContact C-N 3.35Å; V299-L444 HydrophobicContact CG2-CD2 4.12Å; V299-L444 HydrophobicContact CG2-CG 4.38Å
300	R	87.4	Confident	94.2	Very high	124 Å²	124	40.4 Å²	40.4	47%	0.468	19%	0.187	S	C	.	.	H	α-helix	trans	-68.1	-49	-173.6	-173.1	-172.1	67.6	-162.1	-1.8	112.6	V296	V296-R300 HydrophobicContact CG2-CB 4.49Å; V296-R300 WeakPolarHBondContact O-CB 3.29Å; V296-R300 PolarHBondContact O-N 3.44Å
301	D	93.2	Very high	94.1	Very high	67 Å²	67	36.9 Å²	36.9	36%	0.358	17%	0.173	S	C	.	.	S	Bend	trans	-105.7	-3.9	-168.6	-49.1	-37.3	0	0	0	112.3	A297 L303	A297-D301 WeakPolarHBondContact CB-OD2 3.09Å; A297-D301 CarbonylContact O-C 3.52Å; A297-D301 WeakPolarHBondContact O-CA 3.5Å; A297-D301 WeakPolarHBondContact O-CB 3.43Å; A297-D301 PolarHBondContact O-N 3.5Å; D301-L303 HydrophobicContact CB-CB 4.47Å; D301-L303 HydrophobicContact CB-CD1 3.79Å; D301-L303 HydrophobicContact CB-CG 3.75Å; D301-L303 PolarHBondContact O-N 3.02Å
302	R	94.3	Very high	94.1	Very high	110 Å²	110	43.5 Å²	43.5	42%	0.415	20%	0.204	S	C	.	.			trans	56.2	34.4	-177.6	-47	165.4	-155.8	-166.1	3.3	111.4	A297 F298 P406 D440 P441	A297-R302 PolarHBondContact O-N 3.14Å; A297-R302 VanDerWaalsContact O-N 3.15Å; F298-R302 WeakPolarHBondContact O-CA 3.3Å; R302-P406 VanDerWaalsContact C-CG 3.42Å; R302-P406 HydrophobicContact CB-CG 4.42Å; R302-P406 WeakPolarHBondContact O-CG 3.24Å; R302-D440 WeakPolarHBondContact CD-OD1 3.22Å; R302-D440 IonicContact CZ-OD1 2.66Å; R302-D440 IonicContact CZ-OD2 3.64Å; R302-D440 IonicContact NE-OD1 3.46Å; R302-D440 IonicContact NE-OD2 3.55Å; R302-D440 IonicContact NH1-OD1 2.71Å; R302-D440 PolarHBondContact NH1-OD1 2.74Å; R302-D440 IonicContact NH1-OD2 2.87Å; R302-D440 PolarHBondContact NH1-OD2 2.78Å; R302-D440 IonicContact NH2-OD2 3.22Å; R302-D440 PolarHBondContact NH2-OD2 3.04Å; R302-P441 HydrophobicContact CG-CG 4.34Å
303	L	95.8	Very high	94.1	Very high	61 Å²	61	42.7 Å²	42.7	32%	0.319	21%	0.206	S	C	.	.	P	Polyproline II helix	trans	-94.8	152.5	178	-65.4	177.6	0	0	0	110.9	A297 F298 D301 L305	A297-L303 PolarHBondContact O-N 3.04Å; F298-L303 VanDerWaalsContact CA-O 3.31Å; F298-L303 WeakPolarHBondContact CA-O 3.21Å; D301-L303 HydrophobicContact CB-CB 4.47Å; D301-L303 HydrophobicContact CB-CD1 3.79Å; D301-L303 HydrophobicContact CB-CG 3.75Å; D301-L303 PolarHBondContact O-N 3.02Å; L303-L305 PolarHBondContact O-N 3.38Å
304	P	96.6	Very high	94.2	Very high	18 Å²	18	40.4 Å²	40.4	12%	0.117	20%	0.198	C	C	.	.	P	Polyproline II helix	trans	-60	136	178.7	-22.1	32.4	0	0	0	112.5	I403 R404 Y405 M471	P304-I403 HydrophobicContact CB-CG2 3.67Å; P304-R404 CarbonylContact C-O 3.58Å; P304-R404 VanDerWaalsContact CA-O 3.25Å; P304-R404 WeakPolarHBondContact CA-O 3.33Å; P304-Y405 HydrophobicContact CB-CD1 4.07Å; P304-Y405 HydrophobicContact CB-CE1 4.2Å; P304-Y405 HydrophobicContact CB-CG 4.44Å; P304-Y405 HydrophobicContact CG-CD1 3.5Å; P304-Y405 HydrophobicContact CG-CE1 3.61Å; P304-Y405 HydrophobicContact CG-CG 4.3Å; P304-M471 HydrophobicContact CB-CE 3.89Å; P304-M471 HydrophobicContact CB-SD 3.98Å; P304-M471 HydrophobicContact CG-CE 4.28Å
305	L	96.1	Very high	94.4	Very high	10 Å²	10	45.7 Å²	45.7	5%	0.052	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	116.4	167.4	171.4	65.2	0	0	0	107.7	I295 F298 L303 I403 R404	I295-L305 HydrophobicContact CB-CD1 4.39Å; I295-L305 HydrophobicContact CG1-CD1 3.85Å; F298-L305 HydrophobicContact CB-CB 4.25Å; F298-L305 HydrophobicContact CD2-CB 3.72Å; F298-L305 HydrophobicContact CE2-CB 4.48Å; F298-L305 HydrophobicContact CG-CB 4.3Å; L303-L305 PolarHBondContact O-N 3.38Å; L305-I403 CarbonylContact O-C 3.57Å; L305-I403 WeakPolarHBondContact O-CA 3.49Å; L305-R404 HydrophobicContact CB-CB 4.32Å; L305-R404 PolarHBondContact N-O 2.83Å; L305-R404 PolarHBondContact O-N 2.86Å
306	A	97.5	Very high	94.6	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.008	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	134.6	-171.6	0	0	0	0	0	111.8	N291 R292 Y402 I403 F467 M471	N291-A306 CarbonylContact C-O 3.49Å; N291-A306 VanDerWaalsContact CA-O 3.32Å; N291-A306 WeakPolarHBondContact CA-O 3.42Å; R292-A306 HydrophobicContact CB-CB 4.08Å; R292-A306 PolarHBondContact N-O 2.94Å; A306-Y402 CarbonylContact C-O 3.57Å; A306-Y402 VanDerWaalsContact CA-O 3.31Å; A306-Y402 WeakPolarHBondContact CA-O 3.38Å; A306-I403 HydrophobicContact CB-CB 4.39Å; A306-I403 HydrophobicContact CB-CG1 3.98Å; A306-I403 HydrophobicContact CB-CG2 4.16Å; A306-F467 HydrophobicContact CB-CE2 3.64Å; A306-F467 HydrophobicContact CB-CZ 3.54Å; A306-M471 HydrophobicContact CB-CE 3.74Å; A306-M471 HydrophobicContact CB-CG 4.05Å; A306-M471 HydrophobicContact CB-SD 3.18Å; A306-M471 WeakPolarHBondContact CB-SD 3.2Å
307	K	98.2	Very high	95.1	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.017	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	128.6	-177	-62.7	-148.7	-173.6	-169.6	0	110.2	Y275 Y289 R290 N291 A401 Y402	Y275-K307 PolarHBondContact OH-NZ 2.82Å; Y289-K307 HydrophobicContact CD1-CB 3.88Å; Y289-K307 HydrophobicContact CG-CB 4.31Å; R290-K307 WeakPolarHBondContact O-CA 3.18Å; N291-K307 WeakPolarHBondContact OD1-CD 3.15Å; N291-K307 WeakPolarHBondContact OD1-CE 3.38Å; N291-K307 VanDerWaalsContact OD1-CG 3.29Å; N291-K307 WeakPolarHBondContact OD1-CG 3.34Å; K307-A401 CarbonylContact O-C 3.57Å; K307-A401 WeakPolarHBondContact O-CA 3.36Å; K307-A401 WeakPolarHBondContact O-CB 3.4Å; K307-Y402 HydrophobicContact CB-CD1 4Å; K307-Y402 HydrophobicContact CB-CE1 3.6Å; K307-Y402 HydrophobicContact CB-CE2 4.34Å; K307-Y402 HydrophobicContact CD-CE1 3.85Å; K307-Y402 WeakPolarHBondContact CD-OH 3.43Å; K307-Y402 WeakPolarHBondContact CE-OH 3.45Å; K307-Y402 HydrophobicContact CG-CE1 3.85Å; K307-Y402 HydrophobicContact CG-CE2 4.06Å; K307-Y402 WeakPolarHBondContact CG-OH 3.15Å; K307-Y402 PolarHBondContact N-O 3.13Å; K307-Y402 PolarHBondContact O-N 3.13Å
308	L	98.3	Very high	95.4	Very high	12 Å²	12	49.9 Å²	49.9	6%	0.063	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	125.6	174.6	174.3	63.4	0	0	0	108.8	Y289 R290 A401 Y460 L463 K464 F467	Y289-L308 CarbonylContact C-O 3.59Å; Y289-L308 VanDerWaalsContact CA-O 3.26Å; Y289-L308 WeakPolarHBondContact CA-O 3.18Å; R290-L308 PolarHBondContact N-O 3.04Å; R290-L308 PolarHBondContact O-N 3.31Å; L308-A401 HydrophobicContact CD1-CB 3.87Å; L308-Y460 HydrophobicContact CD1-CE2 4.27Å; L308-Y460 HydrophobicContact CD2-CE2 4.29Å; L308-Y460 HydrophobicContact CG-CE2 4.28Å; L308-L463 HydrophobicContact CD1-CD2 3.72Å; L308-L463 HydrophobicContact CD1-CG 3.77Å; L308-K464 HydrophobicContact CD2-CB 4.23Å; L308-K464 HydrophobicContact CD2-CG 3.99Å; L308-F467 HydrophobicContact CB-CD1 4.3Å; L308-F467 HydrophobicContact CB-CD2 4.43Å; L308-F467 HydrophobicContact CB-CE1 4.15Å; L308-F467 HydrophobicContact CB-CE2 4.26Å; L308-F467 HydrophobicContact CB-CG 4.43Å; L308-F467 HydrophobicContact CB-CZ 4.11Å; L308-F467 HydrophobicContact CD2-CD1 4.43Å
309	E	98.2	Very high	95.6	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	137.2	173.9	-175.6	-175.6	152.8	0	0	110.5	R287 I288 Y289 R397 L399 T400 Y460	R287-E309 WeakPolarHBondContact CD-OE1 3.29Å; R287-E309 IonicContact NE-OE1 2.71Å; I288-E309 CarbonylContact O-C 3.59Å; I288-E309 WeakPolarHBondContact O-CA 3.23Å; Y289-E309 HydrophobicContact CD1-CB 4.06Å; Y289-E309 HydrophobicContact CE1-CB 3.81Å; E309-R397 IonicContact OE1-CZ 3.69Å; E309-R397 IonicContact OE1-NE 3.61Å; E309-R397 IonicContact OE1-NH2 2.85Å; E309-R397 PolarHBondContact OE1-NH2 3.25Å; E309-L399 WeakPolarHBondContact OE1-CD2 3.25Å; E309-T400 WeakPolarHBondContact CB-O 3.42Å; E309-T400 PolarHBondContact N-O 2.91Å; E309-T400 PolarHBondContact OE2-N 3.39Å; E309-T400 PolarHBondContact OE2-OG1 2.88Å; E309-Y460 VanDerWaalsContact O-CE2 3.27Å; E309-Y460 WeakPolarHBondContact O-CE2 3.44Å
310	L	97.5	Very high	96	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.01	25%	0.251	C	S	.	.			trans	-89.2	145.9	168.7	-56.9	-174.9	0	0	0	111	Y272 I288 R290 Y317 H320 R397	Y272-L310 HydrophobicContact CD1-CD1 3.93Å; Y272-L310 HydrophobicContact CE1-CD1 3.78Å; I288-L310 HydrophobicContact CB-CB 4.41Å; I288-L310 HydrophobicContact CB-CD1 4.45Å; I288-L310 HydrophobicContact CG2-CD1 3.84Å; I288-L310 HydrophobicContact CG2-CG 4.31Å; I288-L310 PolarHBondContact O-N 3.09Å; R290-L310 HydrophobicContact CB-CD2 4.03Å; L310-Y317 HydrophobicContact CB-CD2 3.82Å; L310-Y317 HydrophobicContact CB-CE2 4.41Å; L310-Y317 WeakPolarHBondContact O-CE2 3.32Å; L310-H320 HydrophobicContact CD1-CB 4.43Å; L310-R397 PolarHBondContact O-NH2 3.48Å
311	C	95.7	Very high	96.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.235	C	C	.	.			trans	-138.7	174.9	176.4	56.6	0	0	0	0	110.8	E313 D314 Y317 L399 Y460	C311-E313 WeakPolarHBondContact CB-OE2 3.46Å; C311-E313 PolarHBondContact O-N 2.91Å; C311-E313 VanDerWaalsContact O-N 3.11Å; C311-E313 PolarHBondContact SG-OE2 3.31Å; C311-D314 WeakPolarHBondContact O-CB 3.46Å; C311-D314 PolarHBondContact O-N 2.9Å; C311-Y317 VanDerWaalsContact C-CG 3.48Å; C311-Y317 WeakPolarHBondContact O-CB 3.4Å; C311-Y317 VanDerWaalsContact O-CG 3.26Å; C311-L399 HydrophobicContact CB-CD1 4.26Å; C311-L399 HydrophobicContact CB-CD2 3.53Å; C311-Y460 WeakPolarHBondContact SG-CD2 3.37Å
312	Q	95.8	Very high	96.6	Very high	140 Å²	140	43.5 Å²	43.5	65%	0.654	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-20.8	-175.4	64.9	-172	1.1	0	0	113.5	D314 Y317	Q312-D314 PolarHBondContact O-N 3.38Å; Q312-Y317 HydrophobicContact CB-CD1 4.23Å; Q312-Y317 HydrophobicContact CB-CE1 4.45Å
313	E	95.7	Very high	96.8	Very high	103 Å²	103	38.2 Å²	38.2	48%	0.481	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-10.5	174.7	-60.4	75.1	-165.3	0	0	113	C311 Y460	C311-E313 WeakPolarHBondContact CB-OE2 3.46Å; C311-E313 PolarHBondContact O-N 2.91Å; C311-E313 VanDerWaalsContact O-N 3.11Å; C311-E313 PolarHBondContact SG-OE2 3.31Å; E313-Y460 HydrophobicContact CB-CD1 4.1Å
314	D	95.9	Very high	96.9	Very high	17 Å²	17	35.4 Å²	35.4	9%	0.091	20%	0.201	C	C	.	.	S	Bend	trans	-91.9	123.7	171	-166.6	-69.7	0	0	0	109.8	C311 Q312 E316 Y317 Y460	C311-D314 WeakPolarHBondContact O-CB 3.46Å; C311-D314 PolarHBondContact O-N 2.9Å; Q312-D314 PolarHBondContact O-N 3.38Å; D314-E316 PolarHBondContact O-N 2.89Å; D314-E316 VanDerWaalsContact OD1-CB 3.31Å; D314-E316 WeakPolarHBondContact OD1-CB 3.27Å; D314-E316 PolarHBondContact OD1-N 3.45Å; D314-Y317 WeakPolarHBondContact O-CB 3.22Å; D314-Y317 PolarHBondContact O-N 3.12Å; D314-Y460 HydrophobicContact CB-CE1 3.9Å; D314-Y460 PolarHBondContact OD2-OH 3.25Å; D314-Y460 VanDerWaalsContact OD2-OH 3.04Å
315	D	95.3	Very high	96.9	Very high	168 Å²	168	38.8 Å²	38.8	90%	0.898	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-23.4	-175.9	-62.8	-28.5	0	0	0	113.3
316	E	94.7	Very high	96.9	Very high	57 Å²	57	39.5 Å²	39.5	27%	0.266	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-15.2	-179.7	-72.6	-164.7	172.2	0	0	113.8	Y272 D314 A318 A319 H320 R345	Y272-E316 PolarHBondContact OH-OE2 3.22Å; D314-E316 PolarHBondContact O-N 2.89Å; D314-E316 VanDerWaalsContact OD1-CB 3.31Å; D314-E316 WeakPolarHBondContact OD1-CB 3.27Å; D314-E316 PolarHBondContact OD1-N 3.45Å; E316-A318 PolarHBondContact O-N 3.14Å; E316-A319 PolarHBondContact O-N 3.2Å; E316-A319 VanDerWaalsContact O-N 3.13Å; E316-H320 PolarHBondContact O-CD2 3.36Å; E316-H320 PolarHBondContact O-N 2.66Å; E316-H320 IonicContact OE2-NE2 2.85Å; E316-H320 PolarHBondContact OE2-NE2 2.8Å; E316-R345 VanDerWaalsContact CD-NH1 3.27Å; E316-R345 IonicContact OE1-CZ 3.9Å; E316-R345 IonicContact OE1-NH1 3.54Å; E316-R345 IonicContact OE2-CZ 2.84Å; E316-R345 IonicContact OE2-NH1 2.98Å; E316-R345 PolarHBondContact OE2-NH1 3.3Å
317	Y	97.5	Very high	96.9	Very high	36 Å²	36	39.5 Å²	39.5	14%	0.141	22%	0.22	C	C	.	.	H	α-helix	trans	-56.9	-43.7	-166.9	-177.6	-107	0	0	0	113.6	L310 C311 Q312 D314 A319 H320 C321	L310-Y317 HydrophobicContact CB-CD2 3.82Å; L310-Y317 HydrophobicContact CB-CE2 4.41Å; L310-Y317 WeakPolarHBondContact O-CE2 3.32Å; C311-Y317 VanDerWaalsContact C-CG 3.48Å; C311-Y317 WeakPolarHBondContact O-CB 3.4Å; C311-Y317 VanDerWaalsContact O-CG 3.26Å; Q312-Y317 HydrophobicContact CB-CD1 4.23Å; Q312-Y317 HydrophobicContact CB-CE1 4.45Å; D314-Y317 WeakPolarHBondContact O-CB 3.22Å; D314-Y317 PolarHBondContact O-N 3.12Å; Y317-A319 VanDerWaalsContact C-N 3.34Å; Y317-A319 PolarHBondContact O-N 3.31Å; Y317-H320 PolarHBondContact O-N 3.46Å; Y317-C321 VanDerWaalsContact CE1-SG 3.5Å; Y317-C321 VanDerWaalsContact CZ-SG 3.53Å; Y317-C321 PolarHBondContact O-N 3.39Å; Y317-C321 PolarHBondContact O-SG 2.85Å
318	A	97.1	Very high	96.8	Very high	75 Å²	75	40 Å²	40	62%	0.62	23%	0.225	S	C	*	.	H	α-helix	trans	-61	-41.5	-179.4	0	0	0	0	0	112.5	E316 C321 A322	E316-A318 PolarHBondContact O-N 3.14Å; A318-C321 PolarHBondContact O-N 2.97Å; A318-A322 PolarHBondContact O-N 3.34Å
319	A	97.2	Very high	96.7	Very high	34 Å²	34	43.4 Å²	43.4	28%	0.281	25%	0.246	S	C	.	.	H	α-helix	trans	-64.8	-40.7	176.8	0	0	0	0	0	111.3	E316 Y317 A322 Y323 F351	E316-A319 PolarHBondContact O-N 3.2Å; E316-A319 VanDerWaalsContact O-N 3.13Å; Y317-A319 VanDerWaalsContact C-N 3.34Å; Y317-A319 PolarHBondContact O-N 3.31Å; A319-A322 PolarHBondContact O-N 3.48Å; A319-Y323 PolarHBondContact O-N 2.81Å; A319-F351 HydrophobicContact CB-CZ 4.18Å
320	H	98.1	Very high	96.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-64.4	-41.2	174.8	-75	-77.5	0	0	0	112.4	Y272 I288 L310 E316 Y317 A322 Y323 V324 Y343 R345 F351	Y272-H320 AromaticContact CD1-CE1 3.47Å; Y272-H320 VanDerWaalsContact CD1-CE1 3.47Å; Y272-H320 WeakPolarHBondContact CD1-CE1 3.49Å; Y272-H320 AromaticContact CD1-ND1 3.93Å; Y272-H320 AromaticContact CD1-NE2 3.99Å; Y272-H320 AromaticContact CD2-CE1 3.66Å; Y272-H320 AromaticContact CE1-CE1 3.31Å; Y272-H320 WeakPolarHBondContact CE1-CE1 3.37Å; Y272-H320 AromaticContact CE1-NE2 3.41Å; Y272-H320 WeakPolarHBondContact CE1-NE2 3.5Å; Y272-H320 AromaticContact CE2-CE1 3.56Å; Y272-H320 AromaticContact CG-CE1 3.64Å; Y272-H320 AromaticContact CZ-CE1 3.36Å; Y272-H320 AromaticContact CZ-NE2 3.46Å; I288-H320 HydrophobicContact CD1-CB 3.69Å; I288-H320 HydrophobicContact CG2-CB 4.32Å; L310-H320 HydrophobicContact CD1-CB 4.43Å; E316-H320 PolarHBondContact O-CD2 3.36Å; E316-H320 PolarHBondContact O-N 2.66Å; E316-H320 IonicContact OE2-NE2 2.85Å; E316-H320 PolarHBondContact OE2-NE2 2.8Å; Y317-H320 PolarHBondContact O-N 3.46Å; H320-A322 PolarHBondContact O-N 3.21Å; H320-Y323 PolarHBondContact O-N 3.18Å; H320-V324 VanDerWaalsContact O-CG2 3.29Å; H320-V324 WeakPolarHBondContact O-CG2 3.48Å; H320-V324 PolarHBondContact O-N 3.04Å; H320-Y343 AromaticContact CE1-CE2 3.85Å; H320-Y343 AromaticContact ND1-CE2 3.4Å; H320-Y343 WeakPolarHBondContact ND1-CE2 3.11Å; H320-Y343 AromaticContact ND1-CZ 3.64Å; H320-Y343 PolarHBondContact ND1-OH 2.96Å; H320-R345 PolarHBondContact NE2-NH1 3.44Å; H320-F351 AromaticContact CE1-CE1 3.76Å; H320-F351 AromaticContact ND1-CE1 3.65Å
321	C	97.6	Very high	96.6	Very high	21 Å²	21	43.7 Å²	43.7	14%	0.142	25%	0.249	C	C	.	.	H	α-helix	trans	-59.9	-43.8	174	-74.6	0	0	0	0	112.2	Y317 A318 Y323 V324 N325	Y317-C321 VanDerWaalsContact CE1-SG 3.5Å; Y317-C321 VanDerWaalsContact CZ-SG 3.53Å; Y317-C321 PolarHBondContact O-N 3.39Å; Y317-C321 PolarHBondContact O-SG 2.85Å; A318-C321 PolarHBondContact O-N 2.97Å; C321-Y323 VanDerWaalsContact C-N 3.32Å; C321-Y323 PolarHBondContact O-N 2.82Å; C321-V324 PolarHBondContact O-N 3.15Å; C321-N325 PolarHBondContact O-N 3.44Å; C321-N325 PolarHBondContact O-ND2 2.74Å
322	A	96.6	Very high	96.6	Very high	44 Å²	44	47 Å²	47	36%	0.364	27%	0.272	S	S	.	.	H	α-helix	trans	-60.3	-42.5	175.4	0	0	0	0	0	111.7	A318 A319 H320 N325 Y326	A318-A322 PolarHBondContact O-N 3.34Å; A319-A322 PolarHBondContact O-N 3.48Å; H320-A322 PolarHBondContact O-N 3.21Å; A322-N325 PolarHBondContact O-N 2.62Å; A322-Y326 PolarHBondContact O-N 2.82Å
323	Y	97.6	Very high	96.6	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-67.4	-37.6	176.2	-171.5	-115.2	0	0	0	114.3	P190 V192 A319 H320 C321 Y326 L327 Y343 F351 F353	P190-Y323 HydrophobicContact CB-CD2 4.12Å; P190-Y323 HydrophobicContact CG-CD2 3.89Å; V192-Y323 HydrophobicContact CB-CE2 4.48Å; V192-Y323 HydrophobicContact CG1-CE2 4.11Å; V192-Y323 HydrophobicContact CG2-CD2 3.99Å; V192-Y323 HydrophobicContact CG2-CE2 3.57Å; A319-Y323 PolarHBondContact O-N 2.81Å; H320-Y323 PolarHBondContact O-N 3.18Å; C321-Y323 VanDerWaalsContact C-N 3.32Å; C321-Y323 PolarHBondContact O-N 2.82Å; Y323-Y326 AromaticContact CD2-CD1 3.97Å; Y323-Y326 HydrophobicContact CD2-CD1 3.97Å; Y323-Y326 AromaticContact CE2-CD1 3.79Å; Y323-Y326 HydrophobicContact CE2-CD1 3.79Å; Y323-Y326 HydrophobicContact CE2-CE1 4.18Å; Y323-Y326 WeakPolarHBondContact O-CB 3.43Å; Y323-Y326 PolarHBondContact O-N 2.74Å; Y323-L327 HydrophobicContact CD1-CD1 4.05Å; Y323-L327 HydrophobicContact CD1-CG 4.43Å; Y323-L327 HydrophobicContact CE1-CD1 3.54Å; Y323-L327 HydrophobicContact CE1-CD2 4.43Å; Y323-L327 HydrophobicContact CE1-CG 4.02Å; Y323-L327 HydrophobicContact CE2-CD2 4.23Å; Y323-L327 HydrophobicContact CE2-CG 4.23Å; Y323-L327 WeakPolarHBondContact O-CG 3.02Å; Y323-L327 PolarHBondContact O-N 3.1Å; Y323-Y343 HydrophobicContact CD1-CD1 4.13Å; Y323-Y343 AromaticContact CD1-CD2 3.72Å; Y323-Y343 HydrophobicContact CD1-CD2 3.72Å; Y323-Y343 HydrophobicContact CD1-CE1 4.19Å; Y323-Y343 AromaticContact CD1-CE2 3.77Å; Y323-Y343 HydrophobicContact CD1-CE2 3.77Å; Y323-Y343 AromaticContact CD1-CG 3.9Å; Y323-Y343 HydrophobicContact CD1-CG 3.9Å; Y323-Y343 AromaticContact CE1-CD1 3.84Å; Y323-Y343 HydrophobicContact CE1-CD1 3.84Å; Y323-Y343 AromaticContact CE1-CD2 3.56Å; Y323-Y343 HydrophobicContact CE1-CD2 3.56Å; Y323-Y343 HydrophobicContact CE1-CE1 4.36Å; Y323-Y343 HydrophobicContact CE1-CE2 4.1Å; Y323-Y343 AromaticContact CE1-CG 3.4Å; Y323-Y343 HydrophobicContact CE1-CG 3.4Å; Y323-Y343 VanDerWaalsContact CE1-CG 3.4Å; Y323-F351 HydrophobicContact CD1-CB 4.01Å; Y323-F351 AromaticContact CD1-CD1 3.46Å; Y323-F351 HydrophobicContact CD1-CD1 3.46Å; Y323-F351 VanDerWaalsContact CD1-CD1 3.46Å; Y323-F351 HydrophobicContact CD1-CE1 4.02Å; Y323-F351 AromaticContact CD1-CG 3.74Å; Y323-F351 HydrophobicContact CD1-CG 3.74Å; Y323-F351 HydrophobicContact CD2-CB 3.57Å; Y323-F351 HydrophobicContact CD2-CD1 4.2Å; Y323-F351 AromaticContact CD2-CD2 3.83Å; Y323-F351 HydrophobicContact CD2-CD2 3.83Å; Y323-F351 AromaticContact CD2-CG 3.6Å; Y323-F351 HydrophobicContact CD2-CG 3.6Å; Y323-F351 HydrophobicContact CE1-CB 3.81Å; Y323-F351 AromaticContact CE1-CD1 3.92Å; Y323-F351 HydrophobicContact CE1-CD1 3.92Å; Y323-F351 HydrophobicContact CE1-CG 4.06Å; Y323-F351 HydrophobicContact CE2-CB 3.39Å; Y323-F351 AromaticContact CE2-CG 3.96Å; Y323-F351 HydrophobicContact CE2-CG 3.96Å; Y323-F351 HydrophobicContact CG-CB 3.88Å; Y323-F351 AromaticContact CG-CD1 3.6Å; Y323-F351 HydrophobicContact CG-CD1 3.6Å; Y323-F351 AromaticContact CG-CD2 3.83Å; Y323-F351 HydrophobicContact CG-CD2 3.83Å; Y323-F351 HydrophobicContact CG-CE1 4.04Å; Y323-F351 HydrophobicContact CG-CE2 4.24Å; Y323-F351 AromaticContact CG-CG 3.47Å; Y323-F351 HydrophobicContact CG-CG 3.47Å; Y323-F351 VanDerWaalsContact CG-CG 3.47Å; Y323-F351 HydrophobicContact CG-CZ 4.34Å; Y323-F351 VanDerWaalsContact CZ-CB 3.49Å; Y323-F353 WeakPolarHBondContact OH-CA 3.3Å; Y323-F353 PolarHBondContact OH-N 2.88Å
324	V	97.6	Very high	96.7	Very high	2 Å²	2	40.3 Å²	40.3	1%	0.012	25%	0.249	C	C	.	.	H	α-helix	trans	-63.2	-42.8	173.7	170.5	0	0	0	0	111.5	A274 M276 I283 I288 H320 C321 L327 A328	A274-V324 HydrophobicContact CB-CG1 4.29Å; A274-V324 HydrophobicContact CB-CG2 3.37Å; M276-V324 HydrophobicContact CE-CG1 4.34Å; M276-V324 HydrophobicContact CG-CG1 3.99Å; M276-V324 HydrophobicContact SD-CG1 3.43Å; M276-V324 WeakPolarHBondContact SD-CG1 3.15Å; I283-V324 HydrophobicContact CD1-CG1 4.45Å; I288-V324 HydrophobicContact CD1-CG2 3.73Å; I288-V324 HydrophobicContact CG1-CG2 4.14Å; H320-V324 VanDerWaalsContact O-CG2 3.29Å; H320-V324 WeakPolarHBondContact O-CG2 3.48Å; H320-V324 PolarHBondContact O-N 3.04Å; C321-V324 PolarHBondContact O-N 3.15Å; V324-L327 PolarHBondContact O-N 3.39Å; V324-A328 WeakPolarHBondContact O-CB 3.3Å; V324-A328 PolarHBondContact O-N 3.45Å
325	N	96.2	Very high	96.6	Very high	89 Å²	89	41.1 Å²	41.1	48%	0.476	26%	0.255	S	S	.	.	H	α-helix	trans	-64.4	-39.8	174.7	-74.8	-35.3	0	0	0	112.2	I283 C321 A322 A328 T329	I283-N325 WeakPolarHBondContact CD1-OD1 3.31Å; C321-N325 PolarHBondContact O-N 3.44Å; C321-N325 PolarHBondContact O-ND2 2.74Å; A322-N325 PolarHBondContact O-N 2.62Å; N325-A328 PolarHBondContact O-N 3.13Å; N325-T329 WeakPolarHBondContact O-CB 3.32Å; N325-T329 PolarHBondContact O-N 2.83Å; N325-T329 PolarHBondContact O-OG1 2.61Å
326	Y	96.8	Very high	96.5	Very high	24 Å²	24	35.3 Å²	35.3	9%	0.094	22%	0.224	C	C	.	.	H	α-helix	trans	-56.4	-50.6	173.1	169.1	-92	0	0	0	111.2	L180 F183 P185 P190 V192 A322 Y323 T329 A330	L180-Y326 HydrophobicContact CD2-CE1 3.99Å; F183-Y326 HydrophobicContact CD1-CD2 4.18Å; F183-Y326 AromaticContact CD1-CE2 3.44Å; F183-Y326 HydrophobicContact CD1-CE2 3.44Å; F183-Y326 VanDerWaalsContact CD1-CE2 3.44Å; F183-Y326 AromaticContact CD1-CZ 3.74Å; F183-Y326 AromaticContact CE1-CD2 3.74Å; F183-Y326 HydrophobicContact CE1-CD2 3.74Å; F183-Y326 AromaticContact CE1-CE2 3.45Å; F183-Y326 HydrophobicContact CE1-CE2 3.45Å; F183-Y326 VanDerWaalsContact CE1-CE2 3.45Å; P185-Y326 HydrophobicContact CB-CD2 4.37Å; P185-Y326 HydrophobicContact CB-CE2 3.85Å; P190-Y326 HydrophobicContact CG-CD2 4.31Å; P190-Y326 HydrophobicContact CG-CG 3.95Å; V192-Y326 HydrophobicContact CG1-CE1 4.41Å; V192-Y326 HydrophobicContact CG2-CD1 4.07Å; V192-Y326 HydrophobicContact CG2-CE1 3.71Å; V192-Y326 HydrophobicContact CG2-CE2 4.44Å; A322-Y326 PolarHBondContact O-N 2.82Å; Y323-Y326 AromaticContact CD2-CD1 3.97Å; Y323-Y326 HydrophobicContact CD2-CD1 3.97Å; Y323-Y326 AromaticContact CE2-CD1 3.79Å; Y323-Y326 HydrophobicContact CE2-CD1 3.79Å; Y323-Y326 HydrophobicContact CE2-CE1 4.18Å; Y323-Y326 WeakPolarHBondContact O-CB 3.43Å; Y323-Y326 PolarHBondContact O-N 2.74Å; Y326-T329 PolarHBondContact O-N 2.82Å; Y326-A330 WeakPolarHBondContact O-CB 3.48Å; Y326-A330 PolarHBondContact O-N 3.23Å
327	L	97.4	Very high	96.5	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-63.9	-43.8	178.9	-68.6	179.7	0	0	0	112.5	L180 Y323 V324 T329 A330 F331 A341 Y343 F353	L180-L327 HydrophobicContact CD1-CD2 4.47Å; L180-L327 HydrophobicContact CD2-CD2 3.88Å; Y323-L327 HydrophobicContact CD1-CD1 4.05Å; Y323-L327 HydrophobicContact CD1-CG 4.43Å; Y323-L327 HydrophobicContact CE1-CD1 3.54Å; Y323-L327 HydrophobicContact CE1-CD2 4.43Å; Y323-L327 HydrophobicContact CE1-CG 4.02Å; Y323-L327 HydrophobicContact CE2-CD2 4.23Å; Y323-L327 HydrophobicContact CE2-CG 4.23Å; Y323-L327 WeakPolarHBondContact O-CG 3.02Å; Y323-L327 PolarHBondContact O-N 3.1Å; V324-L327 PolarHBondContact O-N 3.39Å; L327-T329 PolarHBondContact O-N 3.38Å; L327-A330 PolarHBondContact O-N 3.26Å; L327-F331 HydrophobicContact CD2-CE2 4.41Å; L327-F331 WeakPolarHBondContact O-CD2 3.45Å; L327-F331 PolarHBondContact O-N 2.89Å; L327-F331 VanDerWaalsContact O-N 3.08Å; L327-A341 HydrophobicContact CD1-CB 3.67Å; L327-Y343 HydrophobicContact CD1-CD1 4.33Å; L327-F353 HydrophobicContact CD1-CD2 4.24Å; L327-F353 HydrophobicContact CD2-CD2 3.68Å; L327-F353 HydrophobicContact CD2-CE2 4.24Å
328	A	96.8	Very high	96.4	Very high	14 Å²	14	31 Å²	31	12%	0.116	21%	0.205	C	C	.	.	H	α-helix	trans	-60.4	-36.8	177.5	0	0	0	0	0	112	M276 I283 V324 N325 S332 I334	M276-A328 HydrophobicContact SD-CB 4.42Å; I283-A328 HydrophobicContact CD1-CB 3.9Å; I283-A328 HydrophobicContact CG1-CB 4.39Å; V324-A328 WeakPolarHBondContact O-CB 3.3Å; V324-A328 PolarHBondContact O-N 3.45Å; N325-A328 PolarHBondContact O-N 3.13Å; A328-S332 PolarHBondContact O-N 3.14Å; A328-I334 HydrophobicContact CB-CD1 4.3Å; A328-I334 WeakPolarHBondContact O-CD1 3.37Å
329	T	96.3	Very high	96.4	Very high	84 Å²	84	27.4 Å²	27.4	52%	0.515	18%	0.176	S	C	.	.	H	α-helix	trans	-70.5	-46.8	176.2	-52.1	0	0	0	0	111.1	F183 N325 Y326 L327 F331 S332	F183-T329 HydrophobicContact CE2-CG2 3.9Å; F183-T329 HydrophobicContact CZ-CG2 3.56Å; N325-T329 WeakPolarHBondContact O-CB 3.32Å; N325-T329 PolarHBondContact O-N 2.83Å; N325-T329 PolarHBondContact O-OG1 2.61Å; Y326-T329 PolarHBondContact O-N 2.82Å; L327-T329 PolarHBondContact O-N 3.38Å; T329-F331 VanDerWaalsContact C-N 3.27Å; T329-F331 PolarHBondContact O-N 2.77Å; T329-S332 VanDerWaalsContact O-CB 3.25Å; T329-S332 WeakPolarHBondContact O-CB 3.31Å; T329-S332 PolarHBondContact O-N 3.24Å; T329-S332 VanDerWaalsContact O-N 3.16Å
330	A	96.4	Very high	96.4	Very high	9 Å²	9	26 Å²	26	7%	0.074	16%	0.164	C	C	.	.	H	α-helix	trans	-61.4	-33.2	-178.1	0	0	0	0	0	113.7	T179 L180 F183 Y326 L327	T179-A330 WeakPolarHBondContact CG2-O 3.32Å; L180-A330 HydrophobicContact CD2-CB 3.73Å; F183-A330 HydrophobicContact CB-CB 4.02Å; F183-A330 HydrophobicContact CD1-CB 3.6Å; F183-A330 HydrophobicContact CD2-CB 3.94Å; F183-A330 HydrophobicContact CE1-CB 4Å; F183-A330 HydrophobicContact CE2-CB 4.31Å; F183-A330 HydrophobicContact CG-CB 3.56Å; F183-A330 HydrophobicContact CZ-CB 4.34Å; Y326-A330 WeakPolarHBondContact O-CB 3.48Å; Y326-A330 PolarHBondContact O-N 3.23Å; L327-A330 PolarHBondContact O-N 3.26Å
331	F	97.3	Very high	96.4	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	2.9	180	-76	-78.1	0	0	0	114.5	R169 F170 M176 T179 L180 L327 T329 I334 F339 F353 N356	R169-F331 HydrophobicContact CB-CD1 4.23Å; R169-F331 HydrophobicContact CB-CE1 4.33Å; R169-F331 HydrophobicContact CG-CD1 4.18Å; R169-F331 PolarHBondContact NE-O 2.75Å; R169-F331 VanDerWaalsContact NE-O 3.11Å; R169-F331 VanDerWaalsContact O-CE1 3.25Å; R169-F331 WeakPolarHBondContact O-CE1 3.18Å; F170-F331 HydrophobicContact CD1-CD1 4.49Å; F170-F331 HydrophobicContact CE1-CB 3.86Å; F170-F331 HydrophobicContact CE1-CD1 4.22Å; F170-F331 HydrophobicContact CE1-CG 4.36Å; F170-F331 HydrophobicContact CZ-CB 4.34Å; F170-F331 WeakPolarHBondContact CZ-O 3.38Å; M176-F331 HydrophobicContact CB-CE1 4.26Å; M176-F331 HydrophobicContact CB-CZ 4.23Å; M176-F331 HydrophobicContact CG-CE1 4.43Å; T179-F331 HydrophobicContact CG2-CD1 3.8Å; T179-F331 HydrophobicContact CG2-CE1 3.82Å; T179-F331 HydrophobicContact CG2-CG 4.45Å; T179-F331 HydrophobicContact CG2-CZ 4.5Å; L180-F331 HydrophobicContact CD1-CE2 3.92Å; L180-F331 HydrophobicContact CD1-CZ 3.96Å; L180-F331 HydrophobicContact CD2-CE2 3.79Å; L180-F331 HydrophobicContact CD2-CZ 4.33Å; L180-F331 HydrophobicContact CG-CE2 3.74Å; L180-F331 HydrophobicContact CG-CZ 3.78Å; L327-F331 HydrophobicContact CD2-CE2 4.41Å; L327-F331 WeakPolarHBondContact O-CD2 3.45Å; L327-F331 PolarHBondContact O-N 2.89Å; L327-F331 VanDerWaalsContact O-N 3.08Å; T329-F331 VanDerWaalsContact C-N 3.27Å; T329-F331 PolarHBondContact O-N 2.77Å; F331-I334 HydrophobicContact CB-CD1 4.36Å; F331-I334 HydrophobicContact CB-CG1 4.26Å; F331-I334 WeakPolarHBondContact O-CG1 3.25Å; F331-F339 HydrophobicContact CB-CE2 4.48Å; F331-F339 HydrophobicContact CB-CZ 4.05Å; F331-F339 HydrophobicContact CD2-CZ 4.12Å; F331-F339 HydrophobicContact CG-CZ 4.23Å; F331-F353 HydrophobicContact CE2-CD2 4.45Å; F331-F353 AromaticContact CE2-CE2 3.76Å; F331-F353 HydrophobicContact CE2-CE2 3.76Å; F331-F353 AromaticContact CE2-CZ 3.86Å; F331-F353 HydrophobicContact CE2-CZ 3.86Å; F331-F353 HydrophobicContact CZ-CE1 4.22Å; F331-F353 HydrophobicContact CZ-CE2 4.08Å; F331-F353 AromaticContact CZ-CZ 3.67Å; F331-F353 HydrophobicContact CZ-CZ 3.67Å; F331-N356 WeakPolarHBondContact CD1-ND2 3.38Å; F331-N356 VanDerWaalsContact CD2-ND2 3.32Å; F331-N356 WeakPolarHBondContact CD2-ND2 3.23Å; F331-N356 WeakPolarHBondContact CE1-ND2 3.26Å; F331-N356 WeakPolarHBondContact CE2-ND2 3.46Å; F331-N356 VanDerWaalsContact CG-ND2 3.26Å; F331-N356 WeakPolarHBondContact CG-ND2 3.43Å; F331-N356 WeakPolarHBondContact CZ-ND2 3.27Å
332	S	95.9	Very high	96.4	Very high	69 Å²	69	26.4 Å²	26.4	48%	0.483	16%	0.163	S	C	.	.	P	Polyproline II helix	trans	-66	144.7	178.1	-165.5	0	0	0	0	112	A328 T329	A328-S332 PolarHBondContact O-N 3.14Å; T329-S332 VanDerWaalsContact O-CB 3.25Å; T329-S332 WeakPolarHBondContact O-CB 3.31Å; T329-S332 PolarHBondContact O-N 3.24Å; T329-S332 VanDerWaalsContact O-N 3.16Å
333	P	95.8	Very high	96.5	Very high	88 Å²	88	24.3 Å²	24.3	57%	0.571	15%	0.146	S	C	*	.	S	Bend	cis	-73.4	128.2	-2	28.9	-33.4	0	0	0	112.4	R169	R169-P333 PolarHBondContact NH2-O 3.01Å
334	I	95.9	Very high	96.5	Very high	14 Å²	14	25.1 Å²	25.1	7%	0.072	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-92.8	129.9	175.2	-60.6	165.8	0	0	0	108.3	F170 I278 A328 F331 F339 I358	F170-I334 HydrophobicContact CE1-CG1 4.14Å; F170-I334 HydrophobicContact CE1-CG2 4.47Å; F170-I334 HydrophobicContact CZ-CB 4.46Å; F170-I334 HydrophobicContact CZ-CG1 4.07Å; F170-I334 HydrophobicContact CZ-CG2 4.47Å; I278-I334 HydrophobicContact CB-CG2 4.39Å; I278-I334 HydrophobicContact CG1-CB 4.42Å; I278-I334 HydrophobicContact CG1-CD1 4.44Å; I278-I334 HydrophobicContact CG1-CG2 4.01Å; I278-I334 HydrophobicContact CG2-CB 4.36Å; A328-I334 HydrophobicContact CB-CD1 4.3Å; A328-I334 WeakPolarHBondContact O-CD1 3.37Å; F331-I334 HydrophobicContact CB-CD1 4.36Å; F331-I334 HydrophobicContact CB-CG1 4.26Å; F331-I334 WeakPolarHBondContact O-CG1 3.25Å; I334-F339 HydrophobicContact CD1-CD1 3.61Å; I334-F339 HydrophobicContact CD1-CD2 4.43Å; I334-F339 HydrophobicContact CD1-CE1 3.69Å; I334-F339 HydrophobicContact CD1-CE2 4.47Å; I334-F339 HydrophobicContact CD1-CG 4.02Å; I334-F339 HydrophobicContact CD1-CZ 4.13Å; I334-F339 HydrophobicContact CG2-CB 3.99Å; I334-F339 HydrophobicContact CG2-CD2 4.29Å; I334-F339 HydrophobicContact CG2-CG 4.12Å; I334-I358 HydrophobicContact CG2-CG2 4.07Å
335	P	94.1	Very high	96.5	Very high	35 Å²	35	27 Å²	27	23%	0.227	16%	0.157	C	C	.	.	P	Polyproline II helix	trans	-58.6	142.2	174.1	-23.7	34.7	0	0	0	111.9	A162 I167 G337 I358	A162-P335 HydrophobicContact CB-CG 3.79Å; I167-P335 HydrophobicContact CD1-CG 4.36Å; P335-G337 PolarHBondContact O-N 3.06Å; P335-I358 HydrophobicContact CG-CD1 3.96Å
336	D	93.3	Very high	96.5	Very high	45 Å²	45	27.2 Å²	27.2	24%	0.241	15%	0.151	C	C	.	.	S	Bend	trans	-58.9	137.6	179.4	-64.7	-28.7	0	0	0	112	I278 F279 Q280 G384 Q385	I278-D336 WeakPolarHBondContact O-CA 3.46Å; F279-D336 WeakPolarHBondContact CA-OD1 3.47Å; F279-D336 HydrophobicContact CD2-CB 4.43Å; Q280-D336 PolarHBondContact N-OD1 2.99Å; D336-G384 WeakPolarHBondContact CB-O 3.4Å; D336-Q385 HydrophobicContact CB-CG 4.49Å
337	G	94.4	Very high	96.5	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.01	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	126.1	-154.6	-174.6	0	0	0	0	0	112.9	I278 P335	I278-G337 PolarHBondContact N-O 3Å; I278-G337 PolarHBondContact O-N 3.43Å; P335-G337 PolarHBondContact O-N 3.06Å
338	M	95.8	Very high	96.4	Very high	1 Å²	1	37 Å²	37	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	130.3	-178.5	-72	-59.6	-56.9	0	0	111.3	M276 L277 W285 I358 R359 L360 P361 L377 H381	M276-M338 CarbonylContact O-C 3.5Å; M276-M338 WeakPolarHBondContact O-CA 3.31Å; L277-M338 HydrophobicContact CB-SD 4.43Å; L277-M338 HydrophobicContact CD1-SD 3.98Å; W285-M338 HydrophobicContact CZ3-CE 4.22Å; M338-I358 CarbonylContact O-C 3.58Å; M338-I358 VanDerWaalsContact O-CA 3.23Å; M338-I358 WeakPolarHBondContact O-CA 3.48Å; M338-R359 WeakPolarHBondContact CB-O 3.34Å; M338-L360 HydrophobicContact CG-CD1 4.28Å; M338-P361 HydrophobicContact CE-CG 4.26Å; M338-L377 HydrophobicContact SD-CD2 3.97Å; M338-H381 HydrophobicContact CG-CB 3.91Å; M338-H381 PolarHBondContact N-ND1 2.89Å
339	F	97	Very high	96.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	126.5	165.4	177.7	-127.8	0	0	0	108.2	F170 M276 I278 F331 I334 N356 I358	F170-F339 HydrophobicContact CD1-CD2 4.35Å; F170-F339 AromaticContact CD1-CE2 3.96Å; F170-F339 HydrophobicContact CD1-CE2 3.96Å; F170-F339 HydrophobicContact CE1-CD2 4.22Å; F170-F339 AromaticContact CE1-CE2 3.83Å; F170-F339 HydrophobicContact CE1-CE2 3.83Å; M276-F339 HydrophobicContact CB-CB 4.41Å; M276-F339 HydrophobicContact CE-CD1 3.21Å; M276-F339 HydrophobicContact CE-CE1 3.57Å; M276-F339 HydrophobicContact CE-CG 4.03Å; M276-F339 PolarHBondContact N-O 2.99Å; M276-F339 PolarHBondContact O-N 2.83Å; M276-F339 HydrophobicContact SD-CD1 3.62Å; M276-F339 HydrophobicContact SD-CE1 4.08Å; I278-F339 HydrophobicContact CG1-CB 3.89Å; F331-F339 HydrophobicContact CB-CE2 4.48Å; F331-F339 HydrophobicContact CB-CZ 4.05Å; F331-F339 HydrophobicContact CD2-CZ 4.12Å; F331-F339 HydrophobicContact CG-CZ 4.23Å; I334-F339 HydrophobicContact CD1-CD1 3.61Å; I334-F339 HydrophobicContact CD1-CD2 4.43Å; I334-F339 HydrophobicContact CD1-CE1 3.69Å; I334-F339 HydrophobicContact CD1-CE2 4.47Å; I334-F339 HydrophobicContact CD1-CG 4.02Å; I334-F339 HydrophobicContact CD1-CZ 4.13Å; I334-F339 HydrophobicContact CG2-CB 3.99Å; I334-F339 HydrophobicContact CG2-CD2 4.29Å; I334-F339 HydrophobicContact CG2-CG 4.12Å; F339-N356 HydrophobicContact CE2-CB 3.64Å; F339-N356 HydrophobicContact CZ-CB 4.05Å; F339-I358 HydrophobicContact CD2-CG2 3.86Å
340	T	97.7	Very high	96.4	Very high	6 Å²	6	35 Å²	35	4%	0.037	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	135.1	177.5	-56.5	0	0	0	0	108.7	A274 Y275 N356 C357	A274-T340 CarbonylContact O-C 3.52Å; A274-T340 VanDerWaalsContact O-CA 3.31Å; A274-T340 WeakPolarHBondContact O-CA 3.45Å; Y275-T340 HydrophobicContact CD1-CG2 3.54Å; Y275-T340 WeakPolarHBondContact CD1-OG1 3.2Å; Y275-T340 HydrophobicContact CE1-CG2 3.44Å; Y275-T340 VanDerWaalsContact CE1-CG2 3.44Å; Y275-T340 HydrophobicContact CG-CG2 4.47Å; T340-N356 CarbonylContact O-C 3.57Å; T340-N356 WeakPolarHBondContact O-CA 3.47Å; T340-N356 VanDerWaalsContact O-CB 3.24Å; T340-N356 WeakPolarHBondContact O-CB 3.31Å; T340-C357 PolarHBondContact N-O 2.91Å; T340-C357 PolarHBondContact O-N 2.84Å
341	A	98	Very high	96.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	134.1	171.6	0	0	0	0	0	110.5	A273 A274 M276 L327 N356	A273-A341 CarbonylContact C-O 3.53Å; A273-A341 WeakPolarHBondContact CA-O 3.37Å; A274-A341 PolarHBondContact N-O 3.26Å; A274-A341 PolarHBondContact O-N 3.15Å; M276-A341 HydrophobicContact CE-CB 4.18Å; L327-A341 HydrophobicContact CD1-CB 3.67Å; A341-N356 HydrophobicContact CB-CB 4.4Å
342	E	97.6	Very high	96.4	Very high	28 Å²	28	35.4 Å²	35.4	13%	0.131	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	142.6	171.1	-57.1	-160	165.1	0	0	109.7	Q271 Y272 A273 I295 L354 E355	Q271-E342 PolarHBondContact NE2-OE2 2.97Å; Q271-E342 VanDerWaalsContact NE2-OE2 3.1Å; Y272-E342 WeakPolarHBondContact O-CA 3.43Å; A273-E342 HydrophobicContact CB-CG 4.21Å; I295-E342 WeakPolarHBondContact CD1-OE2 3.31Å; E342-L354 HydrophobicContact CB-CB 4.22Å; E342-L354 HydrophobicContact CB-CD2 3.95Å; E342-L354 HydrophobicContact CB-CG 4.47Å; E342-L354 WeakPolarHBondContact O-CB 3.45Å; E342-L354 PolarHBondContact O-N 3.19Å; E342-E355 HydrophobicContact CB-CG 4.29Å; E342-E355 HydrophobicContact CG-CG 4.5Å; E342-E355 PolarHBondContact N-O 3.22Å; E342-E355 PolarHBondContact O-N 3.38Å
343	Y	98.1	Very high	96.5	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.6	168.6	-175	58.9	-92	0	0	0	111.5	Q271 Y272 A274 I288 H320 Y323 L327 F351 Q352	Q271-Y343 CarbonylContact C-O 3.41Å; Q271-Y343 WeakPolarHBondContact CA-O 3.41Å; Y272-Y343 HydrophobicContact CD2-CD2 4.42Å; Y272-Y343 HydrophobicContact CD2-CE2 4.09Å; Y272-Y343 AromaticContact CG-CE2 3.95Å; Y272-Y343 HydrophobicContact CG-CE2 3.95Å; Y272-Y343 PolarHBondContact N-O 2.83Å; Y272-Y343 PolarHBondContact O-N 2.91Å; A274-Y343 HydrophobicContact CB-CE1 4.08Å; I288-Y343 WeakPolarHBondContact CG2-OH 3.36Å; H320-Y343 AromaticContact CE1-CE2 3.85Å; H320-Y343 AromaticContact ND1-CE2 3.4Å; H320-Y343 WeakPolarHBondContact ND1-CE2 3.11Å; H320-Y343 AromaticContact ND1-CZ 3.64Å; H320-Y343 PolarHBondContact ND1-OH 2.96Å; Y323-Y343 HydrophobicContact CD1-CD1 4.13Å; Y323-Y343 AromaticContact CD1-CD2 3.72Å; Y323-Y343 HydrophobicContact CD1-CD2 3.72Å; Y323-Y343 HydrophobicContact CD1-CE1 4.19Å; Y323-Y343 AromaticContact CD1-CE2 3.77Å; Y323-Y343 HydrophobicContact CD1-CE2 3.77Å; Y323-Y343 AromaticContact CD1-CG 3.9Å; Y323-Y343 HydrophobicContact CD1-CG 3.9Å; Y323-Y343 AromaticContact CE1-CD1 3.84Å; Y323-Y343 HydrophobicContact CE1-CD1 3.84Å; Y323-Y343 AromaticContact CE1-CD2 3.56Å; Y323-Y343 HydrophobicContact CE1-CD2 3.56Å; Y323-Y343 HydrophobicContact CE1-CE1 4.36Å; Y323-Y343 HydrophobicContact CE1-CE2 4.1Å; Y323-Y343 AromaticContact CE1-CG 3.4Å; Y323-Y343 HydrophobicContact CE1-CG 3.4Å; Y323-Y343 VanDerWaalsContact CE1-CG 3.4Å; L327-Y343 HydrophobicContact CD1-CD1 4.33Å; Y343-F351 AromaticContact CD2-CD1 3.9Å; Y343-F351 HydrophobicContact CD2-CD1 3.9Å; Y343-F351 HydrophobicContact CD2-CE1 4.4Å; Y343-F351 AromaticContact CE2-CD1 3.9Å; Y343-F351 HydrophobicContact CE2-CD1 3.9Å; Y343-F351 AromaticContact CE2-CE1 3.93Å; Y343-F351 HydrophobicContact CE2-CE1 3.93Å; Y343-Q352 CarbonylContact C-O 3.54Å; Y343-Q352 VanDerWaalsContact CA-O 3.25Å; Y343-Q352 WeakPolarHBondContact CA-O 3.45Å; Y343-Q352 VanDerWaalsContact CB-O 3.26Å; Y343-Q352 WeakPolarHBondContact CB-O 3.45Å
344	F	97.9	Very high	96.5	Very high	17 Å²	17	29.6 Å²	29.6	8%	0.075	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	152.4	172.8	-70.9	-106.5	0	0	0	110.8	L267 G269 D270 Q271 F351 Q352 L354	L267-F344 HydrophobicContact CB-CD1 4.43Å; L267-F344 HydrophobicContact CB-CD2 3.63Å; L267-F344 HydrophobicContact CB-CE2 3.84Å; L267-F344 HydrophobicContact CB-CG 3.96Å; L267-F344 HydrophobicContact CB-CZ 4.33Å; L267-F344 HydrophobicContact CD1-CD2 3.52Å; L267-F344 HydrophobicContact CD1-CE2 3.81Å; L267-F344 HydrophobicContact CD1-CG 4.47Å; L267-F344 HydrophobicContact CG-CD2 4.22Å; L267-F344 HydrophobicContact CG-CE2 4.4Å; G269-F344 WeakPolarHBondContact O-CD1 3.25Å; D270-F344 CarbonylContact O-C 3.57Å; D270-F344 WeakPolarHBondContact O-CA 3.45Å; Q271-F344 HydrophobicContact CB-CD1 4.07Å; Q271-F344 HydrophobicContact CB-CE1 3.73Å; Q271-F344 HydrophobicContact CB-CE2 4.36Å; Q271-F344 HydrophobicContact CB-CZ 3.89Å; Q271-F344 HydrophobicContact CG-CD2 4.38Å; Q271-F344 HydrophobicContact CG-CE1 4.23Å; Q271-F344 HydrophobicContact CG-CE2 3.95Å; Q271-F344 HydrophobicContact CG-CZ 3.87Å; F344-F351 WeakPolarHBondContact O-CA 3.44Å; F344-Q352 HydrophobicContact CB-CB 4.22Å; F344-Q352 PolarHBondContact N-O 2.89Å; F344-Q352 PolarHBondContact O-N 2.83Å; F344-L354 HydrophobicContact CD2-CB 4.38Å; F344-L354 HydrophobicContact CE2-CB 4.3Å; F344-L354 HydrophobicContact CE2-CD1 4.28Å; F344-L354 HydrophobicContact CE2-CD2 4.03Å; F344-L354 HydrophobicContact CE2-CG 4.43Å
345	R	97.5	Very high	96.6	Very high	42 Å²	42	31 Å²	31	16%	0.158	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.3	165.9	-173.2	177.6	179	171.8	-4.8	109.1	G269 D270 Y272 E316 H320 F351	G269-R345 WeakPolarHBondContact CA-O 3.31Å; D270-R345 PolarHBondContact N-O 3.3Å; D270-R345 PolarHBondContact O-N 3.37Å; Y272-R345 HydrophobicContact CD2-CB 4.26Å; Y272-R345 HydrophobicContact CE2-CB 3.7Å; E316-R345 VanDerWaalsContact CD-NH1 3.27Å; E316-R345 IonicContact OE1-CZ 3.9Å; E316-R345 IonicContact OE1-NH1 3.54Å; E316-R345 IonicContact OE2-CZ 2.84Å; E316-R345 IonicContact OE2-NH1 2.98Å; E316-R345 PolarHBondContact OE2-NH1 3.3Å; H320-R345 PolarHBondContact NE2-NH1 3.44Å; R345-F351 HydrophobicContact CB-CD1 4.28Å; R345-F351 HydrophobicContact CB-CE1 4.22Å; R345-F351 HydrophobicContact CG-CD1 4.39Å; R345-F351 HydrophobicContact CG-CE1 4.13Å
346	R	96.9	Very high	96.7	Very high	94 Å²	94	29.5 Å²	29.5	36%	0.355	16%	0.157	S	C	.	.			trans	-80.9	159.1	179	-68.5	-176.4	78.4	178.2	3.5	111	D193 A268 N348 G349 N350 Q352	D193-R346 WeakPolarHBondContact OD2-CD 3.34Å; D193-R346 IonicContact OD2-CZ 3.17Å; D193-R346 IonicContact OD2-NE 3.91Å; D193-R346 IonicContact OD2-NH1 3.49Å; D193-R346 PolarHBondContact OD2-NH1 2.93Å; A268-R346 WeakPolarHBondContact O-CG 3.2Å; R346-N348 WeakPolarHBondContact CB-OD1 3.34Å; R346-N348 PolarHBondContact O-N 2.93Å; R346-N348 VanDerWaalsContact O-N 3.14Å; R346-G349 PolarHBondContact O-N 3.19Å; R346-N350 PolarHBondContact N-O 2.96Å; R346-Q352 HydrophobicContact CG-CG 4.27Å
347	P	95.6	Very high	96.8	Very high	134 Å²	134	27.8 Å²	27.8	87%	0.87	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-26	176.3	-26.8	35.4	0	0	0	114.7	G349	P347-G349 PolarHBondContact O-N 3.39Å
348	N	95.6	Very high	96.9	Very high	96 Å²	96	28.5 Å²	28.5	51%	0.513	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-0.5	175.4	69.9	-12.5	0	0	0	113.6	R346 N350	R346-N348 WeakPolarHBondContact CB-OD1 3.34Å; R346-N348 PolarHBondContact O-N 2.93Å; R346-N348 VanDerWaalsContact O-N 3.14Å; N348-N350 PolarHBondContact ND2-ND2 2.88Å; N348-N350 WeakPolarHBondContact OD1-CB 3.27Å; N348-N350 PolarHBondContact OD1-N 3.28Å; N348-N350 VanDerWaalsContact OD1-N 3.08Å
349	G	96.1	Very high	96.9	Very high	25 Å²	25	30.5 Å²	30.5	26%	0.258	16%	0.16	S	C	.	.	S	Bend	trans	92	-10.3	-179.4	0	0	0	0	0	115.1	R346 P347	R346-G349 PolarHBondContact O-N 3.19Å; P347-G349 PolarHBondContact O-N 3.39Å
350	N	96.8	Very high	96.7	Very high	32 Å²	32	31 Å²	31	17%	0.171	16%	0.162	C	C	.	.			trans	-72.4	147.6	-178.9	-65.2	4	0	0	0	111.5	T191 D193 R346 N348	T191-N350 WeakPolarHBondContact CG2-OD1 3.21Å; D193-N350 WeakPolarHBondContact OD1-CB 3.37Å; D193-N350 PolarHBondContact OD1-ND2 2.78Å; R346-N350 PolarHBondContact N-O 2.96Å; N348-N350 PolarHBondContact ND2-ND2 2.88Å; N348-N350 WeakPolarHBondContact OD1-CB 3.27Å; N348-N350 PolarHBondContact OD1-N 3.28Å; N348-N350 VanDerWaalsContact OD1-N 3.08Å
351	F	97.8	Very high	96.5	Very high	5 Å²	5	31 Å²	31	2%	0.022	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	145	175.5	-66.2	-83.7	0	0	0	111.9	P190 T191 V192 D193 A319 H320 Y323 Y343 F344 R345	P190-F351 HydrophobicContact CB-CD2 3.93Å; P190-F351 HydrophobicContact CB-CE2 4.05Å; T191-F351 PolarHBondContact O-N 2.9Å; V192-F351 WeakPolarHBondContact CA-O 3.28Å; D193-F351 PolarHBondContact N-O 3.3Å; A319-F351 HydrophobicContact CB-CZ 4.18Å; H320-F351 AromaticContact CE1-CE1 3.76Å; H320-F351 AromaticContact ND1-CE1 3.65Å; Y323-F351 HydrophobicContact CD1-CB 4.01Å; Y323-F351 AromaticContact CD1-CD1 3.46Å; Y323-F351 HydrophobicContact CD1-CD1 3.46Å; Y323-F351 VanDerWaalsContact CD1-CD1 3.46Å; Y323-F351 HydrophobicContact CD1-CE1 4.02Å; Y323-F351 AromaticContact CD1-CG 3.74Å; Y323-F351 HydrophobicContact CD1-CG 3.74Å; Y323-F351 HydrophobicContact CD2-CB 3.57Å; Y323-F351 HydrophobicContact CD2-CD1 4.2Å; Y323-F351 AromaticContact CD2-CD2 3.83Å; Y323-F351 HydrophobicContact CD2-CD2 3.83Å; Y323-F351 AromaticContact CD2-CG 3.6Å; Y323-F351 HydrophobicContact CD2-CG 3.6Å; Y323-F351 HydrophobicContact CE1-CB 3.81Å; Y323-F351 AromaticContact CE1-CD1 3.92Å; Y323-F351 HydrophobicContact CE1-CD1 3.92Å; Y323-F351 HydrophobicContact CE1-CG 4.06Å; Y323-F351 HydrophobicContact CE2-CB 3.39Å; Y323-F351 AromaticContact CE2-CG 3.96Å; Y323-F351 HydrophobicContact CE2-CG 3.96Å; Y323-F351 HydrophobicContact CG-CB 3.88Å; Y323-F351 AromaticContact CG-CD1 3.6Å; Y323-F351 HydrophobicContact CG-CD1 3.6Å; Y323-F351 AromaticContact CG-CD2 3.83Å; Y323-F351 HydrophobicContact CG-CD2 3.83Å; Y323-F351 HydrophobicContact CG-CE1 4.04Å; Y323-F351 HydrophobicContact CG-CE2 4.24Å; Y323-F351 AromaticContact CG-CG 3.47Å; Y323-F351 HydrophobicContact CG-CG 3.47Å; Y323-F351 VanDerWaalsContact CG-CG 3.47Å; Y323-F351 HydrophobicContact CG-CZ 4.34Å; Y323-F351 VanDerWaalsContact CZ-CB 3.49Å; Y343-F351 AromaticContact CD2-CD1 3.9Å; Y343-F351 HydrophobicContact CD2-CD1 3.9Å; Y343-F351 HydrophobicContact CD2-CE1 4.4Å; Y343-F351 AromaticContact CE2-CD1 3.9Å; Y343-F351 HydrophobicContact CE2-CD1 3.9Å; Y343-F351 AromaticContact CE2-CE1 3.93Å; Y343-F351 HydrophobicContact CE2-CE1 3.93Å; F344-F351 WeakPolarHBondContact O-CA 3.44Å; R345-F351 HydrophobicContact CB-CD1 4.28Å; R345-F351 HydrophobicContact CB-CE1 4.22Å; R345-F351 HydrophobicContact CG-CD1 4.39Å; R345-F351 HydrophobicContact CG-CE1 4.13Å
352	Q	97.3	Very high	96.1	Very high	12 Å²	12	33 Å²	33	6%	0.056	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	119	172.7	-62.8	-178.1	-56.7	0	0	109.3	D193 V195 L267 A268 Y343 F344 R346	D193-Q352 HydrophobicContact CB-CG 3.94Å; V195-Q352 HydrophobicContact CG2-CB 4.09Å; V195-Q352 HydrophobicContact CG2-CG 4.24Å; L267-Q352 HydrophobicContact CD1-CB 4.42Å; L267-Q352 HydrophobicContact CD2-CB 4.16Å; A268-Q352 PolarHBondContact O-OE1 3.05Å; A268-Q352 VanDerWaalsContact O-OE1 3.13Å; Y343-Q352 CarbonylContact C-O 3.54Å; Y343-Q352 VanDerWaalsContact CA-O 3.25Å; Y343-Q352 WeakPolarHBondContact CA-O 3.45Å; Y343-Q352 VanDerWaalsContact CB-O 3.26Å; Y343-Q352 WeakPolarHBondContact CB-O 3.45Å; F344-Q352 HydrophobicContact CB-CB 4.22Å; F344-Q352 PolarHBondContact N-O 2.89Å; F344-Q352 PolarHBondContact O-N 2.83Å; R346-Q352 HydrophobicContact CG-CG 4.27Å
353	F	97.6	Very high	95.6	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.018	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	138.8	174.4	178.1	-101.7	0	0	0	111.1	M176 R177 L180 L267 Y323 L327 F331 E355 N356	M176-F353 HydrophobicContact CB-CE1 3.83Å; M176-F353 HydrophobicContact CB-CZ 4.23Å; M176-F353 HydrophobicContact SD-CE1 4.41Å; M176-F353 HydrophobicContact SD-CZ 4.43Å; R177-F353 VanDerWaalsContact CZ-O 3.28Å; R177-F353 PolarHBondContact NH1-O 2.81Å; R177-F353 PolarHBondContact NH2-O 2.84Å; L180-F353 HydrophobicContact CD1-CB 3.45Å; L180-F353 VanDerWaalsContact CD1-CB 3.45Å; L180-F353 HydrophobicContact CD1-CD1 3.26Å; L180-F353 HydrophobicContact CD1-CD2 3.65Å; L180-F353 HydrophobicContact CD1-CE1 3.78Å; L180-F353 HydrophobicContact CD1-CE2 4.11Å; L180-F353 HydrophobicContact CD1-CG 3.16Å; L180-F353 HydrophobicContact CD1-CZ 4.16Å; L267-F353 WeakPolarHBondContact CD1-O 3.45Å; Y323-F353 WeakPolarHBondContact OH-CA 3.3Å; Y323-F353 PolarHBondContact OH-N 2.88Å; L327-F353 HydrophobicContact CD1-CD2 4.24Å; L327-F353 HydrophobicContact CD2-CD2 3.68Å; L327-F353 HydrophobicContact CD2-CE2 4.24Å; F331-F353 HydrophobicContact CE2-CD2 4.45Å; F331-F353 AromaticContact CE2-CE2 3.76Å; F331-F353 HydrophobicContact CE2-CE2 3.76Å; F331-F353 AromaticContact CE2-CZ 3.86Å; F331-F353 HydrophobicContact CE2-CZ 3.86Å; F331-F353 HydrophobicContact CZ-CE1 4.22Å; F331-F353 HydrophobicContact CZ-CE2 4.08Å; F331-F353 AromaticContact CZ-CZ 3.67Å; F331-F353 HydrophobicContact CZ-CZ 3.67Å; F353-E355 WeakPolarHBondContact CE2-O 3.48Å; F353-E355 VanDerWaalsContact CZ-CA 3.45Å; F353-N356 HydrophobicContact CE2-CB 3.99Å; F353-N356 HydrophobicContact CZ-CB 3.9Å
354	L	96.4	Very high	95.4	Very high	31 Å²	31	33.6 Å²	33.6	16%	0.162	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	-63.9	172	175.9	65.9	0	0	0	110.9	L267 E342 F344	L267-L354 HydrophobicContact CD1-CB 3.94Å; L267-L354 HydrophobicContact CD1-CD1 3.78Å; L267-L354 HydrophobicContact CD1-CG 4.47Å; E342-L354 HydrophobicContact CB-CB 4.22Å; E342-L354 HydrophobicContact CB-CD2 3.95Å; E342-L354 HydrophobicContact CB-CG 4.47Å; E342-L354 WeakPolarHBondContact O-CB 3.45Å; E342-L354 PolarHBondContact O-N 3.19Å; F344-L354 HydrophobicContact CD2-CB 4.38Å; F344-L354 HydrophobicContact CE2-CB 4.3Å; F344-L354 HydrophobicContact CE2-CD1 4.28Å; F344-L354 HydrophobicContact CE2-CD2 4.03Å; F344-L354 HydrophobicContact CE2-CG 4.43Å
355	E	96.4	Very high	95.2	Very high	43 Å²	43	32.8 Å²	32.8	20%	0.201	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.9	168.9	179.8	65.2	-177.8	-164.3	0	0	111.3	K173 M176 E342 F353	K173-E355 WeakPolarHBondContact CE-OE2 3.5Å; M176-E355 HydrophobicContact SD-CB 4.16Å; E342-E355 HydrophobicContact CB-CG 4.29Å; E342-E355 HydrophobicContact CG-CG 4.5Å; E342-E355 PolarHBondContact N-O 3.22Å; E342-E355 PolarHBondContact O-N 3.38Å; F353-E355 WeakPolarHBondContact CE2-O 3.48Å; F353-E355 VanDerWaalsContact CZ-CA 3.45Å
356	N	97.3	Very high	95	Very high	4 Å²	4	30.9 Å²	30.9	2%	0.021	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	170	169.2	70.5	23.3	0	0	0	111.1	R169 F170 M176 F331 F339 T340 A341 F353	R169-N356 PolarHBondContact O-OD1 3.37Å; F170-N356 WeakPolarHBondContact CA-OD1 3.4Å; M176-N356 WeakPolarHBondContact CE-O 3.32Å; M176-N356 WeakPolarHBondContact CE-OD1 3.09Å; F331-N356 WeakPolarHBondContact CD1-ND2 3.38Å; F331-N356 VanDerWaalsContact CD2-ND2 3.32Å; F331-N356 WeakPolarHBondContact CD2-ND2 3.23Å; F331-N356 WeakPolarHBondContact CE1-ND2 3.26Å; F331-N356 WeakPolarHBondContact CE2-ND2 3.46Å; F331-N356 VanDerWaalsContact CG-ND2 3.26Å; F331-N356 WeakPolarHBondContact CG-ND2 3.43Å; F331-N356 WeakPolarHBondContact CZ-ND2 3.27Å; F339-N356 HydrophobicContact CE2-CB 3.64Å; F339-N356 HydrophobicContact CZ-CB 4.05Å; T340-N356 CarbonylContact O-C 3.57Å; T340-N356 WeakPolarHBondContact O-CA 3.47Å; T340-N356 VanDerWaalsContact O-CB 3.24Å; T340-N356 WeakPolarHBondContact O-CB 3.31Å; A341-N356 HydrophobicContact CB-CB 4.4Å; F353-N356 HydrophobicContact CE2-CB 3.99Å; F353-N356 HydrophobicContact CZ-CB 3.9Å
357	C	95.8	Very high	94.9	Very high	9 Å²	9	28.5 Å²	28.5	6%	0.061	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	157.5	169.3	64	0	0	0	0	111.4	T340 R359	T340-C357 PolarHBondContact N-O 2.91Å; T340-C357 PolarHBondContact O-N 2.84Å; C357-R359 HydrophobicContact CB-CG 4.1Å
358	I	96.2	Very high	94.9	Very high	15 Å²	15	22.1 Å²	22.1	8%	0.077	14%	0.14	C	C	.	.	S	Bend	trans	-115.3	59	178.2	51.5	170.7	0	0	0	111.4	V147 I167 F170 I334 P335 M338 F339	V147-I358 HydrophobicContact CG1-CD1 3.74Å; V147-I358 HydrophobicContact CG1-CG1 3.73Å; I167-I358 HydrophobicContact CD1-CD1 3.35Å; F170-I358 HydrophobicContact CB-CD1 3.92Å; F170-I358 HydrophobicContact CB-CG1 3.7Å; F170-I358 HydrophobicContact CB-CG2 4.27Å; F170-I358 HydrophobicContact CD1-CG2 3.56Å; F170-I358 HydrophobicContact CD2-CD1 3.65Å; F170-I358 HydrophobicContact CD2-CG1 4.28Å; F170-I358 HydrophobicContact CD2-CG2 4.34Å; F170-I358 HydrophobicContact CE1-CG2 3.83Å; F170-I358 HydrophobicContact CE2-CD1 4.29Å; F170-I358 HydrophobicContact CG-CD1 3.85Å; F170-I358 HydrophobicContact CG-CG1 3.95Å; F170-I358 HydrophobicContact CG-CG2 3.81Å; F170-I358 HydrophobicContact CZ-CG2 4.34Å; I334-I358 HydrophobicContact CG2-CG2 4.07Å; P335-I358 HydrophobicContact CG-CD1 3.96Å; M338-I358 CarbonylContact O-C 3.58Å; M338-I358 VanDerWaalsContact O-CA 3.23Å; M338-I358 WeakPolarHBondContact O-CA 3.48Å; F339-I358 HydrophobicContact CD2-CG2 3.86Å
359	R	94.2	Very high	94.8	Very high	44 Å²	44	17.6 Å²	17.6	17%	0.166	12%	0.116	C	C	.	.	S	Bend	trans	-141.7	169.3	179.7	60.8	135.5	171.8	74.1	13.6	110.5	E144 V147 M338 C357	E144-R359 HydrophobicContact CB-CG 4.24Å; E144-R359 HydrophobicContact CG-CG 4.22Å; E144-R359 IonicContact OE2-CZ 3.7Å; E144-R359 IonicContact OE2-NE 3.92Å; E144-R359 PolarHBondContact OE2-NE 3.02Å; E144-R359 IonicContact OE2-NH2 3.57Å; E144-R359 PolarHBondContact OE2-NH2 3Å; V147-R359 HydrophobicContact CG2-CB 4.26Å; M338-R359 WeakPolarHBondContact CB-O 3.34Å; C357-R359 HydrophobicContact CB-CG 4.1Å
360	L	94.4	Very high	94.6	Very high	10 Å²	10	19.3 Å²	19.3	5%	0.052	12%	0.117	C	C	.	.			trans	-57.3	136.7	171.5	-160	70.2	0	0	0	110.4	S142 M338 V366 L377 E378 H381	S142-L360 PolarHBondContact O-N 3.24Å; M338-L360 HydrophobicContact CG-CD1 4.28Å; L360-V366 HydrophobicContact CD1-CG2 3.96Å; L360-V366 HydrophobicContact CD2-CG2 3.77Å; L360-V366 HydrophobicContact CG-CG2 3.65Å; L360-L377 HydrophobicContact CD1-CB 4.44Å; L360-E378 HydrophobicContact CD1-CB 4.19Å; L360-E378 HydrophobicContact CD2-CB 3.9Å; L360-E378 HydrophobicContact CD2-CG 3.75Å; L360-H381 HydrophobicContact CD1-CB 4.04Å; L360-H381 PolarHBondContact N-NE2 2.81Å
361	P	92.6	Very high	94.4	Very high	6 Å²	6	20.6 Å²	20.6	4%	0.039	12%	0.123	C	C	.	.			trans	-63.3	144.7	176.7	25.4	-34.3	0	0	0	111.4	Y275 M338 L365 V366	Y275-P361 HydrophobicContact CD1-CB 3.72Å; Y275-P361 HydrophobicContact CD1-CG 4.27Å; Y275-P361 HydrophobicContact CE1-CB 3.57Å; M338-P361 HydrophobicContact CE-CG 4.26Å; P361-L365 HydrophobicContact CB-CB 4.31Å; P361-L365 HydrophobicContact CB-CD2 3.7Å; P361-L365 HydrophobicContact CB-CG 4.46Å; P361-L365 HydrophobicContact CG-CB 4.31Å; P361-L365 HydrophobicContact CG-CD2 3.73Å; P361-L365 HydrophobicContact CG-CG 4.2Å; P361-V366 HydrophobicContact CG-CG2 4.08Å
362	G	89	Confident	94.2	Very high	41 Å²	41	20.8 Å²	20.8	42%	0.423	13%	0.126	S	C	.	.			trans	-79.9	-179.5	172.3	0	0	0	0	0	112.8
363	G	87.7	Confident	93.9	Very high	37 Å²	37	21.2 Å²	21.2	38%	0.381	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	-154.7	178.4	0	0	0	0	0	112.5	L365	G363-L365 VanDerWaalsContact C-N 3.31Å
364	P	93.6	Very high	93.5	Very high	5 Å²	5	31.8 Å²	31.8	3%	0.032	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	3.1	-176.7	35.4	-34.6	0	0	0	113.8	V366 T367 L368 Y402 L454	P364-V366 VanDerWaalsContact C-N 3.32Å; P364-V366 PolarHBondContact O-N 3.1Å; P364-T367 PolarHBondContact O-N 2.95Å; P364-T367 VanDerWaalsContact O-N 3.14Å; P364-L368 WeakPolarHBondContact O-CB 3Å; P364-L368 PolarHBondContact O-N 3.34Å; P364-Y402 HydrophobicContact CG-CD1 4.21Å; P364-Y402 HydrophobicContact CG-CD2 3.54Å; P364-Y402 HydrophobicContact CG-CE2 4.01Å; P364-Y402 HydrophobicContact CG-CG 3.64Å; P364-L454 HydrophobicContact CB-CD2 3.45Å; P364-L454 VanDerWaalsContact CB-CD2 3.45Å; P364-L454 HydrophobicContact CG-CD2 3.73Å
365	L	94.6	Very high	93.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-60	-40	-168.6	-177.7	62.5	0	0	0	113.2	Y275 Y289 P361 G363 T367 L368 V369	Y275-L365 HydrophobicContact CD1-CD2 3.32Å; Y275-L365 HydrophobicContact CD2-CD2 3.39Å; Y275-L365 HydrophobicContact CE1-CD2 3.39Å; Y275-L365 HydrophobicContact CE2-CD2 3.46Å; Y275-L365 VanDerWaalsContact CE2-CD2 3.46Å; Y275-L365 HydrophobicContact CG-CD2 3.31Å; Y275-L365 VanDerWaalsContact CZ-CD2 3.45Å; Y289-L365 HydrophobicContact CE2-CD1 3.78Å; Y289-L365 WeakPolarHBondContact OH-CD1 3.47Å; P361-L365 HydrophobicContact CB-CB 4.31Å; P361-L365 HydrophobicContact CB-CD2 3.7Å; P361-L365 HydrophobicContact CB-CG 4.46Å; P361-L365 HydrophobicContact CG-CB 4.31Å; P361-L365 HydrophobicContact CG-CD2 3.73Å; P361-L365 HydrophobicContact CG-CG 4.2Å; G363-L365 VanDerWaalsContact C-N 3.31Å; L365-T367 PolarHBondContact O-N 3.3Å; L365-L368 HydrophobicContact CD1-CD2 4.27Å; L365-L368 PolarHBondContact O-N 3.27Å; L365-V369 HydrophobicContact CD1-CG2 3.91Å; L365-V369 HydrophobicContact CG-CG2 4.32Å; L365-V369 WeakPolarHBondContact O-CG2 3.31Å; L365-V369 PolarHBondContact O-N 3.31Å
366	V	94.1	Very high	92.9	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.006	16%	0.16	C	C	.	.	H	α-helix	trans	-60.5	-47.9	177.9	178.3	0	0	0	0	110.6	T56 T57 L360 P361 P364 Q370 L377 E378	T56-V366 HydrophobicContact CG2-CB 3.93Å; T56-V366 HydrophobicContact CG2-CG1 4Å; T57-V366 HydrophobicContact CG2-CG1 3.68Å; L360-V366 HydrophobicContact CD1-CG2 3.96Å; L360-V366 HydrophobicContact CD2-CG2 3.77Å; L360-V366 HydrophobicContact CG-CG2 3.65Å; P361-V366 HydrophobicContact CG-CG2 4.08Å; P364-V366 VanDerWaalsContact C-N 3.32Å; P364-V366 PolarHBondContact O-N 3.1Å; V366-Q370 WeakPolarHBondContact O-CB 3.37Å; V366-Q370 PolarHBondContact O-N 3.32Å; V366-L377 HydrophobicContact CG1-CB 4.38Å; V366-E378 HydrophobicContact CG1-CB 4.43Å
367	T	93.6	Very high	92.7	Very high	45 Å²	45	30 Å²	30	28%	0.276	16%	0.159	S	C	.	.	H	α-helix	trans	-64	-41.7	175.9	-52.4	0	0	0	0	111.7	P364 L365 Q370 L371 L454	P364-T367 PolarHBondContact O-N 2.95Å; P364-T367 VanDerWaalsContact O-N 3.14Å; L365-T367 PolarHBondContact O-N 3.3Å; T367-Q370 PolarHBondContact O-N 3.1Å; T367-L371 HydrophobicContact CG2-CD1 4.1Å; T367-L371 HydrophobicContact CG2-CG 4.46Å; T367-L371 WeakPolarHBondContact O-CG 3.39Å; T367-L371 PolarHBondContact O-N 3.2Å; T367-L454 HydrophobicContact CG2-CD1 4.38Å
368	L	95.2	Very high	92.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.7	-47.5	-180	-176.2	65.8	0	0	0	111.4	Y289 P364 L365 Q370 L371 A372 T400 Y402 L454 L456	Y289-L368 HydrophobicContact CE1-CD2 4.36Å; P364-L368 WeakPolarHBondContact O-CB 3Å; P364-L368 PolarHBondContact O-N 3.34Å; L365-L368 HydrophobicContact CD1-CD2 4.27Å; L365-L368 PolarHBondContact O-N 3.27Å; L368-Q370 VanDerWaalsContact C-N 3.34Å; L368-L371 PolarHBondContact O-N 3.43Å; L368-A372 VanDerWaalsContact O-CB 3.3Å; L368-A372 WeakPolarHBondContact O-CB 3.46Å; L368-A372 PolarHBondContact O-N 3.33Å; L368-T400 HydrophobicContact CD1-CG2 4.08Å; L368-T400 HydrophobicContact CD2-CG2 4.43Å; L368-T400 HydrophobicContact CG-CG2 3.95Å; L368-Y402 HydrophobicContact CD2-CD1 3.83Å; L368-Y402 HydrophobicContact CD2-CG 4.5Å; L368-L454 HydrophobicContact CD1-CB 3.81Å; L368-L454 HydrophobicContact CD1-CD1 4.39Å; L368-L454 HydrophobicContact CD1-CD2 4.34Å; L368-L454 HydrophobicContact CD1-CG 4.39Å; L368-L456 HydrophobicContact CD1-CD1 4.08Å; L368-L456 HydrophobicContact CD1-CG 4.31Å
369	V	93.3	Very high	92.6	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	16%	0.156	C	C	.	.	H	α-helix	trans	-67.9	-35.6	177.7	173.7	0	0	0	0	111.2	W285 L365 L371 A372 E373 M375 L377	W285-V369 HydrophobicContact CH2-CG2 3.95Å; W285-V369 HydrophobicContact CZ2-CB 4.5Å; W285-V369 HydrophobicContact CZ2-CG1 3.86Å; W285-V369 HydrophobicContact CZ2-CG2 3.76Å; L365-V369 HydrophobicContact CD1-CG2 3.91Å; L365-V369 HydrophobicContact CG-CG2 4.32Å; L365-V369 WeakPolarHBondContact O-CG2 3.31Å; L365-V369 PolarHBondContact O-N 3.31Å; V369-L371 VanDerWaalsContact C-N 3.34Å; V369-L371 PolarHBondContact O-N 3.18Å; V369-A372 PolarHBondContact O-N 2.73Å; V369-E373 HydrophobicContact CG1-CB 4.39Å; V369-E373 WeakPolarHBondContact O-CA 3.46Å; V369-E373 WeakPolarHBondContact O-CB 3.41Å; V369-E373 PolarHBondContact O-N 2.63Å; V369-M375 HydrophobicContact CG1-CB 4.26Å; V369-M375 HydrophobicContact CG1-CE 3.57Å; V369-L377 HydrophobicContact CB-CD1 3.68Å; V369-L377 HydrophobicContact CB-CG 4.14Å; V369-L377 HydrophobicContact CG1-CD1 3.75Å; V369-L377 HydrophobicContact CG1-CD2 4.38Å; V369-L377 HydrophobicContact CG1-CG 3.75Å; V369-L377 HydrophobicContact CG2-CD1 3.76Å
370	Q	91.8	Very high	92.5	Very high	61 Å²	61	27.4 Å²	27.4	29%	0.285	15%	0.149	S	C	.	.	H	α-helix	trans	-63.5	-39.5	172.8	-170.5	172.8	8.7	0	0	112	V366 T367 L368 R374 M375	V366-Q370 WeakPolarHBondContact O-CB 3.37Å; V366-Q370 PolarHBondContact O-N 3.32Å; T367-Q370 PolarHBondContact O-N 3.1Å; L368-Q370 VanDerWaalsContact C-N 3.34Å; Q370-R374 WeakPolarHBondContact O-CA 3.46Å; Q370-R374 PolarHBondContact O-N 3.15Å; Q370-M375 WeakPolarHBondContact CA-O 3.25Å
371	L	92.7	Very high	92.5	Very high	58 Å²	58	27.6 Å²	27.6	30%	0.304	15%	0.15	S	C	.	.	H	α-helix	trans	-72.7	-37	177.3	-71	171	0	0	0	113.3	T367 L368 V369 R425 Y427 L454 L456	T367-L371 HydrophobicContact CG2-CD1 4.1Å; T367-L371 HydrophobicContact CG2-CG 4.46Å; T367-L371 WeakPolarHBondContact O-CG 3.39Å; T367-L371 PolarHBondContact O-N 3.2Å; L368-L371 PolarHBondContact O-N 3.43Å; V369-L371 VanDerWaalsContact C-N 3.34Å; V369-L371 PolarHBondContact O-N 3.18Å; L371-R425 PolarHBondContact O-NH2 3.07Å; L371-Y427 HydrophobicContact CD1-CD1 4.34Å; L371-Y427 HydrophobicContact CD1-CD2 3.99Å; L371-Y427 HydrophobicContact CD1-CE1 4.44Å; L371-Y427 HydrophobicContact CD1-CE2 4.09Å; L371-Y427 HydrophobicContact CD1-CG 4.11Å; L371-Y427 HydrophobicContact CD2-CE1 4.28Å; L371-L454 HydrophobicContact CD1-CD1 3.86Å; L371-L456 HydrophobicContact CB-CD2 3.88Å
372	A	93.7	Very high	92.6	Very high	10 Å²	10	27.3 Å²	27.3	8%	0.083	15%	0.148	C	C	.	.	H	α-helix	trans	-81.4	-43	-176.7	0	0	0	0	0	112.6	L368 V369 V398 T400 L456	L368-A372 VanDerWaalsContact O-CB 3.3Å; L368-A372 WeakPolarHBondContact O-CB 3.46Å; L368-A372 PolarHBondContact O-N 3.33Å; V369-A372 PolarHBondContact O-N 2.73Å; A372-V398 HydrophobicContact CB-CB 4.11Å; A372-V398 HydrophobicContact CB-CG1 4.1Å; A372-T400 HydrophobicContact CB-CG2 3.42Å; A372-T400 VanDerWaalsContact CB-CG2 3.42Å; A372-L456 HydrophobicContact CB-CD2 3.8Å
373	E	90.9	Very high	92.7	Very high	21 Å²	21	25.4 Å²	25.4	10%	0.098	13%	0.128	C	C	.	.	H	α-helix	trans	-119.5	-3.5	-167.8	-56.9	-177.9	-156	0	0	113.3	W285 R287 V369 M375	W285-E373 PolarHBondContact NE1-OE1 3.13Å; W285-E373 PolarHBondContact NE1-OE2 2.95Å; R287-E373 IonicContact CZ-OE1 3.11Å; R287-E373 IonicContact CZ-OE2 3.96Å; R287-E373 IonicContact NE-OE1 3.53Å; R287-E373 PolarHBondContact NE-OE1 2.84Å; R287-E373 IonicContact NH2-OE1 2.69Å; R287-E373 PolarHBondContact NH2-OE1 2.87Å; R287-E373 IonicContact NH2-OE2 3.17Å; R287-E373 PolarHBondContact NH2-OE2 2.9Å; R287-E373 VanDerWaalsContact NH2-OE2 3.17Å; V369-E373 HydrophobicContact CG1-CB 4.39Å; V369-E373 WeakPolarHBondContact O-CA 3.46Å; V369-E373 WeakPolarHBondContact O-CB 3.41Å; V369-E373 PolarHBondContact O-N 2.63Å; E373-M375 HydrophobicContact CB-CB 4.35Å; E373-M375 PolarHBondContact O-N 3.36Å; E373-M375 VanDerWaalsContact O-N 3.12Å
374	R	89.6	Confident	92.3	Very high	226 Å²	226	23.7 Å²	23.7	85%	0.853	11%	0.111	S	C	*	.			trans	57.9	21	-173.4	-53.5	-179	179.5	-178.5	0.1	113.3	Q370	Q370-R374 WeakPolarHBondContact O-CA 3.46Å; Q370-R374 PolarHBondContact O-N 3.15Å
375	M	89.2	Confident	91.2	Very high	20 Å²	20	26.1 Å²	26.1	10%	0.099	12%	0.122	C	C	.	.			trans	-95.3	125.2	177.8	-178.3	173.3	56	0	0	110.5	W285 V369 Q370 E373 L377 T391	W285-M375 HydrophobicContact CD2-CE 3.72Å; W285-M375 VanDerWaalsContact CE2-CE 3.46Å; W285-M375 HydrophobicContact CE3-CE 4.48Å; W285-M375 HydrophobicContact CG-CE 3.78Å; W285-M375 HydrophobicContact CZ2-CE 4Å; V369-M375 HydrophobicContact CG1-CB 4.26Å; V369-M375 HydrophobicContact CG1-CE 3.57Å; Q370-M375 WeakPolarHBondContact CA-O 3.25Å; E373-M375 HydrophobicContact CB-CB 4.35Å; E373-M375 PolarHBondContact O-N 3.36Å; E373-M375 VanDerWaalsContact O-N 3.12Å; M375-L377 HydrophobicContact CE-CD2 3.35Å; M375-L377 HydrophobicContact CE-CG 3.99Å; M375-L377 PolarHBondContact O-N 3.1Å; M375-L377 HydrophobicContact SD-CD2 4.14Å; M375-T391 HydrophobicContact SD-CG2 4.19Å
376	N	92.3	Very high	90.2	Very high	19 Å²	19	27.8 Å²	27.8	10%	0.102	13%	0.128	C	C	.	.			trans	-83.1	91.5	170.4	-171.7	-27	0	0	0	110	T57 E378 V379 A380	T57-N376 WeakPolarHBondContact CB-ND2 3.48Å; T57-N376 WeakPolarHBondContact CG2-OD1 3.23Å; T57-N376 PolarHBondContact OG1-ND2 3.19Å; T57-N376 PolarHBondContact OG1-OD1 3.22Å; N376-E378 PolarHBondContact O-N 2.83Å; N376-E378 PolarHBondContact OD1-N 3.23Å; N376-E378 VanDerWaalsContact OD1-N 3.1Å; N376-V379 HydrophobicContact CB-CB 4.06Å; N376-V379 HydrophobicContact CB-CG2 4.19Å; N376-V379 VanDerWaalsContact CG-CG2 3.49Å; N376-V379 WeakPolarHBondContact ND2-CG2 3.46Å; N376-V379 PolarHBondContact O-N 3.42Å; N376-V379 PolarHBondContact OD1-N 3.23Å; N376-A380 PolarHBondContact O-N 3.01Å
377	L	92.7	Very high	88.7	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.5	-29.8	178.8	-80.3	-178.7	0	0	0	113.5	W285 M338 L360 V366 V369 M375 H381	W285-L377 HydrophobicContact CE3-CD2 4.3Å; W285-L377 HydrophobicContact CH2-CD1 4.02Å; W285-L377 HydrophobicContact CH2-CD2 4.35Å; W285-L377 HydrophobicContact CZ3-CD1 4.4Å; W285-L377 HydrophobicContact CZ3-CD2 4.18Å; M338-L377 HydrophobicContact SD-CD2 3.97Å; L360-L377 HydrophobicContact CD1-CB 4.44Å; V366-L377 HydrophobicContact CG1-CB 4.38Å; V369-L377 HydrophobicContact CB-CD1 3.68Å; V369-L377 HydrophobicContact CB-CG 4.14Å; V369-L377 HydrophobicContact CG1-CD1 3.75Å; V369-L377 HydrophobicContact CG1-CD2 4.38Å; V369-L377 HydrophobicContact CG1-CG 3.75Å; V369-L377 HydrophobicContact CG2-CD1 3.76Å; M375-L377 HydrophobicContact CE-CD2 3.35Å; M375-L377 HydrophobicContact CE-CG 3.99Å; M375-L377 PolarHBondContact O-N 3.1Å; M375-L377 HydrophobicContact SD-CD2 4.14Å; L377-H381 VanDerWaalsContact O-CB 3.28Å; L377-H381 WeakPolarHBondContact O-CB 3.43Å; L377-H381 PolarHBondContact O-N 2.64Å
378	E	94.7	Very high	86.9	Confident	1 Å²	1	32 Å²	32	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-70.5	-42.2	178.1	-170	167	-144.6	0	0	111	K50 F55 T56 T57 L59 L360 V366 N376 H381 L382	K50-E378 IonicContact NZ-OE1 3.37Å; K50-E378 PolarHBondContact NZ-OE1 2.97Å; F55-E378 WeakPolarHBondContact CA-OE1 3.19Å; F55-E378 HydrophobicContact CD1-CG 4.33Å; F55-E378 VanDerWaalsContact CD1-OE1 3.29Å; F55-E378 WeakPolarHBondContact CD1-OE1 3.21Å; T56-E378 PolarHBondContact N-OE1 3.08Å; T56-E378 PolarHBondContact N-OE2 2.83Å; T57-E378 HydrophobicContact CG2-CB 4.17Å; T57-E378 PolarHBondContact N-OE2 3.4Å; T57-E378 PolarHBondContact OG1-OE2 2.96Å; L59-E378 HydrophobicContact CD2-CG 3.96Å; L360-E378 HydrophobicContact CD1-CB 4.19Å; L360-E378 HydrophobicContact CD2-CB 3.9Å; L360-E378 HydrophobicContact CD2-CG 3.75Å; V366-E378 HydrophobicContact CG1-CB 4.43Å; N376-E378 PolarHBondContact O-N 2.83Å; N376-E378 PolarHBondContact OD1-N 3.23Å; N376-E378 VanDerWaalsContact OD1-N 3.1Å; E378-H381 PolarHBondContact O-N 2.85Å; E378-L382 HydrophobicContact CG-CD1 4.04Å; E378-L382 WeakPolarHBondContact O-CB 3.47Å; E378-L382 WeakPolarHBondContact O-CG 3.27Å; E378-L382 PolarHBondContact O-N 3.14Å
379	V	94.3	Very high	85	Confident	10 Å²	10	32.8 Å²	32.8	6%	0.061	15%	0.152	C	C	.	.	H	α-helix	trans	-64	-46.9	172.6	169	0	0	0	0	111	L59 L62 A65 N376 H381 L382 S383	L59-V379 HydrophobicContact CB-CG2 4.34Å; L59-V379 HydrophobicContact CD2-CG2 4.21Å; L62-V379 HydrophobicContact CB-CG1 4.49Å; L62-V379 HydrophobicContact CB-CG2 4.2Å; L62-V379 HydrophobicContact CD1-CG1 4.39Å; A65-V379 HydrophobicContact CB-CG1 3.72Å; N376-V379 HydrophobicContact CB-CB 4.06Å; N376-V379 HydrophobicContact CB-CG2 4.19Å; N376-V379 VanDerWaalsContact CG-CG2 3.49Å; N376-V379 WeakPolarHBondContact ND2-CG2 3.46Å; N376-V379 PolarHBondContact O-N 3.42Å; N376-V379 PolarHBondContact OD1-N 3.23Å; V379-H381 VanDerWaalsContact C-N 3.3Å; V379-H381 PolarHBondContact O-N 3.14Å; V379-L382 PolarHBondContact O-N 3.38Å; V379-S383 WeakPolarHBondContact O-CB 3.43Å; V379-S383 PolarHBondContact O-N 3.09Å; V379-S383 PolarHBondContact O-OG 2.9Å
380	A	93	Very high	82.9	Confident	3 Å²	3	36.5 Å²	36.5	3%	0.025	18%	0.183	C	C	.	.	H	α-helix	trans	-56.2	-43.5	176.6	0	0	0	0	0	112.1	L277 N376 G384 P389	L277-A380 HydrophobicContact CD1-CB 4.1Å; L277-A380 HydrophobicContact CD2-CB 3.96Å; N376-A380 PolarHBondContact O-N 3.01Å; A380-G384 WeakPolarHBondContact O-CA 3.45Å; A380-G384 PolarHBondContact O-N 2.85Å; A380-G384 VanDerWaalsContact O-N 3.11Å; A380-P389 HydrophobicContact CB-CB 4.16Å; A380-P389 HydrophobicContact CB-CG 3.79Å
381	H	94.5	Very high	81	Confident	15 Å²	15	36 Å²	36	7%	0.069	18%	0.184	C	C	.	.	H	α-helix	trans	-64.7	-46.3	177.3	179.6	33.7	0	0	0	112.9	V141 M338 L360 L377 E378 V379	V141-H381 PolarHBondContact O-NE2 2.59Å; M338-H381 HydrophobicContact CG-CB 3.91Å; M338-H381 PolarHBondContact N-ND1 2.89Å; L360-H381 HydrophobicContact CD1-CB 4.04Å; L360-H381 PolarHBondContact N-NE2 2.81Å; L377-H381 VanDerWaalsContact O-CB 3.28Å; L377-H381 WeakPolarHBondContact O-CB 3.43Å; L377-H381 PolarHBondContact O-N 2.64Å; E378-H381 PolarHBondContact O-N 2.85Å; V379-H381 VanDerWaalsContact C-N 3.3Å; V379-H381 PolarHBondContact O-N 3.14Å
382	L	94	Very high	79	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-74.1	-35.9	-175	-67.2	171.9	0	0	0	112.4	L46 V48 F55 L59 L62 V140 E378 V379	L46-L382 WeakPolarHBondContact CD1-O 3.27Å; L46-L382 WeakPolarHBondContact CD2-O 3.38Å; V48-L382 HydrophobicContact CG1-CD1 4.35Å; V48-L382 HydrophobicContact CG1-CD2 3.88Å; V48-L382 HydrophobicContact CG2-CD2 4.33Å; F55-L382 HydrophobicContact CD1-CD1 4.32Å; F55-L382 HydrophobicContact CE1-CD1 3.82Å; L59-L382 HydrophobicContact CD2-CD1 4.09Å; L62-L382 HydrophobicContact CD1-CB 4.29Å; V140-L382 HydrophobicContact CG2-CB 4.48Å; V140-L382 HydrophobicContact CG2-CD2 3.78Å; E378-L382 HydrophobicContact CG-CD1 4.04Å; E378-L382 WeakPolarHBondContact O-CB 3.47Å; E378-L382 WeakPolarHBondContact O-CG 3.27Å; E378-L382 PolarHBondContact O-N 3.14Å; V379-L382 PolarHBondContact O-N 3.38Å
383	S	90.4	Very high	77.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-87	-6.1	179.8	62	0	0	0	0	113.9	A65 V379 Q385 Y386 F387	A65-S383 WeakPolarHBondContact CB-OG 3.31Å; V379-S383 WeakPolarHBondContact O-CB 3.43Å; V379-S383 PolarHBondContact O-N 3.09Å; V379-S383 PolarHBondContact O-OG 2.9Å; S383-Q385 PolarHBondContact O-N 2.71Å; S383-Y386 PolarHBondContact O-N 3.24Å; S383-F387 PolarHBondContact O-N 3.03Å
384	G	81	Confident	75.6	Confident	2 Å²	2	48.6 Å²	48.6	2%	0.021	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-15.6	-172.7	0	0	0	0	0	115.5	F279 D336 A380	F279-G384 WeakPolarHBondContact CD2-O 3.31Å; F279-G384 WeakPolarHBondContact CE2-O 3.5Å; D336-G384 WeakPolarHBondContact CB-O 3.4Å; A380-G384 WeakPolarHBondContact O-CA 3.45Å; A380-G384 PolarHBondContact O-N 2.85Å; A380-G384 VanDerWaalsContact O-N 3.11Å
385	Q	70.4	Confident	74.3	Confident	56 Å²	56	45.4 Å²	45.4	26%	0.262	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-11.8	174.7	-63.8	-175.9	2.4	0	0	114.1	S138 V140 D336 S383	S138-Q385 PolarHBondContact OG-OE1 2.84Å; V140-Q385 HydrophobicContact CG1-CG 4.47Å; D336-Q385 HydrophobicContact CB-CG 4.49Å; S383-Q385 PolarHBondContact O-N 2.71Å
386	Y	73.1	Confident	73.6	Confident	35 Å²	35	50.1 Å²	50.1	14%	0.137	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-33.4	-174.1	-69.1	-64.4	0	0	0	113.2	R44 C45 L46 T70 S138 S383	R44-Y386 HydrophobicContact CB-CE1 3.84Å; R44-Y386 HydrophobicContact CG-CE1 4.38Å; C45-Y386 VanDerWaalsContact C-OH 3.31Å; C45-Y386 PolarHBondContact O-OH 3.37Å; L46-Y386 HydrophobicContact CB-CD2 4.23Å; L46-Y386 HydrophobicContact CB-CE2 3.6Å; L46-Y386 HydrophobicContact CD1-CD2 4.06Å; L46-Y386 HydrophobicContact CD1-CE2 3.6Å; L46-Y386 HydrophobicContact CG-CE2 4.13Å; T70-Y386 HydrophobicContact CG2-CD1 4.38Å; T70-Y386 HydrophobicContact CG2-CD2 3.96Å; T70-Y386 HydrophobicContact CG2-CE1 4.26Å; T70-Y386 HydrophobicContact CG2-CE2 3.8Å; T70-Y386 HydrophobicContact CG2-CG 4.23Å; S138-Y386 WeakPolarHBondContact CB-OH 3.18Å; S138-Y386 PolarHBondContact N-OH 3.24Å; S138-Y386 PolarHBondContact OG-OH 3.21Å; S383-Y386 PolarHBondContact O-N 3.24Å
387	F	62.6	Low	73.2	Confident	98 Å²	98	53.2 Å²	53.2	43%	0.43	29%	0.291	S	S	.	.			trans	-149.1	139.3	-175.2	-163.7	-113.5	0	0	0	109.9	A65 F279 S383 P389 A390	A65-F387 WeakPolarHBondContact O-CB 3.11Å; F279-F387 WeakPolarHBondContact CE2-O 3.07Å; S383-F387 PolarHBondContact O-N 3.03Å; F387-P389 WeakPolarHBondContact O-CD 3.39Å; F387-A390 HydrophobicContact CE1-CB 4.46Å
388	S	55.2	Low	73.3	Confident	35 Å²	35	54.4 Å²	54.4	25%	0.245	30%	0.298	C	S	.	.			trans	-66.2	117.6	160.6	-179	0	0	0	0	104.7	F279 A390	F279-S388 VanDerWaalsContact CE2-N 3.31Å; S388-A390 PolarHBondContact O-N 3.1Å
389	P	56.2	Low	73.4	Confident	18 Å²	18	54.6 Å²	54.6	12%	0.117	30%	0.299	C	S	.	.			trans	-51.1	123.1	167.8	20.2	-27.1	0	0	0	105.7	L277 A380 F387 T391	L277-P389 HydrophobicContact CD2-CG 3.48Å; L277-P389 VanDerWaalsContact CD2-CG 3.48Å; A380-P389 HydrophobicContact CB-CB 4.16Å; A380-P389 HydrophobicContact CB-CG 3.79Å; F387-P389 WeakPolarHBondContact O-CD 3.39Å; P389-T391 PolarHBondContact O-N 3.21Å
390	A	48	Very low	73.6	Confident	78 Å²	78	54.1 Å²	54.1	65%	0.645	30%	0.296	S	S	*	.			trans	-59.4	97.5	166.1	0	0	0	0	0	103.3	F387 S388 T392	F387-A390 HydrophobicContact CE1-CB 4.46Å; S388-A390 PolarHBondContact O-N 3.1Å; A390-T392 PolarHBondContact O-N 3.21Å
391	T	53.3	Low	73.9	Confident	52 Å²	52	54 Å²	54	32%	0.319	30%	0.295	S	S	.	.			trans	-62.2	98.1	170.1	35.7	0	0	0	0	102.8	M375 P389 K393	M375-T391 HydrophobicContact SD-CG2 4.19Å; P389-T391 PolarHBondContact O-N 3.21Å; T391-K393 PolarHBondContact O-N 2.99Å
392	T	51.1	Low	74.1	Confident	106 Å²	106	53.6 Å²	53.6	65%	0.65	29%	0.293	S	S	*	.			trans	-58.5	103.1	166	44.3	0	0	0	0	103.5	A390 A394	A390-T392 PolarHBondContact O-N 3.21Å; T392-A394 VanDerWaalsContact C-N 3.31Å; T392-A394 PolarHBondContact O-N 2.9Å
393	K	53.7	Low	74.3	Confident	195 Å²	195	53.6 Å²	53.6	85%	0.848	29%	0.293	S	S	*	.			trans	-55.2	105.7	174.4	-78.3	-174.1	177	-178.5	0	104.8	T391 T395	T391-K393 PolarHBondContact O-N 2.99Å; K393-T395 PolarHBondContact O-N 3.4Å
394	A	58.1	Low	74.6	Confident	52 Å²	52	54.5 Å²	54.5	43%	0.43	30%	0.297	S	S	.	.			trans	-53.9	133	172.5	0	0	0	0	0	106.7	T392 E396	T392-A394 VanDerWaalsContact C-N 3.31Å; T392-A394 PolarHBondContact O-N 2.9Å; A394-E396 PolarHBondContact O-N 3.07Å
395	T	61.9	Low	75.4	Confident	159 Å²	159	54.7 Å²	54.7	98%	0.975	30%	0.297	S	S	*	.	S	Bend	trans	-64.2	-23.3	-178.1	48.4	0	0	0	0	111.7	K393	K393-T395 PolarHBondContact O-N 3.4Å
396	E	74.3	Confident	76.7	Confident	118 Å²	118	52.2 Å²	52.2	55%	0.551	29%	0.285	S	S	*	.	S	Bend	trans	-133.7	133	177.1	-169.3	174.6	-164.7	0	0	109.7	A394 V398 T458	A394-E396 PolarHBondContact O-N 3.07Å; E396-V398 PolarHBondContact O-N 2.89Å; E396-T458 HydrophobicContact CG-CG2 3.89Å; E396-T458 WeakPolarHBondContact OE1-CG2 3.19Å
397	R	85.7	Confident	77.8	Confident	84 Å²	84	50.7 Å²	50.7	32%	0.317	28%	0.28	S	S	.	.			trans	-79.1	113.4	176.4	-178.3	-179.6	178.6	-178.3	-3.2	109	E309 L310 L399	E309-R397 IonicContact OE1-CZ 3.69Å; E309-R397 IonicContact OE1-NE 3.61Å; E309-R397 IonicContact OE1-NH2 2.85Å; E309-R397 PolarHBondContact OE1-NH2 3.25Å; L310-R397 PolarHBondContact O-NH2 3.48Å; R397-L399 HydrophobicContact CG-CD2 4.37Å
398	V	94.8	Very high	79.4	Confident	25 Å²	25	50.1 Å²	50.1	15%	0.152	28%	0.275	C	S	.	.			trans	-93.4	115.6	171	-178.1	0	0	0	0	108.6	A372 E396 L456 T458	A372-V398 HydrophobicContact CB-CB 4.11Å; A372-V398 HydrophobicContact CB-CG1 4.1Å; E396-V398 PolarHBondContact O-N 2.89Å; V398-L456 HydrophobicContact CG1-CB 3.77Å; V398-L456 HydrophobicContact CG1-CD2 4.16Å; V398-L456 HydrophobicContact CG1-CG 4.34Å; V398-T458 HydrophobicContact CG2-CG2 4.13Å
399	L	97	Very high	81.4	Confident	5 Å²	5	55.9 Å²	55.9	3%	0.026	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	151.1	174.9	-59.1	169	0	0	0	110.1	E309 C311 R397 L456 N457 Y460 L463	E309-L399 WeakPolarHBondContact OE1-CD2 3.25Å; C311-L399 HydrophobicContact CB-CD1 4.26Å; C311-L399 HydrophobicContact CB-CD2 3.53Å; R397-L399 HydrophobicContact CG-CD2 4.37Å; L399-L456 WeakPolarHBondContact O-CA 3.45Å; L399-N457 WeakPolarHBondContact CA-O 3.42Å; L399-N457 VanDerWaalsContact CB-O 3.29Å; L399-N457 WeakPolarHBondContact CB-O 3.34Å; L399-N457 PolarHBondContact N-O 2.83Å; L399-N457 PolarHBondContact O-N 2.84Å; L399-Y460 HydrophobicContact CD1-CD2 3.95Å; L399-Y460 HydrophobicContact CD1-CG 4.22Å; L399-L463 HydrophobicContact CB-CD2 3.6Å
400	T	98.2	Very high	83.4	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	148.2	-169.5	64.1	0	0	0	0	113.7	Y289 E309 L368 A372 L455 L456	Y289-T400 PolarHBondContact OH-OG1 3.27Å; E309-T400 WeakPolarHBondContact CB-O 3.42Å; E309-T400 PolarHBondContact N-O 2.91Å; E309-T400 PolarHBondContact OE2-N 3.39Å; E309-T400 PolarHBondContact OE2-OG1 2.88Å; L368-T400 HydrophobicContact CD1-CG2 4.08Å; L368-T400 HydrophobicContact CD2-CG2 4.43Å; L368-T400 HydrophobicContact CG-CG2 3.95Å; A372-T400 HydrophobicContact CB-CG2 3.42Å; A372-T400 VanDerWaalsContact CB-CG2 3.42Å; T400-L455 WeakPolarHBondContact CA-O 3.3Å; T400-L456 HydrophobicContact CG2-CG 4.43Å
401	A	98.5	Very high	85.8	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	156.3	165.5	0	0	0	0	0	109.3	K307 L308 L455 L463 F467	K307-A401 CarbonylContact O-C 3.57Å; K307-A401 WeakPolarHBondContact O-CA 3.36Å; K307-A401 WeakPolarHBondContact O-CB 3.4Å; L308-A401 HydrophobicContact CD1-CB 3.87Å; A401-L455 HydrophobicContact CB-CB 4.21Å; A401-L455 HydrophobicContact CB-CD1 4.38Å; A401-L455 PolarHBondContact N-O 2.85Å; A401-L455 PolarHBondContact O-N 2.92Å; A401-L463 HydrophobicContact CB-CD1 3.97Å; A401-L463 HydrophobicContact CB-CD2 4.48Å; A401-L463 HydrophobicContact CB-CG 4.27Å; A401-F467 HydrophobicContact CB-CD2 3.66Å; A401-F467 HydrophobicContact CB-CE2 4.25Å; A401-F467 HydrophobicContact CB-CG 4.41Å
402	Y	98.1	Very high	87.9	Confident	7 Å²	7	50.6 Å²	50.6	3%	0.027	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	152.2	170.7	73.8	-97.5	0	0	0	112.5	A306 K307 P364 L368 R404 L453	A306-Y402 CarbonylContact C-O 3.57Å; A306-Y402 VanDerWaalsContact CA-O 3.31Å; A306-Y402 WeakPolarHBondContact CA-O 3.38Å; K307-Y402 HydrophobicContact CB-CD1 4Å; K307-Y402 HydrophobicContact CB-CE1 3.6Å; K307-Y402 HydrophobicContact CB-CE2 4.34Å; K307-Y402 HydrophobicContact CD-CE1 3.85Å; K307-Y402 WeakPolarHBondContact CD-OH 3.43Å; K307-Y402 WeakPolarHBondContact CE-OH 3.45Å; K307-Y402 HydrophobicContact CG-CE1 3.85Å; K307-Y402 HydrophobicContact CG-CE2 4.06Å; K307-Y402 WeakPolarHBondContact CG-OH 3.15Å; K307-Y402 PolarHBondContact N-O 3.13Å; K307-Y402 PolarHBondContact O-N 3.13Å; P364-Y402 HydrophobicContact CG-CD1 4.21Å; P364-Y402 HydrophobicContact CG-CD2 3.54Å; P364-Y402 HydrophobicContact CG-CE2 4.01Å; P364-Y402 HydrophobicContact CG-CG 3.64Å; L368-Y402 HydrophobicContact CD2-CD1 3.83Å; L368-Y402 HydrophobicContact CD2-CG 4.5Å; Y402-R404 HydrophobicContact CD2-CG 4.34Å; Y402-R404 HydrophobicContact CE2-CG 4.41Å; Y402-L453 CarbonylContact C-O 3.53Å; Y402-L453 WeakPolarHBondContact CA-O 3.35Å; Y402-L453 WeakPolarHBondContact CB-O 3.26Å
403	I	98.1	Very high	90.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	134.6	179.9	-51.5	170.1	0	0	0	108.4	P304 L305 A306 Y405 Q452 L453 F467 C470 M471	P304-I403 HydrophobicContact CB-CG2 3.67Å; L305-I403 CarbonylContact O-C 3.57Å; L305-I403 WeakPolarHBondContact O-CA 3.49Å; A306-I403 HydrophobicContact CB-CB 4.39Å; A306-I403 HydrophobicContact CB-CG1 3.98Å; A306-I403 HydrophobicContact CB-CG2 4.16Å; I403-Y405 HydrophobicContact CB-CE2 3.97Å; I403-Y405 HydrophobicContact CG2-CD2 3.84Å; I403-Y405 HydrophobicContact CG2-CE1 4.42Å; I403-Y405 HydrophobicContact CG2-CE2 3.34Å; I403-Q452 CarbonylContact O-C 3.59Å; I403-Q452 VanDerWaalsContact O-CA 3.31Å; I403-Q452 WeakPolarHBondContact O-CA 3.48Å; I403-L453 HydrophobicContact CB-CB 4.29Å; I403-L453 PolarHBondContact N-O 2.88Å; I403-L453 PolarHBondContact O-N 3.39Å; I403-F467 HydrophobicContact CD1-CD2 4.23Å; I403-F467 HydrophobicContact CG1-CD2 4.15Å; I403-F467 HydrophobicContact CG1-CE2 4.05Å; I403-C470 HydrophobicContact CD1-CB 3.26Å; I403-M471 HydrophobicContact CB-SD 4.49Å; I403-M471 HydrophobicContact CD1-CG 4.05Å; I403-M471 HydrophobicContact CD1-SD 3.93Å; I403-M471 HydrophobicContact CG1-SD 4.04Å; I403-M471 HydrophobicContact CG2-SD 3.65Å
404	R	97.6	Very high	92.3	Very high	20 Å²	20	40.8 Å²	40.8	8%	0.075	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	111.5	171.6	-65.5	173.1	59.9	-169.2	-1.1	107.9	F298 P304 L305 Y402 L444 V449 L451 Q452	F298-R404 HydrophobicContact CE2-CB 4.2Å; F298-R404 WeakPolarHBondContact CE2-O 3.13Å; P304-R404 CarbonylContact C-O 3.58Å; P304-R404 VanDerWaalsContact CA-O 3.25Å; P304-R404 WeakPolarHBondContact CA-O 3.33Å; L305-R404 HydrophobicContact CB-CB 4.32Å; L305-R404 PolarHBondContact N-O 2.83Å; L305-R404 PolarHBondContact O-N 2.86Å; Y402-R404 HydrophobicContact CD2-CG 4.34Å; Y402-R404 HydrophobicContact CE2-CG 4.41Å; R404-L444 PolarHBondContact NH2-O 2.98Å; R404-V449 HydrophobicContact CB-CG1 4.27Å; R404-L451 WeakPolarHBondContact CA-O 3.43Å; R404-Q452 HydrophobicContact CG-CG 4.31Å
405	Y	97.8	Very high	94.2	Very high	6 Å²	6	40.8 Å²	40.8	2%	0.024	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	126.5	173.3	-66.5	-96.8	0	0	0	109	P304 I403 V449 A450 L451 L453 C470 Y474 P476	P304-Y405 HydrophobicContact CB-CD1 4.07Å; P304-Y405 HydrophobicContact CB-CE1 4.2Å; P304-Y405 HydrophobicContact CB-CG 4.44Å; P304-Y405 HydrophobicContact CG-CD1 3.5Å; P304-Y405 HydrophobicContact CG-CE1 3.61Å; P304-Y405 HydrophobicContact CG-CG 4.3Å; I403-Y405 HydrophobicContact CB-CE2 3.97Å; I403-Y405 HydrophobicContact CG2-CD2 3.84Å; I403-Y405 HydrophobicContact CG2-CE1 4.42Å; I403-Y405 HydrophobicContact CG2-CE2 3.34Å; Y405-V449 WeakPolarHBondContact O-CA 3.34Å; Y405-A450 PolarHBondContact O-N 3.31Å; Y405-L451 HydrophobicContact CD2-CB 4.14Å; Y405-L451 HydrophobicContact CD2-CD2 3.9Å; Y405-L451 HydrophobicContact CD2-CG 4.11Å; Y405-L451 HydrophobicContact CE2-CD2 4.19Å; Y405-L451 PolarHBondContact N-O 2.91Å; Y405-L453 HydrophobicContact CE2-CD1 3.84Å; Y405-L453 HydrophobicContact CE2-CG 4.07Å; Y405-C470 PolarHBondContact OH-O 2.9Å; Y405-Y474 HydrophobicContact CE2-CD1 4.35Å; Y405-Y474 HydrophobicContact CE2-CE1 4.4Å; Y405-Y474 AromaticContact CZ-CD1 3.89Å; Y405-Y474 WeakPolarHBondContact OH-CD1 3.18Å; Y405-P476 HydrophobicContact CD1-CG 3.49Å; Y405-P476 VanDerWaalsContact CD1-CG 3.49Å; Y405-P476 HydrophobicContact CD2-CG 4.26Å; Y405-P476 HydrophobicContact CE1-CG 4Å; Y405-P476 HydrophobicContact CG-CG 3.65Å
406	P	97.4	Very high	95.9	Very high	4 Å²	4	38.9 Å²	38.9	3%	0.026	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	155.4	177.5	27.8	-31.6	0	0	0	110.5	F298 R302 P441 Y448 F477	F298-P406 HydrophobicContact CD2-CB 4.06Å; F298-P406 HydrophobicContact CD2-CG 4.33Å; F298-P406 HydrophobicContact CE1-CB 4.1Å; F298-P406 HydrophobicContact CE2-CB 3.57Å; F298-P406 HydrophobicContact CE2-CG 4.15Å; F298-P406 HydrophobicContact CZ-CB 3.6Å; R302-P406 VanDerWaalsContact C-CG 3.42Å; R302-P406 HydrophobicContact CB-CG 4.42Å; R302-P406 WeakPolarHBondContact O-CG 3.24Å; P406-P441 HydrophobicContact CB-CG 4.03Å; P406-Y448 CarbonylContact C-O 3.57Å; P406-Y448 VanDerWaalsContact CA-O 3.25Å; P406-Y448 WeakPolarHBondContact CA-O 3.47Å; P406-F477 VanDerWaalsContact O-CZ 3.24Å; P406-F477 WeakPolarHBondContact O-CZ 3.29Å
407	T	97.2	Very high	96.9	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.018	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-66.8	162	159.5	52.4	0	0	0	0	110	V432 T438 E439 P441 Y448 A450	T407-V432 HydrophobicContact CG2-CG1 4.1Å; T407-T438 HydrophobicContact CG2-CG2 4.1Å; T407-E439 WeakPolarHBondContact CB-O 3.25Å; T407-E439 PolarHBondContact OG1-O 3.01Å; T407-P441 WeakPolarHBondContact O-CD 3.35Å; T407-Y448 PolarHBondContact N-O 3.47Å; T407-Y448 WeakPolarHBondContact OG1-CA 3.41Å; T407-Y448 PolarHBondContact OG1-O 3.48Å; T407-A450 HydrophobicContact CG2-CB 4.07Å
408	R	96.1	Very high	97.4	Very high	85 Å²	85	36.5 Å²	36.5	32%	0.321	17%	0.169	S	C	.	.			trans	-132.7	154.1	168.1	-42	176.5	178.2	145.8	4.1	108.6	G410 T438 D440 E475 I479	R408-G410 PolarHBondContact O-N 2.91Å; R408-T438 PolarHBondContact O-OG1 3.15Å; R408-D440 WeakPolarHBondContact CA-OD1 3.25Å; R408-E475 IonicContact CZ-OE1 3.19Å; R408-E475 IonicContact NH1-OE1 2.8Å; R408-E475 PolarHBondContact NH1-OE1 3.45Å; R408-E475 IonicContact NH2-OE1 2.78Å; R408-E475 PolarHBondContact NH2-OE1 3.23Å; R408-E475 IonicContact NH2-OE2 2.72Å; R408-E475 PolarHBondContact NH2-OE2 3.41Å; R408-I479 HydrophobicContact CB-CD1 3.54Å; R408-I479 HydrophobicContact CG-CD1 4.15Å; R408-I479 VanDerWaalsContact O-CD1 3.32Å; R408-I479 WeakPolarHBondContact O-CD1 3.42Å
409	R	97.1	Very high	97.4	Very high	157 Å²	157	37.3 Å²	37.3	59%	0.592	18%	0.175	S	C	*	.	S	Bend	trans	-58.8	129.2	179	-176.9	-178.3	-64	-166	-3.6	111.9	T438 D440 I479	R409-T438 WeakPolarHBondContact CA-O 3.24Å; R409-D440 PolarHBondContact N-OD1 2.72Å; R409-I479 WeakPolarHBondContact O-CG2 3.39Å
410	G	97.5	Very high	97.3	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	136.9	-161.6	173.8	0	0	0	0	0	112.3	R408 R437 T438 L480	R408-G410 PolarHBondContact O-N 2.91Å; G410-R437 CarbonylContact O-C 3.53Å; G410-R437 WeakPolarHBondContact O-CA 3.43Å; G410-T438 PolarHBondContact N-O 2.87Å; G410-T438 PolarHBondContact O-N 3.5Å; G410-L480 WeakPolarHBondContact CA-O 3.38Å
411	V	98.2	Very high	97.2	Very high	36 Å²	36	52.2 Å²	52.2	22%	0.218	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	129.3	-179.8	-177.6	0	0	0	0	110.8	T413 R437 I479 L480	V411-T413 PolarHBondContact O-N 3.22Å; V411-R437 HydrophobicContact CG2-CB 4.38Å; V411-I479 WeakPolarHBondContact O-CA 3.47Å; V411-L480 PolarHBondContact N-O 2.99Å; V411-L480 PolarHBondContact O-N 2.6Å
412	I	98.3	Very high	97.2	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	117.2	178.2	-56.8	-69.9	0	0	0	109.7	I415 V432 G435 Q436 T438 F477 E478 I479	I412-I415 HydrophobicContact CG2-CD1 4.43Å; I412-I415 HydrophobicContact CG2-CG1 4.04Å; I412-V432 HydrophobicContact CD1-CG2 4.36Å; I412-V432 HydrophobicContact CG1-CB 4.28Å; I412-V432 HydrophobicContact CG1-CG2 4.44Å; I412-G435 PolarHBondContact O-N 2.93Å; I412-Q436 WeakPolarHBondContact CG1-O 3.12Å; I412-Q436 PolarHBondContact N-O 2.9Å; I412-T438 HydrophobicContact CD1-CG2 4.49Å; I412-T438 HydrophobicContact CG1-CG2 4.2Å; I412-F477 HydrophobicContact CD1-CB 4.49Å; I412-F477 HydrophobicContact CD1-CD2 3.62Å; I412-F477 HydrophobicContact CD1-CE2 4.13Å; I412-F477 HydrophobicContact CD1-CG 4.09Å; I412-F477 HydrophobicContact CG2-CB 4.47Å; I412-E478 WeakPolarHBondContact CA-O 3.24Å; I412-I479 HydrophobicContact CD1-CD1 4.17Å; I412-I479 HydrophobicContact CD1-CG1 3.82Å
413	T	98.1	Very high	97.2	Very high	65 Å²	65	61 Å²	61	40%	0.399	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-30.7	-179.1	51.2	0	0	0	0	113.1	V411 E478 L480	V411-T413 PolarHBondContact O-N 3.22Å; T413-E478 PolarHBondContact N-O 2.93Å; T413-E478 VanDerWaalsContact OG1-CB 3.23Å; T413-E478 WeakPolarHBondContact OG1-CB 3.4Å; T413-E478 PolarHBondContact OG1-O 3.5Å; T413-L480 HydrophobicContact CG2-CB 3.63Å
414	S	98.1	Very high	97.2	Very high	30 Å²	30	61.4 Å²	61.4	21%	0.21	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	153.8	179	70.5	0	0	0	0	111.3	F477 E478	S414-F477 VanDerWaalsContact O-CA 3.23Å; S414-F477 WeakPolarHBondContact O-CA 3.49Å; S414-F477 WeakPolarHBondContact O-CB 3.27Å; S414-E478 PolarHBondContact O-N 2.93Å; S414-E478 VanDerWaalsContact O-N 3.14Å; S414-E478 WeakPolarHBondContact OG-CB 3.43Å; S414-E478 WeakPolarHBondContact OG-CG 3.47Å; S414-E478 PolarHBondContact OG-OE2 3.24Å
415	I	98	Very high	97.2	Very high	51 Å²	51	66.3 Å²	66.3	26%	0.262	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	130	174.9	-77.4	174.6	0	0	0	107.2	I412 W430 V432 V434 F477	I412-I415 HydrophobicContact CG2-CD1 4.43Å; I412-I415 HydrophobicContact CG2-CG1 4.04Å; I415-W430 HydrophobicContact CB-CH2 4.42Å; I415-W430 HydrophobicContact CB-CZ3 4.31Å; I415-W430 HydrophobicContact CD1-CE3 4.03Å; I415-W430 HydrophobicContact CD1-CZ3 4.38Å; I415-W430 HydrophobicContact CG1-CE3 4.13Å; I415-W430 HydrophobicContact CG1-CZ3 3.96Å; I415-W430 HydrophobicContact CG2-CD2 3.79Å; I415-W430 HydrophobicContact CG2-CE3 3.81Å; I415-W430 HydrophobicContact CG2-CH2 3.55Å; I415-W430 HydrophobicContact CG2-CZ2 3.53Å; I415-W430 HydrophobicContact CG2-CZ3 3.68Å; I415-V432 HydrophobicContact CD1-CG2 4.3Å; I415-V432 WeakPolarHBondContact CD1-O 3.33Å; I415-V434 HydrophobicContact CD1-CG2 4.39Å; I415-V434 HydrophobicContact CG1-CG2 4.33Å; I415-F477 HydrophobicContact CG1-CB 4.46Å
416	R	97.6	Very high	97.2	Very high	119 Å²	119	68.1 Å²	68.1	45%	0.449	32%	0.32	S	S	.	.			trans	-113	133	-177.2	-58.1	-174.9	-175.2	-177.5	-3.2	110.1	W430 Y474 E475 P476 E478	R416-W430 WeakPolarHBondContact O-CZ2 3.39Å; R416-Y474 HydrophobicContact CB-CE2 4.4Å; R416-Y474 PolarHBondContact O-OH 3.02Å; R416-E475 WeakPolarHBondContact CD-O 3.5Å; R416-P476 PolarHBondContact N-O 2.8Å; R416-E478 IonicContact CZ-OE1 3.43Å; R416-E478 IonicContact NE-OE1 3.61Å; R416-E478 IonicContact NH2-OE1 2.66Å; R416-E478 PolarHBondContact NH2-OE1 3.15Å
417	Q	96.7	Very high	97.2	Very high	133 Å²	133	71.6 Å²	71.6	62%	0.621	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-68.9	155.3	174.8	-63.5	-56.7	-32	0	0	111.6	Y474	Q417-Y474 VanDerWaalsContact O-CE2 3.27Å; Q417-Y474 WeakPolarHBondContact O-CE2 3.46Å
418	P	95.9	Very high	97.2	Very high	20 Å²	20	73.3 Å²	73.3	13%	0.13	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-56.1	150.5	172.3	-24.8	36	0	0	0	111.7	E420 L422 V426 A428 L453	P418-E420 PolarHBondContact O-N 2.79Å; P418-L422 HydrophobicContact CB-CD1 4.22Å; P418-V426 HydrophobicContact CB-CG1 4.07Å; P418-V426 HydrophobicContact CG-CG1 3.98Å; P418-A428 HydrophobicContact CG-CB 4Å; P418-L453 HydrophobicContact CG-CD2 3.65Å
419	P	94.5	Very high	97.2	Very high	41 Å²	41	72.6 Å²	72.6	27%	0.266	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-57	132.6	179	-22.9	31.9	0	0	0	112.2	T421 L422 Y474	P419-T421 PolarHBondContact O-N 3.44Å; P419-L422 HydrophobicContact CB-CG 4.22Å; P419-L422 VanDerWaalsContact O-CG 3.29Å; P419-L422 WeakPolarHBondContact O-CG 3.38Å; P419-L422 PolarHBondContact O-N 2.9Å; P419-Y474 HydrophobicContact CG-CD2 4.28Å
420	E	95.1	Very high	97.2	Very high	200 Å²	200	68.1 Å²	68.1	94%	0.935	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-13.1	176.1	-63.2	-177.2	173.4	0	0	112.7	P418 L422	P418-E420 PolarHBondContact O-N 2.79Å; E420-L422 VanDerWaalsContact C-N 3.28Å; E420-L422 PolarHBondContact O-N 3.46Å
421	T	96.1	Very high	97.1	Very high	118 Å²	118	73.9 Å²	73.9	72%	0.724	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-8.8	178.5	53.7	0	0	0	0	114.1	P419	P419-T421 PolarHBondContact O-N 3.44Å
422	L	97.8	Very high	97.1	Very high	20 Å²	20	72.8 Å²	72.8	11%	0.105	35%	0.348	C	S	.	.			trans	-66.7	134.3	179.4	-61.5	173.9	0	0	0	110.6	P418 P419 E420 V426 D466 T469	P418-L422 HydrophobicContact CB-CD1 4.22Å; P419-L422 HydrophobicContact CB-CG 4.22Å; P419-L422 VanDerWaalsContact O-CG 3.29Å; P419-L422 WeakPolarHBondContact O-CG 3.38Å; P419-L422 PolarHBondContact O-N 2.9Å; E420-L422 VanDerWaalsContact C-N 3.28Å; E420-L422 PolarHBondContact O-N 3.46Å; L422-V426 HydrophobicContact CB-CG2 4.18Å; L422-V426 HydrophobicContact CD1-CG2 3.74Å; L422-D466 WeakPolarHBondContact CA-OD1 3.41Å; L422-D466 HydrophobicContact CD2-CB 3.79Å; L422-T469 HydrophobicContact CD2-CG2 4.11Å
423	R	98.2	Very high	97.1	Very high	173 Å²	173	79.2 Å²	79.2	65%	0.653	38%	0.378	S	S	*	.	S	Bend	trans	-85.8	-16.2	-179	-63.1	-177	-176.3	-176.1	2	113.3	N457 H462 D466	R423-N457 PolarHBondContact O-ND2 2.97Å; R423-H462 HydrophobicContact CB-CB 4.17Å; R423-H462 PolarHBondContact NH1-CD2 3.16Å; R423-H462 PolarHBondContact NH1-NE2 2.71Å; R423-D466 WeakPolarHBondContact CA-OD2 3.32Å; R423-D466 VanDerWaalsContact N-CG 3.33Å; R423-D466 PolarHBondContact N-OD1 2.68Å; R423-D466 PolarHBondContact N-OD2 3.01Å
424	S	98.3	Very high	97.1	Very high	8 Å²	8	80.3 Å²	80.3	6%	0.056	38%	0.384	C	S	.	.	S	Bend	trans	-83	148.2	177.9	-59.9	0	0	0	0	110.2	V426 N457 D466	S424-V426 WeakPolarHBondContact O-CG2 3.41Å; S424-V426 PolarHBondContact O-N 2.64Å; S424-N457 VanDerWaalsContact CA-ND2 3.32Å; S424-N457 WeakPolarHBondContact CA-ND2 3.38Å; S424-N457 PolarHBondContact N-ND2 3.44Å; S424-N457 PolarHBondContact OG-ND2 3.33Å; S424-N457 VanDerWaalsContact OG-ND2 3.12Å; S424-D466 WeakPolarHBondContact CA-OD2 3.37Å; S424-D466 WeakPolarHBondContact CB-OD2 3.32Å; S424-D466 PolarHBondContact N-OD2 3.33Å; S424-D466 PolarHBondContact OG-OD2 3.33Å
425	R	97.6	Very high	97.1	Very high	122 Å²	122	81.4 Å²	81.4	46%	0.46	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	123.2	166.9	-177.1	174.8	62.3	174.4	4.5	108.5	L371 Y427 L456	L371-R425 PolarHBondContact O-NH2 3.07Å; R425-Y427 WeakPolarHBondContact CD-OH 3.38Å; R425-Y427 HydrophobicContact CG-CE2 3.85Å; R425-Y427 VanDerWaalsContact CZ-OH 3.27Å; R425-Y427 PolarHBondContact NE-OH 3.14Å; R425-Y427 PolarHBondContact NH1-OH 3.47Å; R425-L456 HydrophobicContact CB-CB 4.43Å; R425-L456 PolarHBondContact N-O 2.84Å; R425-L456 VanDerWaalsContact NH2-CD2 3.33Å; R425-L456 PolarHBondContact O-N 3.17Å
426	V	97.8	Very high	97.1	Very high	45 Å²	45	82.2 Å²	82.2	27%	0.273	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	132.3	-175.7	-171.8	0	0	0	0	110.7	P418 L422 S424 L453 L454 L455	P418-V426 HydrophobicContact CB-CG1 4.07Å; P418-V426 HydrophobicContact CG-CG1 3.98Å; L422-V426 HydrophobicContact CB-CG2 4.18Å; L422-V426 HydrophobicContact CD1-CG2 3.74Å; S424-V426 WeakPolarHBondContact O-CG2 3.41Å; S424-V426 PolarHBondContact O-N 2.64Å; V426-L453 HydrophobicContact CG1-CD2 4.13Å; V426-L454 CarbonylContact C-O 3.47Å; V426-L454 WeakPolarHBondContact CA-O 3.26Å; V426-L455 HydrophobicContact CB-CD2 4.34Å; V426-L455 HydrophobicContact CG1-CD2 4.07Å; V426-L455 HydrophobicContact CG2-CD2 3.78Å
427	Y	97.4	Very high	97.1	Very high	77 Å²	77	83.9 Å²	83.9	30%	0.302	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	119.8	163.3	-59.9	-97.4	0	0	0	109.4	L371 R425 L453 L454 L456	L371-Y427 HydrophobicContact CD1-CD1 4.34Å; L371-Y427 HydrophobicContact CD1-CD2 3.99Å; L371-Y427 HydrophobicContact CD1-CE1 4.44Å; L371-Y427 HydrophobicContact CD1-CE2 4.09Å; L371-Y427 HydrophobicContact CD1-CG 4.11Å; L371-Y427 HydrophobicContact CD2-CE1 4.28Å; R425-Y427 WeakPolarHBondContact CD-OH 3.38Å; R425-Y427 HydrophobicContact CG-CE2 3.85Å; R425-Y427 VanDerWaalsContact CZ-OH 3.27Å; R425-Y427 PolarHBondContact NE-OH 3.14Å; R425-Y427 PolarHBondContact NH1-OH 3.47Å; Y427-L453 WeakPolarHBondContact O-CA 3.16Å; Y427-L454 PolarHBondContact N-O 2.75Å; Y427-L454 PolarHBondContact O-N 3.32Å; Y427-L456 HydrophobicContact CD2-CD1 3.61Å; Y427-L456 HydrophobicContact CE2-CD1 3.73Å
428	A	97.1	Very high	97.1	Very high	38 Å²	38	78 Å²	78	31%	0.314	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	115.4	177.8	0	0	0	0	0	110.5	P418 L451 L453	P418-A428 HydrophobicContact CG-CB 4Å; A428-L451 HydrophobicContact CB-CD1 3.99Å; A428-L453 HydrophobicContact CB-CD2 3.71Å
429	L	95.8	Very high	97.1	Very high	71 Å²	71	83 Å²	83	37%	0.372	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	95.9	175.5	-54	108.9	0	0	0	109.8	Q452 L454	L429-Q452 HydrophobicContact CB-CB 4.23Å; L429-Q452 HydrophobicContact CD1-CB 4.1Å; L429-Q452 PolarHBondContact N-O 3.37Å; L429-Q452 PolarHBondContact O-N 3.15Å; L429-L454 HydrophobicContact CD1-CD1 3.88Å; L429-L454 HydrophobicContact CD1-CD2 4.48Å; L429-L454 HydrophobicContact CD1-CG 3.9Å
430	W	97.1	Very high	97.1	Very high	63 Å²	63	82.2 Å²	82.2	24%	0.239	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	138.7	173.3	-66.6	94.3	0	0	0	111	I415 R416 V432 L451 P476 F477	I415-W430 HydrophobicContact CB-CH2 4.42Å; I415-W430 HydrophobicContact CB-CZ3 4.31Å; I415-W430 HydrophobicContact CD1-CE3 4.03Å; I415-W430 HydrophobicContact CD1-CZ3 4.38Å; I415-W430 HydrophobicContact CG1-CE3 4.13Å; I415-W430 HydrophobicContact CG1-CZ3 3.96Å; I415-W430 HydrophobicContact CG2-CD2 3.79Å; I415-W430 HydrophobicContact CG2-CE3 3.81Å; I415-W430 HydrophobicContact CG2-CH2 3.55Å; I415-W430 HydrophobicContact CG2-CZ2 3.53Å; I415-W430 HydrophobicContact CG2-CZ3 3.68Å; R416-W430 WeakPolarHBondContact O-CZ2 3.39Å; W430-V432 HydrophobicContact CE3-CG2 4.15Å; W430-L451 HydrophobicContact CD2-CD1 3.87Å; W430-L451 HydrophobicContact CE3-CB 4.17Å; W430-L451 HydrophobicContact CE3-CD1 4.3Å; W430-L451 HydrophobicContact CG-CD1 4.19Å; W430-L451 HydrophobicContact CH2-CB 4.37Å; W430-L451 HydrophobicContact CH2-CD1 4.42Å; W430-L451 HydrophobicContact CH2-CD2 3.78Å; W430-L451 HydrophobicContact CH2-CG 4.42Å; W430-L451 HydrophobicContact CZ2-CD1 4.02Å; W430-L451 HydrophobicContact CZ2-CD2 3.83Å; W430-L451 HydrophobicContact CZ2-CG 4.42Å; W430-L451 HydrophobicContact CZ3-CB 4.07Å; W430-L451 HydrophobicContact CZ3-CD2 4.32Å; W430-P476 HydrophobicContact CH2-CB 3.6Å; W430-P476 WeakPolarHBondContact CH2-O 3.43Å; W430-P476 HydrophobicContact CZ3-CB 4.17Å; W430-F477 HydrophobicContact CZ3-CB 4.48Å; W430-F477 HydrophobicContact CZ3-CD1 4.32Å
431	R	96.3	Very high	96.9	Very high	120 Å²	120	73 Å²	73	45%	0.453	36%	0.356	S	S	.	.			trans	-124.6	6.9	175.5	-65.6	-176.9	177.3	-136.2	-6.3	112.4	G446 V449 A450	R431-G446 VanDerWaalsContact NH1-CA 3.33Å; R431-G446 PolarHBondContact NH1-O 2.77Å; R431-V449 VanDerWaalsContact CB-O 3.23Å; R431-V449 WeakPolarHBondContact CB-O 3.42Å; R431-A450 PolarHBondContact N-O 2.88Å
432	V	97.4	Very high	96.5	Very high	13 Å²	13	72.5 Å²	72.5	8%	0.079	35%	0.352	C	S	.	.			trans	-128.5	159.7	174.8	-65.7	0	0	0	0	109.8	T407 I412 I415 W430 Q436 T438 A450	T407-V432 HydrophobicContact CG2-CG1 4.1Å; I412-V432 HydrophobicContact CD1-CG2 4.36Å; I412-V432 HydrophobicContact CG1-CB 4.28Å; I412-V432 HydrophobicContact CG1-CG2 4.44Å; I415-V432 HydrophobicContact CD1-CG2 4.3Å; I415-V432 WeakPolarHBondContact CD1-O 3.33Å; W430-V432 HydrophobicContact CE3-CG2 4.15Å; V432-Q436 VanDerWaalsContact CA-OE1 3.23Å; V432-T438 HydrophobicContact CG1-CG2 3.92Å; V432-A450 HydrophobicContact CG1-CB 4.11Å; V432-A450 HydrophobicContact CG2-CB 3.92Å
433	Q	97.7	Very high	95.9	Very high	136 Å²	136	74.8 Å²	74.8	64%	0.636	36%	0.362	S	S	*	.			trans	-131.4	157.7	173.4	62.1	-172.7	5.3	0	0	110.4	G435 Q436	Q433-G435 PolarHBondContact O-N 3.39Å; Q433-Q436 HydrophobicContact CG-CB 4.08Å; Q433-Q436 WeakPolarHBondContact O-CB 3.11Å; Q433-Q436 PolarHBondContact O-N 3.26Å; Q433-Q436 VanDerWaalsContact O-N 3.07Å
434	V	98.3	Very high	95.2	Very high	88 Å²	88	68.1 Å²	68.1	53%	0.533	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	137.9	173.6	178.5	0	0	0	0	110	I415 Q436	I415-V434 HydrophobicContact CD1-CG2 4.39Å; I415-V434 HydrophobicContact CG1-CG2 4.33Å; V434-Q436 VanDerWaalsContact C-N 3.28Å; V434-Q436 PolarHBondContact O-N 3.28Å
435	G	97.9	Very high	94.6	Very high	54 Å²	54	69.3 Å²	69.3	56%	0.557	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	-9.3	-174.8	0	0	0	0	0	114.6	I412 Q433 R437	I412-G435 PolarHBondContact O-N 2.93Å; Q433-G435 PolarHBondContact O-N 3.39Å; G435-R437 PolarHBondContact O-N 2.96Å
436	Q	97.7	Very high	94	Very high	68 Å²	68	65 Å²	65	32%	0.318	34%	0.342	S	S	.	.			trans	-72	128.3	176.7	-175.2	175.7	-15.5	0	0	111	I412 V432 Q433 V434 T438	I412-Q436 WeakPolarHBondContact CG1-O 3.12Å; I412-Q436 PolarHBondContact N-O 2.9Å; V432-Q436 VanDerWaalsContact CA-OE1 3.23Å; Q433-Q436 HydrophobicContact CG-CB 4.08Å; Q433-Q436 WeakPolarHBondContact O-CB 3.11Å; Q433-Q436 PolarHBondContact O-N 3.26Å; Q433-Q436 VanDerWaalsContact O-N 3.07Å; V434-Q436 VanDerWaalsContact C-N 3.28Å; V434-Q436 PolarHBondContact O-N 3.28Å; Q436-T438 HydrophobicContact CG-CG2 4.02Å
437	R	97.7	Very high	93.6	Very high	154 Å²	154	69.3 Å²	69.3	58%	0.581	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	131.6	166.7	-178.2	174.3	-79.8	-85.7	-7.6	109.6	G410 V411 G435 D482	G410-R437 CarbonylContact O-C 3.53Å; G410-R437 WeakPolarHBondContact O-CA 3.43Å; V411-R437 HydrophobicContact CG2-CB 4.38Å; G435-R437 PolarHBondContact O-N 2.96Å; R437-D482 IonicContact CZ-OD1 3.1Å; R437-D482 IonicContact NH1-OD1 3.44Å; R437-D482 PolarHBondContact NH1-OD1 3.4Å; R437-D482 IonicContact NH1-OD2 2.71Å; R437-D482 PolarHBondContact NH1-OD2 2.71Å; R437-D482 IonicContact NH2-OD1 2.79Å; R437-D482 PolarHBondContact NH2-OD1 2.94Å
438	T	97	Very high	93.5	Very high	10 Å²	10	66.3 Å²	66.3	6%	0.061	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	165.9	179.9	65.2	0	0	0	0	111.8	T407 R408 R409 G410 I412 V432 Q436	T407-T438 HydrophobicContact CG2-CG2 4.1Å; R408-T438 PolarHBondContact O-OG1 3.15Å; R409-T438 WeakPolarHBondContact CA-O 3.24Å; G410-T438 PolarHBondContact N-O 2.87Å; G410-T438 PolarHBondContact O-N 3.5Å; I412-T438 HydrophobicContact CD1-CG2 4.49Å; I412-T438 HydrophobicContact CG1-CG2 4.2Å; V432-T438 HydrophobicContact CG1-CG2 3.92Å; Q436-T438 HydrophobicContact CG-CG2 4.02Å
439	E	95.9	Very high	93.4	Very high	125 Å²	125	64.6 Å²	64.6	58%	0.584	33%	0.33	S	S	*	.			trans	-119	162.3	-178	-65.1	175.7	173.6	0	0	110.5	T407 Y448	T407-E439 WeakPolarHBondContact CB-O 3.25Å; T407-E439 PolarHBondContact OG1-O 3.01Å; E439-Y448 HydrophobicContact CB-CE1 4.23Å
440	D	95.5	Very high	93.5	Very high	24 Å²	24	61.2 Å²	61.2	13%	0.128	31%	0.313	C	S	.	.			trans	-69.3	145.8	169.8	-65.3	-43.8	0	0	0	110.7	R302 R408 R409 V442 Y448	R302-D440 WeakPolarHBondContact CD-OD1 3.22Å; R302-D440 IonicContact CZ-OD1 2.66Å; R302-D440 IonicContact CZ-OD2 3.64Å; R302-D440 IonicContact NE-OD1 3.46Å; R302-D440 IonicContact NE-OD2 3.55Å; R302-D440 IonicContact NH1-OD1 2.71Å; R302-D440 PolarHBondContact NH1-OD1 2.74Å; R302-D440 IonicContact NH1-OD2 2.87Å; R302-D440 PolarHBondContact NH1-OD2 2.78Å; R302-D440 IonicContact NH2-OD2 3.22Å; R302-D440 PolarHBondContact NH2-OD2 3.04Å; R408-D440 WeakPolarHBondContact CA-OD1 3.25Å; R409-D440 PolarHBondContact N-OD1 2.72Å; D440-V442 PolarHBondContact O-N 3.05Å; D440-Y448 WeakPolarHBondContact O-CE1 3.45Å
441	P	91.4	Very high	93.5	Very high	7 Å²	7	58.2 Å²	58.2	5%	0.045	30%	0.301	C	S	.	.			trans	-61.7	130.8	175.3	24.4	-33.6	0	0	0	111.7	F298 R302 P406 T407 Y448	F298-P441 HydrophobicContact CD1-CB 4.06Å; F298-P441 HydrophobicContact CD1-CG 4.44Å; F298-P441 HydrophobicContact CE1-CB 3.82Å; F298-P441 HydrophobicContact CE1-CG 4.39Å; F298-P441 WeakPolarHBondContact O-CG 3.43Å; R302-P441 HydrophobicContact CG-CG 4.34Å; P406-P441 HydrophobicContact CB-CG 4.03Å; T407-P441 WeakPolarHBondContact O-CD 3.35Å; P441-Y448 HydrophobicContact CB-CD2 4.48Å; P441-Y448 HydrophobicContact CB-CG 4.07Å
442	V	86.4	Confident	93.6	Very high	107 Å²	107	53 Å²	53	65%	0.648	28%	0.282	S	S	*	.	S	Bend	trans	-109.2	-7.8	166.1	-52.8	0	0	0	0	112.5	D440 Y448	D440-V442 PolarHBondContact O-N 3.05Å; V442-Y448 HydrophobicContact CG2-CE2 3.76Å; V442-Y448 WeakPolarHBondContact CG2-OH 3.48Å
443	E	84.8	Confident	93.6	Very high	68 Å²	68	52.4 Å²	52.4	32%	0.318	28%	0.278	S	S	.	.	S	Bend	trans	-158.1	174.6	177.7	52.3	167.3	-162	0	0	109.9	S445 Y448	E443-S445 PolarHBondContact O-N 3.18Å; E443-S445 WeakPolarHBondContact OE1-CB 3.21Å; E443-S445 PolarHBondContact OE1-OG 2.73Å; E443-Y448 HydrophobicContact CG-CD2 3.95Å; E443-Y448 HydrophobicContact CG-CE2 3.6Å; E443-Y448 WeakPolarHBondContact O-CD2 3.44Å
444	L	84.7	Confident	93.7	Very high	33 Å²	33	46 Å²	46	17%	0.173	25%	0.248	C	C	.	.	S	Bend	trans	-84.3	17.5	-177.9	-61.3	167.9	0	0	0	114.2	I295 F298 V299 R404	I295-L444 HydrophobicContact CG2-CD1 3.19Å; I295-L444 HydrophobicContact CG2-CD2 3.61Å; I295-L444 HydrophobicContact CG2-CG 3.99Å; F298-L444 HydrophobicContact CB-CD2 3.87Å; F298-L444 HydrophobicContact CD1-CD2 3.72Å; F298-L444 HydrophobicContact CG-CD2 3.98Å; V299-L444 HydrophobicContact CG2-CD2 4.12Å; V299-L444 HydrophobicContact CG2-CG 4.38Å; R404-L444 PolarHBondContact NH2-O 2.98Å
445	S	84.7	Confident	93.7	Very high	33 Å²	33	41.8 Å²	41.8	23%	0.231	22%	0.223	C	C	.	.			trans	-72.9	158.5	-174.4	66.7	0	0	0	0	112.6	E443 K447 Y448	E443-S445 PolarHBondContact O-N 3.18Å; E443-S445 WeakPolarHBondContact OE1-CB 3.21Å; E443-S445 PolarHBondContact OE1-OG 2.73Å; S445-K447 PolarHBondContact O-N 3.06Å; S445-K447 VanDerWaalsContact O-N 3.14Å; S445-K447 WeakPolarHBondContact OG-CE 3.14Å; S445-K447 WeakPolarHBondContact OG-CG 3.23Å; S445-Y448 PolarHBondContact O-N 3.13Å
446	G	86.5	Confident	93.7	Very high	32 Å²	32	39.4 Å²	39.4	33%	0.33	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-67.2	-11.7	-174.4	0	0	0	0	0	115.2	R431	R431-G446 VanDerWaalsContact NH1-CA 3.33Å; R431-G446 PolarHBondContact NH1-O 2.77Å
447	K	88.7	Confident	93.7	Very high	135 Å²	135	37.1 Å²	37.1	59%	0.587	19%	0.187	S	C	*	.	G	3₁₀ helix	trans	-77	-22	176.3	69.5	-177.7	179.9	158.5	0	112.9	S445 V449	S445-K447 PolarHBondContact O-N 3.06Å; S445-K447 VanDerWaalsContact O-N 3.14Å; S445-K447 WeakPolarHBondContact OG-CE 3.14Å; S445-K447 WeakPolarHBondContact OG-CG 3.23Å; K447-V449 VanDerWaalsContact C-N 3.35Å
448	Y	94.2	Very high	93.6	Very high	13 Å²	13	33.2 Å²	33.2	5%	0.051	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-97	16.1	177.1	-61.3	-61.9	0	0	0	112.9	F298 P406 T407 E439 D440 P441 V442 E443 S445	F298-Y448 WeakPolarHBondContact CZ-O 3.09Å; P406-Y448 CarbonylContact C-O 3.57Å; P406-Y448 VanDerWaalsContact CA-O 3.25Å; P406-Y448 WeakPolarHBondContact CA-O 3.47Å; T407-Y448 PolarHBondContact N-O 3.47Å; T407-Y448 WeakPolarHBondContact OG1-CA 3.41Å; T407-Y448 PolarHBondContact OG1-O 3.48Å; E439-Y448 HydrophobicContact CB-CE1 4.23Å; D440-Y448 WeakPolarHBondContact O-CE1 3.45Å; P441-Y448 HydrophobicContact CB-CD2 4.48Å; P441-Y448 HydrophobicContact CB-CG 4.07Å; V442-Y448 HydrophobicContact CG2-CE2 3.76Å; V442-Y448 WeakPolarHBondContact CG2-OH 3.48Å; E443-Y448 HydrophobicContact CG-CD2 3.95Å; E443-Y448 HydrophobicContact CG-CE2 3.6Å; E443-Y448 WeakPolarHBondContact O-CD2 3.44Å; S445-Y448 PolarHBondContact O-N 3.13Å
449	V	96.1	Very high	93.6	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.012	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	121.2	177.6	179.5	0	0	0	0	107.3	F298 R404 Y405 R431 K447 L451 Q452	F298-V449 HydrophobicContact CZ-CG2 4.06Å; R404-V449 HydrophobicContact CB-CG1 4.27Å; Y405-V449 WeakPolarHBondContact O-CA 3.34Å; R431-V449 VanDerWaalsContact CB-O 3.23Å; R431-V449 WeakPolarHBondContact CB-O 3.42Å; K447-V449 VanDerWaalsContact C-N 3.35Å; V449-L451 WeakPolarHBondContact CG1-O 3.42Å; V449-Q452 HydrophobicContact CG1-CG 3.62Å
450	A	97.8	Very high	93.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	-43.1	175.4	0	0	0	0	0	111.6	Y405 T407 R431 V432 F477	Y405-A450 PolarHBondContact O-N 3.31Å; T407-A450 HydrophobicContact CG2-CB 4.07Å; R431-A450 PolarHBondContact N-O 2.88Å; V432-A450 HydrophobicContact CG1-CB 4.11Å; V432-A450 HydrophobicContact CG2-CB 3.92Å; A450-F477 HydrophobicContact CB-CD1 3.81Å; A450-F477 HydrophobicContact CB-CE1 3.28Å; A450-F477 HydrophobicContact CB-CZ 3.91Å
451	L	97.9	Very high	93.8	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	137.6	-177.2	172.3	63.8	0	0	0	110.4	R404 Y405 A428 W430 V449 L453 Y474 P476	R404-L451 WeakPolarHBondContact CA-O 3.43Å; Y405-L451 HydrophobicContact CD2-CB 4.14Å; Y405-L451 HydrophobicContact CD2-CD2 3.9Å; Y405-L451 HydrophobicContact CD2-CG 4.11Å; Y405-L451 HydrophobicContact CE2-CD2 4.19Å; Y405-L451 PolarHBondContact N-O 2.91Å; A428-L451 HydrophobicContact CB-CD1 3.99Å; W430-L451 HydrophobicContact CD2-CD1 3.87Å; W430-L451 HydrophobicContact CE3-CB 4.17Å; W430-L451 HydrophobicContact CE3-CD1 4.3Å; W430-L451 HydrophobicContact CG-CD1 4.19Å; W430-L451 HydrophobicContact CH2-CB 4.37Å; W430-L451 HydrophobicContact CH2-CD1 4.42Å; W430-L451 HydrophobicContact CH2-CD2 3.78Å; W430-L451 HydrophobicContact CH2-CG 4.42Å; W430-L451 HydrophobicContact CZ2-CD1 4.02Å; W430-L451 HydrophobicContact CZ2-CD2 3.83Å; W430-L451 HydrophobicContact CZ2-CG 4.42Å; W430-L451 HydrophobicContact CZ3-CB 4.07Å; W430-L451 HydrophobicContact CZ3-CD2 4.32Å; V449-L451 WeakPolarHBondContact CG1-O 3.42Å; L451-L453 HydrophobicContact CD1-CD2 3.91Å; L451-L453 HydrophobicContact CD1-CG 4.48Å; L451-L453 HydrophobicContact CD2-CD1 4.36Å; L451-L453 HydrophobicContact CD2-CD2 3.8Å; L451-L453 HydrophobicContact CD2-CG 3.84Å; L451-L453 HydrophobicContact CG-CD2 3.99Å; L451-L453 HydrophobicContact CG-CG 4.05Å; L451-Y474 HydrophobicContact CD2-CE1 3.85Å; L451-P476 HydrophobicContact CD2-CB 3.56Å; L451-P476 HydrophobicContact CD2-CG 4.37Å
452	Q	97.6	Very high	94.1	Very high	11 Å²	11	34.8 Å²	34.8	5%	0.051	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	121.5	161.9	-50.8	-175.8	-85.8	0	0	109	I403 R404 L429 V449	I403-Q452 CarbonylContact O-C 3.59Å; I403-Q452 VanDerWaalsContact O-CA 3.31Å; I403-Q452 WeakPolarHBondContact O-CA 3.48Å; R404-Q452 HydrophobicContact CG-CG 4.31Å; L429-Q452 HydrophobicContact CB-CB 4.23Å; L429-Q452 HydrophobicContact CD1-CB 4.1Å; L429-Q452 PolarHBondContact N-O 3.37Å; L429-Q452 PolarHBondContact O-N 3.15Å; V449-Q452 HydrophobicContact CG1-CG 3.62Å
453	L	97.8	Very high	94.7	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	130.4	168.4	-67.1	-173.2	0	0	0	109.9	Y402 I403 Y405 P418 V426 Y427 A428 L451 C470 Y474	Y402-L453 CarbonylContact C-O 3.53Å; Y402-L453 WeakPolarHBondContact CA-O 3.35Å; Y402-L453 WeakPolarHBondContact CB-O 3.26Å; I403-L453 HydrophobicContact CB-CB 4.29Å; I403-L453 PolarHBondContact N-O 2.88Å; I403-L453 PolarHBondContact O-N 3.39Å; Y405-L453 HydrophobicContact CE2-CD1 3.84Å; Y405-L453 HydrophobicContact CE2-CG 4.07Å; P418-L453 HydrophobicContact CG-CD2 3.65Å; V426-L453 HydrophobicContact CG1-CD2 4.13Å; Y427-L453 WeakPolarHBondContact O-CA 3.16Å; A428-L453 HydrophobicContact CB-CD2 3.71Å; L451-L453 HydrophobicContact CD1-CD2 3.91Å; L451-L453 HydrophobicContact CD1-CG 4.48Å; L451-L453 HydrophobicContact CD2-CD1 4.36Å; L451-L453 HydrophobicContact CD2-CD2 3.8Å; L451-L453 HydrophobicContact CD2-CG 3.84Å; L451-L453 HydrophobicContact CG-CD2 3.99Å; L451-L453 HydrophobicContact CG-CG 4.05Å; L453-C470 HydrophobicContact CD1-CB 4.41Å; L453-Y474 HydrophobicContact CD1-CD1 3.98Å; L453-Y474 HydrophobicContact CD1-CE1 3.75Å
454	L	98.2	Very high	95.3	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	124.1	171	-47	-174.5	0	0	0	108.2	P364 T367 L368 L371 V426 Y427 L429 L456	P364-L454 HydrophobicContact CB-CD2 3.45Å; P364-L454 VanDerWaalsContact CB-CD2 3.45Å; P364-L454 HydrophobicContact CG-CD2 3.73Å; T367-L454 HydrophobicContact CG2-CD1 4.38Å; L368-L454 HydrophobicContact CD1-CB 3.81Å; L368-L454 HydrophobicContact CD1-CD1 4.39Å; L368-L454 HydrophobicContact CD1-CD2 4.34Å; L368-L454 HydrophobicContact CD1-CG 4.39Å; L371-L454 HydrophobicContact CD1-CD1 3.86Å; V426-L454 CarbonylContact C-O 3.47Å; V426-L454 WeakPolarHBondContact CA-O 3.26Å; Y427-L454 PolarHBondContact N-O 2.75Å; Y427-L454 PolarHBondContact O-N 3.32Å; L429-L454 HydrophobicContact CD1-CD1 3.88Å; L429-L454 HydrophobicContact CD1-CD2 4.48Å; L429-L454 HydrophobicContact CD1-CG 3.9Å; L454-L456 HydrophobicContact CB-CD1 4.18Å
455	L	98.5	Very high	95.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	130.2	178.9	-53.2	178.4	0	0	0	108.7	T400 A401 V426 L463 D466 F467	T400-L455 WeakPolarHBondContact CA-O 3.3Å; A401-L455 HydrophobicContact CB-CB 4.21Å; A401-L455 HydrophobicContact CB-CD1 4.38Å; A401-L455 PolarHBondContact N-O 2.85Å; A401-L455 PolarHBondContact O-N 2.92Å; V426-L455 HydrophobicContact CB-CD2 4.34Å; V426-L455 HydrophobicContact CG1-CD2 4.07Å; V426-L455 HydrophobicContact CG2-CD2 3.78Å; L455-L463 HydrophobicContact CB-CD1 3.67Å; L455-D466 HydrophobicContact CD1-CB 4.45Å; L455-F467 HydrophobicContact CD1-CB 4.17Å
456	L	98	Very high	96.6	Very high	5 Å²	5	30.6 Å²	30.6	3%	0.026	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	125.5	179.4	-64.8	85.7	0	0	0	109.3	L368 L371 A372 V398 L399 T400 R425 Y427 L454	L368-L456 HydrophobicContact CD1-CD1 4.08Å; L368-L456 HydrophobicContact CD1-CG 4.31Å; L371-L456 HydrophobicContact CB-CD2 3.88Å; A372-L456 HydrophobicContact CB-CD2 3.8Å; V398-L456 HydrophobicContact CG1-CB 3.77Å; V398-L456 HydrophobicContact CG1-CD2 4.16Å; V398-L456 HydrophobicContact CG1-CG 4.34Å; L399-L456 WeakPolarHBondContact O-CA 3.45Å; T400-L456 HydrophobicContact CG2-CG 4.43Å; R425-L456 HydrophobicContact CB-CB 4.43Å; R425-L456 PolarHBondContact N-O 2.84Å; R425-L456 VanDerWaalsContact NH2-CD2 3.33Å; R425-L456 PolarHBondContact O-N 3.17Å; Y427-L456 HydrophobicContact CD2-CD1 3.61Å; Y427-L456 HydrophobicContact CE2-CD1 3.73Å; L454-L456 HydrophobicContact CB-CD1 4.18Å
457	N	97.7	Very high	97.1	Very high	19 Å²	19	29.5 Å²	29.5	10%	0.102	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	149.9	177.8	-149.3	-56.9	0	0	0	110.5	L399 R423 S424 N459 L463	L399-N457 WeakPolarHBondContact CA-O 3.42Å; L399-N457 VanDerWaalsContact CB-O 3.29Å; L399-N457 WeakPolarHBondContact CB-O 3.34Å; L399-N457 PolarHBondContact N-O 2.83Å; L399-N457 PolarHBondContact O-N 2.84Å; R423-N457 PolarHBondContact O-ND2 2.97Å; S424-N457 VanDerWaalsContact CA-ND2 3.32Å; S424-N457 WeakPolarHBondContact CA-ND2 3.38Å; S424-N457 PolarHBondContact N-ND2 3.44Å; S424-N457 PolarHBondContact OG-ND2 3.33Å; S424-N457 VanDerWaalsContact OG-ND2 3.12Å; N457-N459 PolarHBondContact OD1-N 2.98Å; N457-L463 HydrophobicContact CB-CB 3.91Å; N457-L463 HydrophobicContact CB-CD1 4.23Å
458	T	96.5	Very high	97.6	Very high	72 Å²	72	26 Å²	26	44%	0.442	15%	0.152	S	C	.	.	S	Bend	trans	-90	-17.2	173.1	55.3	0	0	0	0	111.5	E396 V398	E396-T458 HydrophobicContact CG-CG2 3.89Å; E396-T458 WeakPolarHBondContact OE1-CG2 3.19Å; V398-T458 HydrophobicContact CG2-CG2 4.13Å
459	N	96.9	Very high	97.7	Very high	74 Å²	74	26.9 Å²	26.9	40%	0.396	16%	0.159	S	C	.	.			trans	-97.7	118.9	173.7	-174.8	-67.1	0	0	0	111.2	N457 G461 H462 L463	N457-N459 PolarHBondContact OD1-N 2.98Å; N459-G461 PolarHBondContact O-N 3.05Å; N459-G461 WeakPolarHBondContact OD1-CA 3.33Å; N459-G461 PolarHBondContact OD1-N 3.47Å; N459-H462 HydrophobicContact CB-CB 4.14Å; N459-H462 PolarHBondContact O-N 3.27Å; N459-H462 PolarHBondContact OD1-N 2.9Å; N459-L463 PolarHBondContact O-N 2.8Å; N459-L463 VanDerWaalsContact O-N 3.08Å
460	Y	97.2	Very high	97.8	Very high	21 Å²	21	26.8 Å²	26.8	8%	0.082	16%	0.158	C	C	.	.	H	α-helix	trans	-63.9	-40.3	-178.4	-174.6	-127.9	0	0	0	113.6	L308 E309 C311 E313 D314 L399 L463 K464	L308-Y460 HydrophobicContact CD1-CE2 4.27Å; L308-Y460 HydrophobicContact CD2-CE2 4.29Å; L308-Y460 HydrophobicContact CG-CE2 4.28Å; E309-Y460 VanDerWaalsContact O-CE2 3.27Å; E309-Y460 WeakPolarHBondContact O-CE2 3.44Å; C311-Y460 WeakPolarHBondContact SG-CD2 3.37Å; E313-Y460 HydrophobicContact CB-CD1 4.1Å; D314-Y460 HydrophobicContact CB-CE1 3.9Å; D314-Y460 PolarHBondContact OD2-OH 3.25Å; D314-Y460 VanDerWaalsContact OD2-OH 3.04Å; L399-Y460 HydrophobicContact CD1-CD2 3.95Å; L399-Y460 HydrophobicContact CD1-CG 4.22Å; Y460-L463 PolarHBondContact O-N 3.47Å; Y460-K464 HydrophobicContact CE1-CD 4.36Å; Y460-K464 VanDerWaalsContact O-CB 3.29Å; Y460-K464 WeakPolarHBondContact O-CB 3.38Å; Y460-K464 PolarHBondContact O-N 3.11Å
461	G	97.6	Very high	97.7	Very high	43 Å²	43	27.5 Å²	27.5	44%	0.443	16%	0.162	S	C	.	.	H	α-helix	trans	-62.5	-44	178.9	0	0	0	0	0	112.4	N459 K464 A465	N459-G461 PolarHBondContact O-N 3.05Å; N459-G461 WeakPolarHBondContact OD1-CA 3.33Å; N459-G461 PolarHBondContact OD1-N 3.47Å; G461-K464 PolarHBondContact O-N 3.1Å; G461-A465 WeakPolarHBondContact O-CB 3.27Å; G461-A465 PolarHBondContact O-N 2.79Å
462	H	98.1	Very high	97.6	Very high	62 Å²	62	31.9 Å²	31.9	29%	0.287	19%	0.185	S	C	.	.	H	α-helix	trans	-63.2	-47	174.2	-67.9	168.4	0	0	0	111.9	R423 N459 K464 A465 D466	R423-H462 HydrophobicContact CB-CB 4.17Å; R423-H462 PolarHBondContact NH1-CD2 3.16Å; R423-H462 PolarHBondContact NH1-NE2 2.71Å; N459-H462 HydrophobicContact CB-CB 4.14Å; N459-H462 PolarHBondContact O-N 3.27Å; N459-H462 PolarHBondContact OD1-N 2.9Å; H462-K464 VanDerWaalsContact C-N 3.31Å; H462-K464 PolarHBondContact O-N 3.41Å; H462-A465 PolarHBondContact O-N 2.79Å; H462-D466 WeakPolarHBondContact O-CB 3.37Å; H462-D466 VanDerWaalsContact O-CG 3.27Å; H462-D466 PolarHBondContact O-N 3.31Å
463	L	98.4	Very high	97.4	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-57.3	-45.4	177	-176.4	65.8	0	0	0	111.8	L308 L399 A401 L455 N457 N459 Y460 F467	L308-L463 HydrophobicContact CD1-CD2 3.72Å; L308-L463 HydrophobicContact CD1-CG 3.77Å; L399-L463 HydrophobicContact CB-CD2 3.6Å; A401-L463 HydrophobicContact CB-CD1 3.97Å; A401-L463 HydrophobicContact CB-CD2 4.48Å; A401-L463 HydrophobicContact CB-CG 4.27Å; L455-L463 HydrophobicContact CB-CD1 3.67Å; N457-L463 HydrophobicContact CB-CB 3.91Å; N457-L463 HydrophobicContact CB-CD1 4.23Å; N459-L463 PolarHBondContact O-N 2.8Å; N459-L463 VanDerWaalsContact O-N 3.08Å; Y460-L463 PolarHBondContact O-N 3.47Å; L463-F467 WeakPolarHBondContact O-CB 3.37Å; L463-F467 PolarHBondContact O-N 3.5Å
464	K	97.9	Very high	97.4	Very high	91 Å²	91	39.3 Å²	39.3	40%	0.396	22%	0.219	S	C	.	.	H	α-helix	trans	-65.8	-40.2	179.9	-174.4	172.7	-178.2	171.6	0	111.9	L308 Y460 G461 H462 T468	L308-K464 HydrophobicContact CD2-CB 4.23Å; L308-K464 HydrophobicContact CD2-CG 3.99Å; Y460-K464 HydrophobicContact CE1-CD 4.36Å; Y460-K464 VanDerWaalsContact O-CB 3.29Å; Y460-K464 WeakPolarHBondContact O-CB 3.38Å; Y460-K464 PolarHBondContact O-N 3.11Å; G461-K464 PolarHBondContact O-N 3.1Å; H462-K464 VanDerWaalsContact C-N 3.31Å; H462-K464 PolarHBondContact O-N 3.41Å; K464-T468 WeakPolarHBondContact O-CB 3.44Å; K464-T468 PolarHBondContact O-N 3.08Å; K464-T468 PolarHBondContact O-OG1 3.06Å
465	A	98.2	Very high	97.3	Very high	53 Å²	53	42.6 Å²	42.6	44%	0.438	24%	0.235	S	C	.	.	H	α-helix	trans	-63.7	-52.4	175.1	0	0	0	0	0	111.2	G461 H462 F467 T468 T469	G461-A465 WeakPolarHBondContact O-CB 3.27Å; G461-A465 PolarHBondContact O-N 2.79Å; H462-A465 PolarHBondContact O-N 2.79Å; A465-F467 VanDerWaalsContact C-N 3.35Å; A465-F467 PolarHBondContact O-N 2.91Å; A465-T468 WeakPolarHBondContact O-CA 3.34Å; A465-T468 WeakPolarHBondContact O-CB 3.35Å; A465-T468 PolarHBondContact O-N 3.4Å; A465-T469 PolarHBondContact O-N 3.31Å; A465-T469 PolarHBondContact O-OG1 2.91Å
466	D	98.5	Very high	97.3	Very high	8 Å²	8	42.6 Å²	42.6	4%	0.043	24%	0.235	C	C	.	.	H	α-helix	trans	-60.6	-42.9	178.9	-68.5	-25.5	0	0	0	112.2	L422 R423 S424 L455 H462 T468 T469 C470	L422-D466 WeakPolarHBondContact CA-OD1 3.41Å; L422-D466 HydrophobicContact CD2-CB 3.79Å; R423-D466 WeakPolarHBondContact CA-OD2 3.32Å; R423-D466 VanDerWaalsContact N-CG 3.33Å; R423-D466 PolarHBondContact N-OD1 2.68Å; R423-D466 PolarHBondContact N-OD2 3.01Å; S424-D466 WeakPolarHBondContact CA-OD2 3.37Å; S424-D466 WeakPolarHBondContact CB-OD2 3.32Å; S424-D466 PolarHBondContact N-OD2 3.33Å; S424-D466 PolarHBondContact OG-OD2 3.33Å; L455-D466 HydrophobicContact CD1-CB 4.45Å; H462-D466 WeakPolarHBondContact O-CB 3.37Å; H462-D466 VanDerWaalsContact O-CG 3.27Å; H462-D466 PolarHBondContact O-N 3.31Å; D466-T468 VanDerWaalsContact C-N 3.26Å; D466-T468 PolarHBondContact O-N 3.42Å; D466-T469 PolarHBondContact O-N 3.43Å; D466-C470 PolarHBondContact O-N 2.91Å; D466-C470 PolarHBondContact O-SG 3.32Å; D466-C470 VanDerWaalsContact O-SG 3.38Å
467	F	98.3	Very high	97.2	Very high	10 Å²	10	42.6 Å²	42.6	4%	0.044	23%	0.234	C	C	.	.	H	α-helix	trans	-57.4	-41.6	173.4	177.3	-96.9	0	0	0	111.6	R292 A306 L308 A401 I403 L455 L463 A465 M471	R292-F467 HydrophobicContact CB-CE1 4.08Å; R292-F467 HydrophobicContact CB-CZ 3.97Å; R292-F467 HydrophobicContact CG-CE1 4.47Å; A306-F467 HydrophobicContact CB-CE2 3.64Å; A306-F467 HydrophobicContact CB-CZ 3.54Å; L308-F467 HydrophobicContact CB-CD1 4.3Å; L308-F467 HydrophobicContact CB-CD2 4.43Å; L308-F467 HydrophobicContact CB-CE1 4.15Å; L308-F467 HydrophobicContact CB-CE2 4.26Å; L308-F467 HydrophobicContact CB-CG 4.43Å; L308-F467 HydrophobicContact CB-CZ 4.11Å; L308-F467 HydrophobicContact CD2-CD1 4.43Å; A401-F467 HydrophobicContact CB-CD2 3.66Å; A401-F467 HydrophobicContact CB-CE2 4.25Å; A401-F467 HydrophobicContact CB-CG 4.41Å; I403-F467 HydrophobicContact CD1-CD2 4.23Å; I403-F467 HydrophobicContact CG1-CD2 4.15Å; I403-F467 HydrophobicContact CG1-CE2 4.05Å; L455-F467 HydrophobicContact CD1-CB 4.17Å; L463-F467 WeakPolarHBondContact O-CB 3.37Å; L463-F467 PolarHBondContact O-N 3.5Å; A465-F467 VanDerWaalsContact C-N 3.35Å; A465-F467 PolarHBondContact O-N 2.91Å; F467-M471 HydrophobicContact CD1-CG 4.41Å; F467-M471 HydrophobicContact CE1-CG 4.15Å; F467-M471 HydrophobicContact CE2-CG 4.44Å; F467-M471 HydrophobicContact CZ-CG 4.19Å; F467-M471 WeakPolarHBondContact O-CB 3.44Å; F467-M471 WeakPolarHBondContact O-CG 3.49Å; F467-M471 PolarHBondContact O-N 2.97Å
468	T	97.4	Very high	97.2	Very high	60 Å²	60	45.6 Å²	45.6	37%	0.368	25%	0.248	S	C	.	.	H	α-helix	trans	-67.1	-45.5	178.4	-59.3	0	0	0	0	111.3	K464 A465 D466 M471 N472	K464-T468 WeakPolarHBondContact O-CB 3.44Å; K464-T468 PolarHBondContact O-N 3.08Å; K464-T468 PolarHBondContact O-OG1 3.06Å; A465-T468 WeakPolarHBondContact O-CA 3.34Å; A465-T468 WeakPolarHBondContact O-CB 3.35Å; A465-T468 PolarHBondContact O-N 3.4Å; D466-T468 VanDerWaalsContact C-N 3.26Å; D466-T468 PolarHBondContact O-N 3.42Å; T468-M471 PolarHBondContact O-N 2.88Å; T468-M471 VanDerWaalsContact O-N 3.15Å; T468-N472 VanDerWaalsContact CG2-ND2 3.31Å; T468-N472 WeakPolarHBondContact CG2-ND2 3.23Å; T468-N472 WeakPolarHBondContact O-CB 3.19Å; T468-N472 PolarHBondContact O-N 2.65Å
469	T	97.7	Very high	97.2	Very high	32 Å²	32	44 Å²	44	20%	0.196	24%	0.236	C	C	.	.	H	α-helix	trans	-57	-50.4	174.7	-63.4	0	0	0	0	110.8	L422 A465 D466 M471 N472 E473 Y474	L422-T469 HydrophobicContact CD2-CG2 4.11Å; A465-T469 PolarHBondContact O-N 3.31Å; A465-T469 PolarHBondContact O-OG1 2.91Å; D466-T469 PolarHBondContact O-N 3.43Å; T469-M471 VanDerWaalsContact C-N 3.25Å; T469-M471 PolarHBondContact O-N 3.1Å; T469-N472 PolarHBondContact O-N 3.42Å; T469-E473 HydrophobicContact CG2-CB 4.44Å; T469-E473 WeakPolarHBondContact O-CB 3.46Å; T469-E473 PolarHBondContact O-N 3.35Å; T469-Y474 PolarHBondContact O-N 2.96Å
470	C	97.7	Very high	97.2	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.5	-37.1	177.4	-68.8	0	0	0	0	112.5	I403 Y405 L453 D466	I403-C470 HydrophobicContact CD1-CB 3.26Å; Y405-C470 PolarHBondContact OH-O 2.9Å; L453-C470 HydrophobicContact CD1-CB 4.41Å; D466-C470 PolarHBondContact O-N 2.91Å; D466-C470 PolarHBondContact O-SG 3.32Å; D466-C470 VanDerWaalsContact O-SG 3.38Å
471	M	95.9	Very high	96.9	Very high	15 Å²	15	53.4 Å²	53.4	7%	0.074	28%	0.279	C	S	.	.	H	α-helix	trans	-77.9	-26.6	-176.4	-75.9	-57.3	-57.9	0	0	115.3	R292 P304 A306 I403 F467 T468 T469	R292-M471 HydrophobicContact CB-CE 4.37Å; R292-M471 HydrophobicContact CG-CE 4Å; P304-M471 HydrophobicContact CB-CE 3.89Å; P304-M471 HydrophobicContact CB-SD 3.98Å; P304-M471 HydrophobicContact CG-CE 4.28Å; A306-M471 HydrophobicContact CB-CE 3.74Å; A306-M471 HydrophobicContact CB-CG 4.05Å; A306-M471 HydrophobicContact CB-SD 3.18Å; A306-M471 WeakPolarHBondContact CB-SD 3.2Å; I403-M471 HydrophobicContact CB-SD 4.49Å; I403-M471 HydrophobicContact CD1-CG 4.05Å; I403-M471 HydrophobicContact CD1-SD 3.93Å; I403-M471 HydrophobicContact CG1-SD 4.04Å; I403-M471 HydrophobicContact CG2-SD 3.65Å; F467-M471 HydrophobicContact CD1-CG 4.41Å; F467-M471 HydrophobicContact CE1-CG 4.15Å; F467-M471 HydrophobicContact CE2-CG 4.44Å; F467-M471 HydrophobicContact CZ-CG 4.19Å; F467-M471 WeakPolarHBondContact O-CB 3.44Å; F467-M471 WeakPolarHBondContact O-CG 3.49Å; F467-M471 PolarHBondContact O-N 2.97Å; T468-M471 PolarHBondContact O-N 2.88Å; T468-M471 VanDerWaalsContact O-N 3.15Å; T469-M471 VanDerWaalsContact C-N 3.25Å; T469-M471 PolarHBondContact O-N 3.1Å
472	N	94.8	Very high	96.2	Very high	92 Å²	92	58.2 Å²	58.2	49%	0.492	29%	0.294	S	S	.	.	H	α-helix	trans	-112.3	-28.8	-171.8	-63.2	-21.5	0	0	0	113.4	T468 T469	T468-N472 VanDerWaalsContact CG2-ND2 3.31Å; T468-N472 WeakPolarHBondContact CG2-ND2 3.23Å; T468-N472 WeakPolarHBondContact O-CB 3.19Å; T468-N472 PolarHBondContact O-N 2.65Å; T469-N472 PolarHBondContact O-N 3.42Å
473	E	95.1	Very high	96.1	Very high	148 Å²	148	58.1 Å²	58.1	69%	0.692	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.2	-23	-168.2	-61.6	166.5	-140	0	0	112.9	T469	T469-E473 HydrophobicContact CG2-CB 4.44Å; T469-E473 WeakPolarHBondContact O-CB 3.46Å; T469-E473 PolarHBondContact O-N 3.35Å
474	Y	96.4	Very high	96	Very high	20 Å²	20	61.1 Å²	61.1	8%	0.078	31%	0.31	C	S	.	.			trans	-94.4	114.1	-175.5	177.9	-123.1	0	0	0	112.7	Y405 R416 Q417 P419 L451 L453 T469 P476	Y405-Y474 HydrophobicContact CE2-CD1 4.35Å; Y405-Y474 HydrophobicContact CE2-CE1 4.4Å; Y405-Y474 AromaticContact CZ-CD1 3.89Å; Y405-Y474 WeakPolarHBondContact OH-CD1 3.18Å; R416-Y474 HydrophobicContact CB-CE2 4.4Å; R416-Y474 PolarHBondContact O-OH 3.02Å; Q417-Y474 VanDerWaalsContact O-CE2 3.27Å; Q417-Y474 WeakPolarHBondContact O-CE2 3.46Å; P419-Y474 HydrophobicContact CG-CD2 4.28Å; L451-Y474 HydrophobicContact CD2-CE1 3.85Å; L453-Y474 HydrophobicContact CD1-CD1 3.98Å; L453-Y474 HydrophobicContact CD1-CE1 3.75Å; T469-Y474 PolarHBondContact O-N 2.96Å; Y474-P476 HydrophobicContact CE1-CB 3.8Å
475	E	96.5	Very high	95.9	Very high	70 Å²	70	59.4 Å²	59.4	33%	0.327	31%	0.305	S	S	.	.			trans	-101.7	109.6	168.9	-171.1	69.1	-155	0	0	109.3	R408 R416	R408-E475 IonicContact CZ-OE1 3.19Å; R408-E475 IonicContact NH1-OE1 2.8Å; R408-E475 PolarHBondContact NH1-OE1 3.45Å; R408-E475 IonicContact NH2-OE1 2.78Å; R408-E475 PolarHBondContact NH2-OE1 3.23Å; R408-E475 IonicContact NH2-OE2 2.72Å; R408-E475 PolarHBondContact NH2-OE2 3.41Å; R416-E475 WeakPolarHBondContact CD-O 3.5Å
476	P	97.5	Very high	95.7	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.298	C	S	.	.			trans	-73.9	-28.2	-169.4	26.1	-35.6	0	0	0	114.9	Y405 R416 W430 L451 Y474	Y405-P476 HydrophobicContact CD1-CG 3.49Å; Y405-P476 VanDerWaalsContact CD1-CG 3.49Å; Y405-P476 HydrophobicContact CD2-CG 4.26Å; Y405-P476 HydrophobicContact CE1-CG 4Å; Y405-P476 HydrophobicContact CG-CG 3.65Å; R416-P476 PolarHBondContact N-O 2.8Å; W430-P476 HydrophobicContact CH2-CB 3.6Å; W430-P476 WeakPolarHBondContact CH2-O 3.43Å; W430-P476 HydrophobicContact CZ3-CB 4.17Å; L451-P476 HydrophobicContact CD2-CB 3.56Å; L451-P476 HydrophobicContact CD2-CG 4.37Å; Y474-P476 HydrophobicContact CE1-CB 3.8Å
477	F	97.6	Very high	95.6	Very high	5 Å²	5	63.1 Å²	63.1	2%	0.022	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	158.5	-175.2	58	-94.9	0	0	0	110.7	P406 I412 S414 I415 W430 A450 I479	P406-F477 VanDerWaalsContact O-CZ 3.24Å; P406-F477 WeakPolarHBondContact O-CZ 3.29Å; I412-F477 HydrophobicContact CD1-CB 4.49Å; I412-F477 HydrophobicContact CD1-CD2 3.62Å; I412-F477 HydrophobicContact CD1-CE2 4.13Å; I412-F477 HydrophobicContact CD1-CG 4.09Å; I412-F477 HydrophobicContact CG2-CB 4.47Å; S414-F477 VanDerWaalsContact O-CA 3.23Å; S414-F477 WeakPolarHBondContact O-CA 3.49Å; S414-F477 WeakPolarHBondContact O-CB 3.27Å; I415-F477 HydrophobicContact CG1-CB 4.46Å; W430-F477 HydrophobicContact CZ3-CB 4.48Å; W430-F477 HydrophobicContact CZ3-CD1 4.32Å; A450-F477 HydrophobicContact CB-CD1 3.81Å; A450-F477 HydrophobicContact CB-CE1 3.28Å; A450-F477 HydrophobicContact CB-CZ 3.91Å; F477-I479 HydrophobicContact CD2-CD1 3.96Å; F477-I479 HydrophobicContact CD2-CG1 3.91Å; F477-I479 HydrophobicContact CE2-CD1 3.46Å; F477-I479 VanDerWaalsContact CE2-CD1 3.46Å; F477-I479 HydrophobicContact CE2-CG1 3.95Å
478	E	97.6	Very high	95.4	Very high	82 Å²	82	66.6 Å²	66.6	38%	0.383	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	152.7	172	-66.5	168	172.5	0	0	110.5	I412 T413 S414 R416	I412-E478 WeakPolarHBondContact CA-O 3.24Å; T413-E478 PolarHBondContact N-O 2.93Å; T413-E478 VanDerWaalsContact OG1-CB 3.23Å; T413-E478 WeakPolarHBondContact OG1-CB 3.4Å; T413-E478 PolarHBondContact OG1-O 3.5Å; S414-E478 PolarHBondContact O-N 2.93Å; S414-E478 VanDerWaalsContact O-N 3.14Å; S414-E478 WeakPolarHBondContact OG-CB 3.43Å; S414-E478 WeakPolarHBondContact OG-CG 3.47Å; S414-E478 PolarHBondContact OG-OE2 3.24Å; R416-E478 IonicContact CZ-OE1 3.43Å; R416-E478 IonicContact NE-OE1 3.61Å; R416-E478 IonicContact NH2-OE1 2.66Å; R416-E478 PolarHBondContact NH2-OE1 3.15Å
479	I	96.8	Very high	95.2	Very high	39 Å²	39	67.1 Å²	67.1	20%	0.2	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.6	179.2	-75	169.3	0	0	0	109.7	R408 R409 V411 I412 F477 K481	R408-I479 HydrophobicContact CB-CD1 3.54Å; R408-I479 HydrophobicContact CG-CD1 4.15Å; R408-I479 VanDerWaalsContact O-CD1 3.32Å; R408-I479 WeakPolarHBondContact O-CD1 3.42Å; R409-I479 WeakPolarHBondContact O-CG2 3.39Å; V411-I479 WeakPolarHBondContact O-CA 3.47Å; I412-I479 HydrophobicContact CD1-CD1 4.17Å; I412-I479 HydrophobicContact CD1-CG1 3.82Å; F477-I479 HydrophobicContact CD2-CD1 3.96Å; F477-I479 HydrophobicContact CD2-CG1 3.91Å; F477-I479 HydrophobicContact CE2-CD1 3.46Å; F477-I479 VanDerWaalsContact CE2-CD1 3.46Å; F477-I479 HydrophobicContact CE2-CG1 3.95Å; I479-K481 PolarHBondContact O-N 2.87Å
480	L	96.3	Very high	95.1	Very high	115 Å²	115	69.8 Å²	69.8	60%	0.602	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	113.4	159.4	-175.3	65	0	0	0	108	G410 V411 T413	G410-L480 WeakPolarHBondContact CA-O 3.38Å; V411-L480 PolarHBondContact N-O 2.99Å; V411-L480 PolarHBondContact O-N 2.6Å; T413-L480 HydrophobicContact CG2-CB 3.63Å
481	K	89.9	Confident	94.8	Very high	177 Å²	177	75.6 Å²	75.6	77%	0.77	37%	0.367	S	S	*	.			trans	-69.4	143.8	177	-66.5	-177.2	-179	177	0	109.6	I479	I479-K481 PolarHBondContact O-N 2.87Å
482	D	83.6	Confident	94.7	Very high	144 Å²	144	81.1 Å²	81.1	77%	0.77	39%	0.394	S	S	*	.			trans	-61.8	0	170.7	-71.1	-40.2	0	0	0	112.3	R437	R437-D482 IonicContact CZ-OD1 3.1Å; R437-D482 IonicContact NH1-OD1 3.44Å; R437-D482 PolarHBondContact NH1-OD1 3.4Å; R437-D482 IonicContact NH1-OD2 2.71Å; R437-D482 PolarHBondContact NH1-OD2 2.71Å; R437-D482 IonicContact NH2-OD1 2.79Å; R437-D482 PolarHBondContact NH2-OD1 2.94Å

Retrieved 482 of 482 residues in 321.5 ms (Link to these results)

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