A0A3Q0KGV0_SCHMA Loading...

Putative tgf-beta family

AlphaFold DB , UniProt , Accession A0A3Q0KGV0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 546 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	43.1	Very low	49.1	Very low	217 Å²	217	132.5 Å²	132.5	100%	1.069	69%	0.685	S	S	*	*				0	-29.9	0	-85.4	-170.5	-151.9	0	0	114.2	I3 K4	M1-I3 VanDerWaalsContact C-N 3.31Å; M1-I3 PolarHBondContact O-N 3.34Å; M1-K4 PolarHBondContact O-N 2.95Å
2	I	47.2	Very low	49.7	Very low	161 Å²	161	128.4 Å²	128.4	83%	0.826	67%	0.673	S	S	*	*	H	α-helix	trans	-64.7	-29.6	-174.6	-63.3	168	0	0	0	113.6
3	I	47.6	Very low	50.7	Low	152 Å²	152	130.2 Å²	130.2	78%	0.779	67%	0.665	S	S	*	*	H	α-helix	trans	-78.8	-19.8	-179	-60.6	169.2	0	0	0	113	M1 S6	M1-I3 VanDerWaalsContact C-N 3.31Å; M1-I3 PolarHBondContact O-N 3.34Å; I3-S6 PolarHBondContact O-OG 3.11Å
4	K	44.7	Very low	50.9	Low	176 Å²	176	127.9 Å²	127.9	77%	0.765	66%	0.655	S	S	*	*	H	α-helix	trans	-79.9	-21.6	-179	-95.8	-174.9	174	-178	0	114	M1	M1-K4 PolarHBondContact O-N 2.95Å
5	N	48.6	Very low	51.4	Low	113 Å²	113	128.4 Å²	128.4	60%	0.604	65%	0.653	S	S	*	*	H	α-helix	trans	-89.2	-18.5	-175.5	-81.9	1.8	0	0	0	114.7
6	S	50.3	Low	52.3	Low	71 Å²	71	130.4 Å²	130.4	50%	0.497	65%	0.652	S	S	.	*	H	α-helix	trans	-76.4	-27.1	178.1	53.3	0	0	0	0	113.2	I3 L8	I3-S6 PolarHBondContact O-OG 3.11Å; S6-L8 VanDerWaalsContact C-N 3.34Å; S6-L8 PolarHBondContact O-N 2.87Å
7	A	48	Very low	53.1	Low	56 Å²	56	131.8 Å²	131.8	46%	0.463	65%	0.647	S	S	.	*	H	α-helix	trans	-69.9	-29.4	-179.8	0	0	0	0	0	113.2	F9	A7-F9 PolarHBondContact O-N 2.73Å
8	L	51.4	Low	53.8	Low	122 Å²	122	129.7 Å²	129.7	64%	0.639	64%	0.639	S	S	*	*	H	α-helix	trans	-73.9	-24.1	-177.5	-85.5	154.1	0	0	0	113.5	S6 P12	S6-L8 VanDerWaalsContact C-N 3.34Å; S6-L8 PolarHBondContact O-N 2.87Å; L8-P12 WeakPolarHBondContact O-CD 3.19Å
9	F	52.5	Low	54.2	Low	172 Å²	172	128.4 Å²	128.4	75%	0.754	63%	0.634	S	S	*	*	H	α-helix	trans	-87.5	-19.5	177.6	-77	-76.5	0	0	0	114.1	A7	A7-F9 PolarHBondContact O-N 2.73Å
10	L	51	Low	54.8	Low	104 Å²	104	126.7 Å²	126.7	55%	0.545	63%	0.627	S	S	.	*	H	α-helix	trans	-82.7	-30.2	-177.7	-72	169.2	0	0	0	113.3	W13 L14	L10-W13 PolarHBondContact O-N 2.94Å; L10-L14 WeakPolarHBondContact O-CB 3.38Å; L10-L14 PolarHBondContact O-N 3.14Å
11	L	55.3	Low	55.2	Low	114 Å²	114	128.1 Å²	128.1	60%	0.597	63%	0.63	S	S	*	*	H	α-helix	trans	-64	-49.7	-176.9	-86.7	151.3	0	0	0	113.6	W13 L14 Q15	L11-W13 VanDerWaalsContact C-N 3.3Å; L11-W13 PolarHBondContact O-N 3.22Å; L11-L14 PolarHBondContact O-N 2.87Å; L11-Q15 WeakPolarHBondContact O-CB 3.31Å; L11-Q15 PolarHBondContact O-N 3.45Å; L11-Q15 VanDerWaalsContact O-N 3.1Å
12	P	56.4	Low	56.2	Low	83 Å²	83	121.5 Å²	121.5	54%	0.539	60%	0.598	S	S	.	*	H	α-helix	trans	-64.6	-36.3	177.1	-20.5	32.6	0	0	0	112.4	L8 Q15 Y16	L8-P12 WeakPolarHBondContact O-CD 3.19Å; P12-Q15 PolarHBondContact O-N 3.4Å; P12-Y16 PolarHBondContact O-N 3.26Å
13	W	62.5	Low	56.8	Low	151 Å²	151	121.7 Å²	121.7	57%	0.572	59%	0.593	S	S	*	*	H	α-helix	trans	-69.5	-39.5	-177.8	-154.6	80.4	0	0	0	112.2	L10 L11 R17	L10-W13 PolarHBondContact O-N 2.94Å; L11-W13 VanDerWaalsContact C-N 3.3Å; L11-W13 PolarHBondContact O-N 3.22Å; W13-R17 PolarHBondContact O-N 3.45Å; W13-R17 VanDerWaalsContact O-N 3.16Å
14	L	53.8	Low	57.5	Low	99 Å²	99	121.1 Å²	121.1	52%	0.518	59%	0.585	S	S	.	*	H	α-helix	trans	-64.3	-43.6	171.7	-93.6	153.6	0	0	0	112	L10 L11 Y16 R17 I18	L10-L14 WeakPolarHBondContact O-CB 3.38Å; L10-L14 PolarHBondContact O-N 3.14Å; L11-L14 PolarHBondContact O-N 2.87Å; L14-Y16 VanDerWaalsContact C-N 3.35Å; L14-Y16 PolarHBondContact O-N 3.46Å; L14-R17 PolarHBondContact O-N 3Å; L14-I18 WeakPolarHBondContact O-CG1 3.44Å; L14-I18 PolarHBondContact O-N 3.43Å
15	Q	58.3	Low	57.9	Low	135 Å²	135	117.9 Å²	117.9	63%	0.631	58%	0.576	S	S	*	*	H	α-helix	trans	-65.6	-37.9	-179.1	-163.2	157.5	-6.1	0	0	112.1	L11 P12 N19	L11-Q15 WeakPolarHBondContact O-CB 3.31Å; L11-Q15 PolarHBondContact O-N 3.45Å; L11-Q15 VanDerWaalsContact O-N 3.1Å; P12-Q15 PolarHBondContact O-N 3.4Å; Q15-N19 PolarHBondContact O-N 2.82Å; Q15-N19 VanDerWaalsContact O-N 3.08Å
16	Y	66.3	Low	58.3	Low	161 Å²	161	117.2 Å²	117.2	63%	0.631	57%	0.572	S	S	*	*	H	α-helix	trans	-63.7	-44.4	172.7	-175.1	-106.6	0	0	0	112.5	P12 L14 I18 N19 L20	P12-Y16 PolarHBondContact O-N 3.26Å; L14-Y16 VanDerWaalsContact C-N 3.35Å; L14-Y16 PolarHBondContact O-N 3.46Å; Y16-I18 PolarHBondContact O-N 3.39Å; Y16-N19 PolarHBondContact O-N 3.39Å; Y16-L20 HydrophobicContact CD1-CD1 3.83Å; Y16-L20 HydrophobicContact CD2-CD1 4.33Å; Y16-L20 HydrophobicContact CE1-CD1 3.25Å; Y16-L20 HydrophobicContact CE2-CD1 3.82Å; Y16-L20 HydrophobicContact CG-CD1 4.34Å; Y16-L20 PolarHBondContact O-N 3Å; Y16-L20 WeakPolarHBondContact OH-CD1 3.18Å
17	R	65.9	Low	59	Low	153 Å²	153	118.3 Å²	118.3	58%	0.577	57%	0.572	S	S	*	*	H	α-helix	trans	-64.5	-38.1	177.4	-97.5	-164.4	173.3	-170	0.2	113.2	W13 L14 K21	W13-R17 PolarHBondContact O-N 3.45Å; W13-R17 VanDerWaalsContact O-N 3.16Å; L14-R17 PolarHBondContact O-N 3Å; R17-K21 PolarHBondContact O-N 2.85Å
18	I	64.7	Low	59.7	Low	95 Å²	95	120.1 Å²	120.1	49%	0.487	57%	0.571	S	S	.	*	H	α-helix	trans	-65	-46.2	176.4	-68.8	164.2	0	0	0	109.8	L14 Y16 L20 K21 I22	L14-I18 WeakPolarHBondContact O-CG1 3.44Å; L14-I18 PolarHBondContact O-N 3.43Å; Y16-I18 PolarHBondContact O-N 3.39Å; I18-L20 VanDerWaalsContact C-N 3.34Å; I18-L20 PolarHBondContact O-N 2.71Å; I18-K21 PolarHBondContact O-N 3.23Å; I18-I22 HydrophobicContact CG2-CD1 3.64Å; I18-I22 HydrophobicContact CG2-CG1 4.33Å; I18-I22 VanDerWaalsContact O-CG1 3.32Å; I18-I22 WeakPolarHBondContact O-CG1 3.44Å; I18-I22 PolarHBondContact O-N 3.48Å
19	N	62.9	Low	60.2	Low	105 Å²	105	119.6 Å²	119.6	56%	0.561	57%	0.568	S	S	*	*	H	α-helix	trans	-63.5	-39.3	179.6	-119.9	-15.9	0	0	0	112.3	Q15 Y16 I22 K23	Q15-N19 PolarHBondContact O-N 2.82Å; Q15-N19 VanDerWaalsContact O-N 3.08Å; Y16-N19 PolarHBondContact O-N 3.39Å; N19-I22 PolarHBondContact O-N 3.43Å; N19-K23 WeakPolarHBondContact O-CB 3.28Å; N19-K23 PolarHBondContact O-N 2.94Å
20	L	65.7	Low	61	Low	94 Å²	94	115.8 Å²	115.8	49%	0.492	56%	0.555	S	S	.	*	H	α-helix	trans	-64	-42.6	174.5	-113.6	122.2	0	0	0	112.3	Y16 I18 K23 F24	Y16-L20 HydrophobicContact CD1-CD1 3.83Å; Y16-L20 HydrophobicContact CD2-CD1 4.33Å; Y16-L20 HydrophobicContact CE1-CD1 3.25Å; Y16-L20 HydrophobicContact CE2-CD1 3.82Å; Y16-L20 HydrophobicContact CG-CD1 4.34Å; Y16-L20 PolarHBondContact O-N 3Å; Y16-L20 WeakPolarHBondContact OH-CD1 3.18Å; I18-L20 VanDerWaalsContact C-N 3.34Å; I18-L20 PolarHBondContact O-N 2.71Å; L20-K23 PolarHBondContact O-N 2.99Å; L20-F24 WeakPolarHBondContact O-CB 3.11Å; L20-F24 PolarHBondContact O-N 3.27Å
21	K	63.3	Low	62	Low	156 Å²	156	114.8 Å²	114.8	68%	0.678	55%	0.55	S	S	*	.	H	α-helix	trans	-64.3	-41.1	175.5	-83.8	-172.2	173.1	-174.5	0	112.2	R17 I18 F24 L25	R17-K21 PolarHBondContact O-N 2.85Å; I18-K21 PolarHBondContact O-N 3.23Å; K21-F24 PolarHBondContact O-N 3.45Å; K21-L25 WeakPolarHBondContact O-CB 3.32Å; K21-L25 WeakPolarHBondContact O-CG 3.43Å; K21-L25 PolarHBondContact O-N 3.49Å
22	I	63.1	Low	62.9	Low	79 Å²	79	116.1 Å²	116.1	41%	0.405	55%	0.551	S	S	.	*	H	α-helix	trans	-63.4	-45.6	176.5	-70.4	168.7	0	0	0	110.3	I18 N19 F24 L25 L26	I18-I22 HydrophobicContact CG2-CD1 3.64Å; I18-I22 HydrophobicContact CG2-CG1 4.33Å; I18-I22 VanDerWaalsContact O-CG1 3.32Å; I18-I22 WeakPolarHBondContact O-CG1 3.44Å; I18-I22 PolarHBondContact O-N 3.48Å; N19-I22 PolarHBondContact O-N 3.43Å; I22-F24 VanDerWaalsContact C-N 3.32Å; I22-F24 PolarHBondContact O-N 3.13Å; I22-L25 PolarHBondContact O-N 3.47Å; I22-L26 HydrophobicContact CG2-CD1 3.73Å; I22-L26 WeakPolarHBondContact O-CB 3.11Å; I22-L26 PolarHBondContact O-N 2.97Å
23	K	60.7	Low	63.7	Low	165 Å²	165	119 Å²	119	72%	0.717	56%	0.555	S	S	*	*	H	α-helix	trans	-63.8	-37.7	178	-149.6	175.1	-171.9	-178.8	0	111.8	N19 L20 N27	N19-K23 WeakPolarHBondContact O-CB 3.28Å; N19-K23 PolarHBondContact O-N 2.94Å; L20-K23 PolarHBondContact O-N 2.99Å; K23-N27 WeakPolarHBondContact O-CB 3.3Å; K23-N27 PolarHBondContact O-N 2.99Å
24	F	62.8	Low	64.3	Low	139 Å²	139	116.5 Å²	116.5	61%	0.61	55%	0.552	S	S	*	*	H	α-helix	trans	-68	-41.1	174.9	-163.8	-91.9	0	0	0	112.4	L20 K21 I22 N27 Q28	L20-F24 WeakPolarHBondContact O-CB 3.11Å; L20-F24 PolarHBondContact O-N 3.27Å; K21-F24 PolarHBondContact O-N 3.45Å; I22-F24 VanDerWaalsContact C-N 3.32Å; I22-F24 PolarHBondContact O-N 3.13Å; F24-N27 PolarHBondContact O-N 3.48Å; F24-Q28 HydrophobicContact CD1-CG 4.26Å; F24-Q28 HydrophobicContact CE1-CG 4.11Å; F24-Q28 WeakPolarHBondContact O-CG 3.35Å; F24-Q28 PolarHBondContact O-N 3.02Å
25	L	52.9	Low	65.2	Low	109 Å²	109	116.4 Å²	116.4	57%	0.571	55%	0.551	S	S	*	*	H	α-helix	trans	-65.5	-41.4	175	-80	161.6	0	0	0	112.2	K21 I22 N27 Q28 L29	K21-L25 WeakPolarHBondContact O-CB 3.32Å; K21-L25 WeakPolarHBondContact O-CG 3.43Å; K21-L25 PolarHBondContact O-N 3.49Å; I22-L25 PolarHBondContact O-N 3.47Å; L25-N27 VanDerWaalsContact C-N 3.33Å; L25-Q28 PolarHBondContact O-N 3.31Å; L25-L29 PolarHBondContact O-N 2.85Å
26	L	55.5	Low	66.1	Low	99 Å²	99	115.2 Å²	115.2	52%	0.518	55%	0.548	S	S	.	.	H	α-helix	trans	-62.6	-39.6	173.4	-95.5	144.3	0	0	0	111.8	I22 L29 N30	I22-L26 HydrophobicContact CG2-CD1 3.73Å; I22-L26 WeakPolarHBondContact O-CB 3.11Å; I22-L26 PolarHBondContact O-N 2.97Å; L26-L29 PolarHBondContact O-N 2.87Å; L26-N30 PolarHBondContact O-N 3.03Å
27	N	66.5	Low	66.5	Low	93 Å²	93	112 Å²	112	50%	0.497	54%	0.542	S	S	.	.	H	α-helix	trans	-68.1	-40.5	176.9	-157.2	27.8	0	0	0	111.8	K23 F24 L25 L29 N30 I31	K23-N27 WeakPolarHBondContact O-CB 3.3Å; K23-N27 PolarHBondContact O-N 2.99Å; F24-N27 PolarHBondContact O-N 3.48Å; L25-N27 VanDerWaalsContact C-N 3.33Å; N27-L29 VanDerWaalsContact C-N 3.32Å; N27-L29 PolarHBondContact O-N 2.89Å; N27-N30 PolarHBondContact O-N 3.41Å; N27-I31 VanDerWaalsContact O-CG1 3.26Å; N27-I31 WeakPolarHBondContact O-CG1 3.5Å; N27-I31 PolarHBondContact O-N 3.14Å
28	Q	61.1	Low	67.1	Low	95 Å²	95	108.6 Å²	108.6	44%	0.444	53%	0.534	S	S	.	.	H	α-helix	trans	-59.9	-40.1	172.1	-81.9	-97	-24.7	0	0	112.5	F24 L25 K32	F24-Q28 HydrophobicContact CD1-CG 4.26Å; F24-Q28 HydrophobicContact CE1-CG 4.11Å; F24-Q28 WeakPolarHBondContact O-CG 3.35Å; F24-Q28 PolarHBondContact O-N 3.02Å; L25-Q28 PolarHBondContact O-N 3.31Å; Q28-K32 PolarHBondContact O-N 3.31Å; Q28-K32 VanDerWaalsContact O-N 3.07Å
29	L	62	Low	67.8	Low	110 Å²	110	108.4 Å²	108.4	58%	0.576	53%	0.533	S	S	*	.	H	α-helix	trans	-64.6	-44.5	174.7	-96.7	145.2	0	0	0	112	L25 L26 N27 K32 F33	L25-L29 PolarHBondContact O-N 2.85Å; L26-L29 PolarHBondContact O-N 2.87Å; N27-L29 VanDerWaalsContact C-N 3.32Å; N27-L29 PolarHBondContact O-N 2.89Å; L29-K32 PolarHBondContact O-N 3.2Å; L29-F33 PolarHBondContact O-N 3.23Å
30	N	70.7	Confident	68.4	Low	93 Å²	93	107.7 Å²	107.7	50%	0.497	53%	0.529	S	S	.	.	H	α-helix	trans	-63.9	-42.2	176.5	-84.5	-8.2	0	0	0	112.2	L26 N27 K32 F33 I34	L26-N30 PolarHBondContact O-N 3.03Å; N27-N30 PolarHBondContact O-N 3.41Å; N30-K32 VanDerWaalsContact C-N 3.34Å; N30-K32 PolarHBondContact O-N 3.42Å; N30-F33 PolarHBondContact O-N 2.85Å; N30-I34 WeakPolarHBondContact O-CD1 3.44Å; N30-I34 VanDerWaalsContact O-CG1 3.24Å; N30-I34 WeakPolarHBondContact O-CG1 3.32Å; N30-I34 PolarHBondContact O-N 3.34Å
31	I	71.8	Confident	68.8	Low	82 Å²	82	107.3 Å²	107.3	42%	0.421	53%	0.526	S	S	.	.	H	α-helix	trans	-62	-43	177.1	-68	163.3	0	0	0	110.7	N27 F33 I34 L35	N27-I31 VanDerWaalsContact O-CG1 3.26Å; N27-I31 WeakPolarHBondContact O-CG1 3.5Å; N27-I31 PolarHBondContact O-N 3.14Å; I31-F33 VanDerWaalsContact C-N 3.34Å; I31-F33 PolarHBondContact O-N 3.09Å; I31-I34 PolarHBondContact O-N 3.09Å; I31-L35 HydrophobicContact CG2-CD1 4.02Å; I31-L35 WeakPolarHBondContact O-CB 3.36Å; I31-L35 PolarHBondContact O-N 2.81Å
32	K	73.9	Confident	69.4	Low	142 Å²	142	104.2 Å²	104.2	62%	0.617	52%	0.516	S	S	*	.	H	α-helix	trans	-63.3	-39.5	174.6	-79	-175.3	177.1	-178.4	0	112.3	Q28 L29 N30 L35 L36	Q28-K32 PolarHBondContact O-N 3.31Å; Q28-K32 VanDerWaalsContact O-N 3.07Å; L29-K32 PolarHBondContact O-N 3.2Å; N30-K32 VanDerWaalsContact C-N 3.34Å; N30-K32 PolarHBondContact O-N 3.42Å; K32-L35 PolarHBondContact O-N 2.94Å; K32-L36 WeakPolarHBondContact O-CB 3.31Å; K32-L36 PolarHBondContact O-N 3.16Å
33	F	73.2	Confident	70	Confident	145 Å²	145	107.7 Å²	107.7	64%	0.636	53%	0.528	S	S	*	.	H	α-helix	trans	-64.9	-42.3	177.6	-129.1	-85.4	0	0	0	111.9	L29 N30 I31 L36 L37	L29-F33 PolarHBondContact O-N 3.23Å; N30-F33 PolarHBondContact O-N 2.85Å; I31-F33 VanDerWaalsContact C-N 3.34Å; I31-F33 PolarHBondContact O-N 3.09Å; F33-L36 PolarHBondContact O-N 3.01Å; F33-L37 PolarHBondContact O-N 3.4Å
34	I	74.2	Confident	70.3	Confident	98 Å²	98	104.6 Å²	104.6	50%	0.503	52%	0.519	S	S	.	.	H	α-helix	trans	-64	-45.9	176.6	-67.5	162.5	0	0	0	110.4	N30 I31 L36 L37 I38	N30-I34 WeakPolarHBondContact O-CD1 3.44Å; N30-I34 VanDerWaalsContact O-CG1 3.24Å; N30-I34 WeakPolarHBondContact O-CG1 3.32Å; N30-I34 PolarHBondContact O-N 3.34Å; I31-I34 PolarHBondContact O-N 3.09Å; I34-L36 VanDerWaalsContact C-N 3.3Å; I34-L36 PolarHBondContact O-N 3.1Å; I34-L37 WeakPolarHBondContact O-CB 3.29Å; I34-L37 PolarHBondContact O-N 2.94Å; I34-I38 HydrophobicContact CG2-CD1 3.8Å; I34-I38 HydrophobicContact CG2-CG1 4.47Å; I34-I38 VanDerWaalsContact O-CG1 3.3Å; I34-I38 WeakPolarHBondContact O-CG1 3.39Å; I34-I38 PolarHBondContact O-N 2.89Å
35	L	74	Confident	70.5	Confident	97 Å²	97	102.8 Å²	102.8	51%	0.508	51%	0.513	S	S	.	.	H	α-helix	trans	-58.7	-40.8	174.6	-98.8	147.6	0	0	0	112.4	I31 K32 I38 I39	I31-L35 HydrophobicContact CG2-CD1 4.02Å; I31-L35 WeakPolarHBondContact O-CB 3.36Å; I31-L35 PolarHBondContact O-N 2.81Å; K32-L35 PolarHBondContact O-N 2.94Å; L35-I38 PolarHBondContact O-N 3.44Å; L35-I39 WeakPolarHBondContact O-CD1 3.41Å; L35-I39 VanDerWaalsContact O-CG1 3.23Å; L35-I39 WeakPolarHBondContact O-CG1 3.5Å; L35-I39 PolarHBondContact O-N 3.3Å
36	L	76.1	Confident	70.7	Confident	109 Å²	109	102.7 Å²	102.7	57%	0.571	51%	0.513	S	S	*	.	H	α-helix	trans	-69.4	-36.8	179.4	-150.1	144.5	0	0	0	111.6	K32 F33 I34 I39 I40	K32-L36 WeakPolarHBondContact O-CB 3.31Å; K32-L36 PolarHBondContact O-N 3.16Å; F33-L36 PolarHBondContact O-N 3.01Å; I34-L36 VanDerWaalsContact C-N 3.3Å; I34-L36 PolarHBondContact O-N 3.1Å; L36-I39 PolarHBondContact O-N 2.85Å; L36-I40 HydrophobicContact CD2-CD1 3.77Å; L36-I40 HydrophobicContact CD2-CG1 4.43Å; L36-I40 VanDerWaalsContact O-CG1 3.28Å; L36-I40 WeakPolarHBondContact O-CG1 3.36Å; L36-I40 PolarHBondContact O-N 3.47Å
37	L	75.8	Confident	70.6	Confident	94 Å²	94	105.5 Å²	105.5	49%	0.492	52%	0.52	S	S	.	.	H	α-helix	trans	-63.5	-45.3	171.9	-115.5	155.5	0	0	0	111.8	F33 I34 I39 I40 I41	F33-L37 PolarHBondContact O-N 3.4Å; I34-L37 WeakPolarHBondContact O-CB 3.29Å; I34-L37 PolarHBondContact O-N 2.94Å; L37-I39 VanDerWaalsContact C-N 3.34Å; L37-I39 PolarHBondContact O-N 3.38Å; L37-I40 PolarHBondContact O-N 2.88Å; L37-I41 HydrophobicContact CD2-CD1 4.26Å; L37-I41 VanDerWaalsContact O-CG1 3.3Å; L37-I41 WeakPolarHBondContact O-CG1 3.48Å; L37-I41 PolarHBondContact O-N 3.37Å
38	I	78.1	Confident	70	Confident	82 Å²	82	105 Å²	105	42%	0.421	52%	0.517	S	S	.	.	H	α-helix	trans	-61.4	-43.2	176.3	-68.2	165.5	0	0	0	110.6	I34 L35 I40 I41 I42	I34-I38 HydrophobicContact CG2-CD1 3.8Å; I34-I38 HydrophobicContact CG2-CG1 4.47Å; I34-I38 VanDerWaalsContact O-CG1 3.3Å; I34-I38 WeakPolarHBondContact O-CG1 3.39Å; I34-I38 PolarHBondContact O-N 2.89Å; L35-I38 PolarHBondContact O-N 3.44Å; I38-I40 VanDerWaalsContact C-N 3.32Å; I38-I40 PolarHBondContact O-N 2.91Å; I38-I41 PolarHBondContact O-N 2.89Å; I38-I42 HydrophobicContact CG2-CD1 3.65Å; I38-I42 HydrophobicContact CG2-CG1 4.3Å; I38-I42 VanDerWaalsContact O-CG1 3.3Å; I38-I42 WeakPolarHBondContact O-CG1 3.29Å; I38-I42 PolarHBondContact O-N 3.3Å
39	I	79	Confident	69.6	Low	90 Å²	90	105.2 Å²	105.2	46%	0.462	52%	0.521	S	S	.	.	H	α-helix	trans	-62.6	-38.9	176.3	-69.4	164.1	0	0	0	111.5	L35 L36 L37 K43	L35-I39 WeakPolarHBondContact O-CD1 3.41Å; L35-I39 VanDerWaalsContact O-CG1 3.23Å; L35-I39 WeakPolarHBondContact O-CG1 3.5Å; L35-I39 PolarHBondContact O-N 3.3Å; L36-I39 PolarHBondContact O-N 2.85Å; L37-I39 VanDerWaalsContact C-N 3.34Å; L37-I39 PolarHBondContact O-N 3.38Å; I39-K43 WeakPolarHBondContact O-CB 3.3Å; I39-K43 PolarHBondContact O-N 3.32Å
40	I	75.7	Confident	68.9	Low	91 Å²	91	105.4 Å²	105.4	47%	0.467	52%	0.522	S	S	.	.	H	α-helix	trans	-64.9	-43	176	-70.9	166	0	0	0	110.7	L36 L37 I38 K43 N44	L36-I40 HydrophobicContact CD2-CD1 3.77Å; L36-I40 HydrophobicContact CD2-CG1 4.43Å; L36-I40 VanDerWaalsContact O-CG1 3.28Å; L36-I40 WeakPolarHBondContact O-CG1 3.36Å; L36-I40 PolarHBondContact O-N 3.47Å; L37-I40 PolarHBondContact O-N 2.88Å; I38-I40 VanDerWaalsContact C-N 3.32Å; I38-I40 PolarHBondContact O-N 2.91Å; I40-K43 PolarHBondContact O-N 3.31Å; I40-N44 WeakPolarHBondContact O-CB 3.27Å; I40-N44 PolarHBondContact O-N 2.74Å
41	I	75.2	Confident	67.8	Low	85 Å²	85	107.7 Å²	107.7	44%	0.436	53%	0.528	S	S	.	.	H	α-helix	trans	-63.2	-50.1	178.5	-67.3	164.6	0	0	0	110.1	L37 I38 K43 N44 Q45	L37-I41 HydrophobicContact CD2-CD1 4.26Å; L37-I41 VanDerWaalsContact O-CG1 3.3Å; L37-I41 WeakPolarHBondContact O-CG1 3.48Å; L37-I41 PolarHBondContact O-N 3.37Å; I38-I41 PolarHBondContact O-N 2.89Å; I41-K43 VanDerWaalsContact C-N 3.34Å; I41-K43 PolarHBondContact O-N 3.28Å; I41-N44 WeakPolarHBondContact O-CB 3.32Å; I41-N44 PolarHBondContact O-N 3.49Å; I41-Q45 VanDerWaalsContact CG2-OE1 3.32Å; I41-Q45 PolarHBondContact O-N 3.25Å
42	I	75.8	Confident	66.6	Low	91 Å²	91	111.8 Å²	111.8	47%	0.467	54%	0.539	S	S	.	.	H	α-helix	trans	-59.7	-43.3	178	-66	168	0	0	0	111.2	I38 N44 Q45 L46	I38-I42 HydrophobicContact CG2-CD1 3.65Å; I38-I42 HydrophobicContact CG2-CG1 4.3Å; I38-I42 VanDerWaalsContact O-CG1 3.3Å; I38-I42 WeakPolarHBondContact O-CG1 3.29Å; I38-I42 PolarHBondContact O-N 3.3Å; I42-N44 VanDerWaalsContact C-N 3.29Å; I42-N44 PolarHBondContact O-N 3.34Å; I42-Q45 PolarHBondContact O-N 2.72Å; I42-L46 HydrophobicContact CG2-CD1 4.09Å; I42-L46 WeakPolarHBondContact O-CB 3.33Å; I42-L46 PolarHBondContact O-N 3.04Å
43	K	74.3	Confident	65.2	Low	152 Å²	152	108.5 Å²	108.5	66%	0.661	53%	0.534	S	S	*	.	H	α-helix	trans	-62.7	-36.5	175.7	-98.1	-174.8	171.8	178.6	0	112.5	I39 I40 I41 K47	I39-K43 WeakPolarHBondContact O-CB 3.3Å; I39-K43 PolarHBondContact O-N 3.32Å; I40-K43 PolarHBondContact O-N 3.31Å; I41-K43 VanDerWaalsContact C-N 3.34Å; I41-K43 PolarHBondContact O-N 3.28Å; K43-K47 WeakPolarHBondContact O-CB 3.36Å; K43-K47 PolarHBondContact O-N 3.4Å
44	N	68.1	Low	63.9	Low	100 Å²	100	106 Å²	106	54%	0.535	53%	0.526	S	S	.	.	H	α-helix	trans	-70.5	-42.2	177	-111.1	5.9	0	0	0	111.4	I40 I41 I42 K47 I48	I40-N44 WeakPolarHBondContact O-CB 3.27Å; I40-N44 PolarHBondContact O-N 2.74Å; I41-N44 WeakPolarHBondContact O-CB 3.32Å; I41-N44 PolarHBondContact O-N 3.49Å; I42-N44 VanDerWaalsContact C-N 3.29Å; I42-N44 PolarHBondContact O-N 3.34Å; N44-K47 WeakPolarHBondContact O-CB 3.24Å; N44-K47 PolarHBondContact O-N 3.06Å; N44-I48 VanDerWaalsContact O-CG1 3.31Å; N44-I48 WeakPolarHBondContact O-CG1 3.18Å; N44-I48 PolarHBondContact O-N 3.23Å; N44-I48 VanDerWaalsContact O-N 3.13Å
45	Q	66.5	Low	62.2	Low	101 Å²	101	105 Å²	105	47%	0.472	52%	0.522	S	S	.	.	H	α-helix	trans	-64.4	-45.8	177.8	-117.6	142.3	-30.3	0	0	112.2	I41 I42 K47 I48 D49	I41-Q45 VanDerWaalsContact CG2-OE1 3.32Å; I41-Q45 PolarHBondContact O-N 3.25Å; I42-Q45 PolarHBondContact O-N 2.72Å; Q45-K47 PolarHBondContact O-N 2.99Å; Q45-I48 WeakPolarHBondContact O-CA 3.37Å; Q45-I48 WeakPolarHBondContact O-CB 3.2Å; Q45-I48 PolarHBondContact O-N 3.42Å; Q45-D49 PolarHBondContact O-N 3.18Å
46	L	57.7	Low	60.3	Low	108 Å²	108	103.8 Å²	103.8	57%	0.565	53%	0.526	S	S	*	.	H	α-helix	trans	-58.2	-33.8	173.8	-84.2	167.4	0	0	0	112.7	I42 I48 L50	I42-L46 HydrophobicContact CG2-CD1 4.09Å; I42-L46 WeakPolarHBondContact O-CB 3.33Å; I42-L46 PolarHBondContact O-N 3.04Å; L46-I48 VanDerWaalsContact C-N 3.3Å; L46-L50 WeakPolarHBondContact O-CB 3.39Å; L46-L50 PolarHBondContact O-N 3.08Å; L46-L50 VanDerWaalsContact O-N 3.15Å
47	K	52.7	Low	58.3	Low	157 Å²	157	102.7 Å²	102.7	68%	0.683	53%	0.528	S	S	*	.	H	α-helix	trans	-70.9	-28.6	177	-149.3	179.4	-172.3	-175.7	0	112.4	K43 N44 Q45	K43-K47 WeakPolarHBondContact O-CB 3.36Å; K43-K47 PolarHBondContact O-N 3.4Å; N44-K47 WeakPolarHBondContact O-CB 3.24Å; N44-K47 PolarHBondContact O-N 3.06Å; Q45-K47 PolarHBondContact O-N 2.99Å
48	I	55.3	Low	56.2	Low	84 Å²	84	104.1 Å²	104.1	43%	0.431	53%	0.534	S	S	.	.	H	α-helix	trans	-76.9	-45.4	177.1	-67.7	164.5	0	0	0	109.9	N44 Q45 L46 L50 F51 Y52	N44-I48 VanDerWaalsContact O-CG1 3.31Å; N44-I48 WeakPolarHBondContact O-CG1 3.18Å; N44-I48 PolarHBondContact O-N 3.23Å; N44-I48 VanDerWaalsContact O-N 3.13Å; Q45-I48 WeakPolarHBondContact O-CA 3.37Å; Q45-I48 WeakPolarHBondContact O-CB 3.2Å; Q45-I48 PolarHBondContact O-N 3.42Å; L46-I48 VanDerWaalsContact C-N 3.3Å; I48-L50 PolarHBondContact O-N 3.21Å; I48-F51 WeakPolarHBondContact O-CA 3.41Å; I48-F51 VanDerWaalsContact O-CB 3.28Å; I48-F51 WeakPolarHBondContact O-CB 3.45Å; I48-F51 PolarHBondContact O-N 3.04Å; I48-Y52 HydrophobicContact CG2-CD2 3.76Å; I48-Y52 HydrophobicContact CG2-CE2 3.39Å; I48-Y52 VanDerWaalsContact O-CD2 3.28Å; I48-Y52 WeakPolarHBondContact O-CD2 3.24Å; I48-Y52 PolarHBondContact O-N 2.85Å; I48-Y52 VanDerWaalsContact O-N 3.1Å
49	D	52.5	Low	54	Low	98 Å²	98	107.5 Å²	107.5	52%	0.524	55%	0.553	S	S	.	*	H	α-helix	trans	-66.1	-38.2	-179.8	-67	-21.6	0	0	0	112.7	Q45 F51 Y52 S53	Q45-D49 PolarHBondContact O-N 3.18Å; D49-F51 PolarHBondContact O-N 3.31Å; D49-Y52 PolarHBondContact O-N 3.27Å; D49-S53 PolarHBondContact O-N 3.37Å; D49-S53 VanDerWaalsContact O-N 3.09Å; D49-S53 PolarHBondContact O-OG 2.76Å
50	L	45.7	Very low	51.4	Low	114 Å²	114	112.9 Å²	112.9	60%	0.597	57%	0.572	S	S	*	*	H	α-helix	trans	-64.9	-26.9	173.8	-136.3	121.3	0	0	0	111.8	L46 I48 S53 I54	L46-L50 WeakPolarHBondContact O-CB 3.39Å; L46-L50 PolarHBondContact O-N 3.08Å; L46-L50 VanDerWaalsContact O-N 3.15Å; I48-L50 PolarHBondContact O-N 3.21Å; L50-S53 PolarHBondContact O-OG 3.35Å; L50-S53 VanDerWaalsContact O-OG 3.12Å; L50-I54 HydrophobicContact CD2-CD1 4.3Å; L50-I54 WeakPolarHBondContact O-CD1 2.95Å; L50-I54 WeakPolarHBondContact O-CG1 3.48Å; L50-I54 PolarHBondContact O-N 2.87Å
51	F	47.8	Very low	49	Very low	141 Å²	141	111.6 Å²	111.6	62%	0.618	58%	0.582	S	S	*	*	H	α-helix	trans	-76.8	-37.4	177.6	-140.2	-91.3	0	0	0	112.1	I48 D49 N55	I48-F51 WeakPolarHBondContact O-CA 3.41Å; I48-F51 VanDerWaalsContact O-CB 3.28Å; I48-F51 WeakPolarHBondContact O-CB 3.45Å; I48-F51 PolarHBondContact O-N 3.04Å; D49-F51 PolarHBondContact O-N 3.31Å; F51-N55 PolarHBondContact O-N 2.64Å
52	Y	47.2	Very low	46.7	Very low	169 Å²	169	113.3 Å²	113.3	66%	0.663	60%	0.601	S	S	*	*	H	α-helix	trans	-70.4	-39.1	176.3	-76.1	-65.7	0	0	0	112.6	I48 D49 I54 N55 A56	I48-Y52 HydrophobicContact CG2-CD2 3.76Å; I48-Y52 HydrophobicContact CG2-CE2 3.39Å; I48-Y52 VanDerWaalsContact O-CD2 3.28Å; I48-Y52 WeakPolarHBondContact O-CD2 3.24Å; I48-Y52 PolarHBondContact O-N 2.85Å; I48-Y52 VanDerWaalsContact O-N 3.1Å; D49-Y52 PolarHBondContact O-N 3.27Å; Y52-I54 PolarHBondContact O-N 3.4Å; Y52-N55 PolarHBondContact O-N 3.15Å; Y52-A56 PolarHBondContact O-N 3.07Å; Y52-A56 VanDerWaalsContact O-N 3.07Å
53	S	45.5	Very low	44.3	Very low	73 Å²	73	114.4 Å²	114.4	51%	0.51	62%	0.617	S	S	.	*	H	α-helix	trans	-65.2	-34.9	178.2	56.6	0	0	0	0	113.4	D49 L50	D49-S53 PolarHBondContact O-N 3.37Å; D49-S53 VanDerWaalsContact O-N 3.09Å; D49-S53 PolarHBondContact O-OG 2.76Å; L50-S53 PolarHBondContact O-OG 3.35Å; L50-S53 VanDerWaalsContact O-OG 3.12Å
54	I	44.3	Very low	42	Very low	91 Å²	91	112.6 Å²	112.6	47%	0.467	62%	0.624	S	S	.	*	H	α-helix	trans	-68.2	-41.7	175.4	-66.9	168.6	0	0	0	110.8	L50 Y52 A56 S57 I58	L50-I54 HydrophobicContact CD2-CD1 4.3Å; L50-I54 WeakPolarHBondContact O-CD1 2.95Å; L50-I54 WeakPolarHBondContact O-CG1 3.48Å; L50-I54 PolarHBondContact O-N 2.87Å; Y52-I54 PolarHBondContact O-N 3.4Å; I54-A56 PolarHBondContact O-N 3.29Å; I54-S57 PolarHBondContact O-N 3.2Å; I54-S57 PolarHBondContact O-OG 3.2Å; I54-I58 HydrophobicContact CG2-CD1 4.41Å
55	N	38.1	Very low	40	Very low	79 Å²	79	113.7 Å²	113.7	42%	0.422	64%	0.636	S	S	.	*	H	α-helix	trans	-73.5	-28.1	-177.6	-75.7	-25.2	0	0	0	113.8	F51 Y52 S57 I58	F51-N55 PolarHBondContact O-N 2.64Å; Y52-N55 PolarHBondContact O-N 3.15Å; N55-S57 PolarHBondContact O-N 2.91Å; N55-I58 PolarHBondContact O-N 2.85Å
56	A	34.5	Very low	37.9	Very low	71 Å²	71	114.4 Å²	114.4	59%	0.587	65%	0.652	S	S	*	*	H	α-helix	trans	-63.9	-26.9	173.5	0	0	0	0	0	112.8	Y52 I54	Y52-A56 PolarHBondContact O-N 3.07Å; Y52-A56 VanDerWaalsContact O-N 3.07Å; I54-A56 PolarHBondContact O-N 3.29Å
57	S	34.5	Very low	36.4	Very low	86 Å²	86	117.4 Å²	117.4	60%	0.601	67%	0.668	S	S	*	*	H	α-helix	trans	-79.6	-21.2	179.4	71.4	0	0	0	0	114.2	I54 N55	I54-S57 PolarHBondContact O-N 3.2Å; I54-S57 PolarHBondContact O-OG 3.2Å; N55-S57 PolarHBondContact O-N 2.91Å
58	I	32.8	Very low	35.1	Very low	124 Å²	124	114.6 Å²	114.6	64%	0.636	67%	0.668	S	S	*	*	H	α-helix	trans	-88.4	-11.7	-174	-64.3	173.7	0	0	0	112.6	I54 N55	I54-I58 HydrophobicContact CG2-CD1 4.41Å; N55-I58 PolarHBondContact O-N 2.85Å
59	L	30.1	Very low	33.7	Very low	153 Å²	153	116 Å²	116	80%	0.801	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-0.1	-177.3	-77.8	163.5	0	0	0	115.4	G61	L59-G61 PolarHBondContact O-N 2.89Å
60	K	25.9	Very low	32.5	Very low	202 Å²	202	119.5 Å²	119.5	88%	0.878	70%	0.703	S	S	*	*	S	Bend	trans	-97.2	72.3	174.9	-71.5	-174.7	179.5	178.5	0	111.3
61	G	25.2	Very low	31.6	Very low	64 Å²	64	119.3 Å²	119.3	66%	0.66	71%	0.711	S	S	*	*			trans	170	77.1	173	0	0	0	0	0	114.7	L59	L59-G61 PolarHBondContact O-N 2.89Å
62	S	27.1	Very low	30.6	Very low	122 Å²	122	117.6 Å²	117.6	85%	0.853	72%	0.717	S	S	*	*			trans	-174.1	122.6	138.9	26.9	0	0	0	0	109.9
63	S	25.3	Very low	29.6	Very low	114 Å²	114	117 Å²	117	80%	0.797	73%	0.725	S	S	*	*			trans	-43	132.9	171.9	42.1	0	0	0	0	114.2
64	S	25	Very low	28.8	Very low	114 Å²	114	121.1 Å²	121.1	80%	0.797	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-59.6	137.5	168.2	42.3	0	0	0	0	113.2
65	P	26	Very low	27.9	Very low	122 Å²	122	127.4 Å²	127.4	79%	0.792	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-96.5	120.5	151.2	26.4	-13	0	0	0	108.8	L67	P65-L67 PolarHBondContact O-N 2.94Å
66	S	22.5	Very low	27.2	Very low	116 Å²	116	134.1 Å²	134.1	81%	0.811	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-55.4	119.2	167.8	49.5	0	0	0	0	110.9
67	L	27	Very low	26.8	Very low	172 Å²	172	141 Å²	141	90%	0.901	79%	0.794	S	S	*	*			trans	-125.7	120.5	158.5	-143	79.9	0	0	0	109	P65	P65-L67 PolarHBondContact O-N 2.94Å
68	S	25.9	Very low	26.5	Very low	97 Å²	97	144.4 Å²	144.4	68%	0.678	81%	0.806	S	S	*	*			trans	-59.2	133.3	-174.4	45.6	0	0	0	0	114.5
69	S	25.3	Very low	26.1	Very low	113 Å²	113	148.8 Å²	148.8	79%	0.79	82%	0.815	S	S	*	*			trans	36.8	89.9	141.2	65.2	0	0	0	0	117.8
70	L	26.5	Very low	25.9	Very low	173 Å²	173	151.2 Å²	151.2	91%	0.906	82%	0.816	S	S	*	*			trans	-110.5	120.5	149.6	-88.5	144.5	0	0	0	107.8
71	S	26.9	Very low	25.9	Very low	110 Å²	110	150.1 Å²	150.1	77%	0.769	81%	0.813	S	S	*	*			trans	-56.3	135.4	-175.6	50.6	0	0	0	0	112.4	N73	S71-N73 PolarHBondContact O-N 3.13Å
72	S	27	Very low	26.2	Very low	105 Å²	105	157.1 Å²	157.1	73%	0.734	82%	0.821	S	S	*	*	S	Bend	trans	-41.2	109.1	167.5	45.9	0	0	0	0	113.5
73	N	27.2	Very low	26.4	Very low	157 Å²	157	162 Å²	162	84%	0.84	82%	0.821	S	S	*	*			trans	-165.1	3.2	148.4	-97.2	-11.7	0	0	0	116	S71 Y75	S71-N73 PolarHBondContact O-N 3.13Å; N73-Y75 PolarHBondContact O-N 2.84Å
74	D	26.9	Very low	27.1	Very low	159 Å²	159	159.6 Å²	159.6	85%	0.85	80%	0.802	S	S	*	*			trans	-96.6	33.1	-179.6	-76	-19.9	0	0	0	114.7	Y76	D74-Y76 PolarHBondContact O-N 2.02Å
75	Y	25.8	Very low	28.2	Very low	223 Å²	223	157.8 Å²	157.8	88%	0.875	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.8	9.3	-172.9	-118.6	-85	0	0	0	116.4	N73	N73-Y75 PolarHBondContact O-N 2.84Å
76	Y	24.8	Very low	29.4	Very low	220 Å²	220	157.4 Å²	157.4	86%	0.863	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.2	7.8	-171.3	-114.6	-87.4	0	0	0	118.3	D74	D74-Y76 PolarHBondContact O-N 2.02Å
77	Y	25.4	Very low	30.8	Very low	216 Å²	216	159.9 Å²	159.9	85%	0.847	77%	0.769	S	S	*	*	S	Bend	trans	-118.6	16.5	-170.4	-104.7	-75.9	0	0	0	118.2
78	N	27.2	Very low	32	Very low	157 Å²	157	154.9 Å²	154.9	84%	0.84	74%	0.743	S	S	*	*			trans	-107	6.5	-172.9	-79.7	-23.9	0	0	0	117.6
79	Y	24.7	Very low	33.3	Very low	215 Å²	215	152.8 Å²	152.8	84%	0.843	72%	0.724	S	S	*	*	S	Bend	trans	-91.3	-7.8	-175.6	-131.3	-94.9	0	0	0	116.7
80	Y	25.9	Very low	34.6	Very low	205 Å²	205	149.5 Å²	149.5	80%	0.804	70%	0.697	S	S	*	*	S	Bend	trans	-133.8	95.4	178.4	-64.8	-75.3	0	0	0	111.7
81	H	26.9	Very low	36	Very low	179 Å²	179	146 Å²	146	83%	0.829	68%	0.676	S	S	*	*			trans	139.6	74.1	158.2	-77.3	-59.2	0	0	0	109.1	R83	H81-R83 PolarHBondContact O-N 3.2Å
82	Y	30.8	Very low	37.4	Very low	210 Å²	210	143.8 Å²	143.8	82%	0.824	66%	0.66	S	S	*	*			trans	-67.1	84.5	159.4	-150.8	-89.1	0	0	0	107.4	P84	Y82-P84 VanDerWaalsContact O-CD 3.24Å; Y82-P84 WeakPolarHBondContact O-CD 3.34Å
83	R	32	Very low	38.5	Very low	226 Å²	226	142.2 Å²	142.2	85%	0.853	64%	0.639	S	S	*	*			trans	-77.1	107.5	166.6	-121.6	-178.3	-172.7	174.9	3.3	104.7	H81 T85	H81-R83 PolarHBondContact O-N 3.2Å; R83-T85 PolarHBondContact O-N 3.45Å
84	P	39	Very low	39.8	Very low	62 Å²	62	138.7 Å²	138.7	40%	0.403	62%	0.62	S	S	.	*			trans	-57.6	134	-179	24.9	-33.4	0	0	0	108.3	Y82 D88 L89	Y82-P84 VanDerWaalsContact O-CD 3.24Å; Y82-P84 WeakPolarHBondContact O-CD 3.34Å; P84-D88 HydrophobicContact CB-CB 4.18Å; P84-L89 HydrophobicContact CB-CD1 4.37Å; P84-L89 HydrophobicContact CB-CD2 4.49Å; P84-L89 HydrophobicContact CB-CG 4Å; P84-L89 HydrophobicContact CG-CD1 4.03Å; P84-L89 HydrophobicContact CG-CD2 4Å; P84-L89 HydrophobicContact CG-CG 3.89Å
85	T	49.5	Very low	41.2	Very low	77 Å²	77	136.6 Å²	136.6	47%	0.472	61%	0.608	S	S	.	*			trans	-65	159.5	178.5	66.4	0	0	0	0	109	R83 K87 D88 L89	R83-T85 PolarHBondContact O-N 3.45Å; T85-K87 PolarHBondContact O-N 3.42Å; T85-D88 PolarHBondContact N-OD2 3.33Å; T85-D88 PolarHBondContact O-N 3.34Å; T85-D88 PolarHBondContact OG1-N 3.34Å; T85-D88 PolarHBondContact OG1-OD2 3.24Å; T85-L89 PolarHBondContact O-N 3.48Å
86	K	50	Low	42.3	Very low	113 Å²	113	130.4 Å²	130.4	49%	0.491	59%	0.586	S	S	.	*	H	α-helix	trans	-52.3	-29.1	175	-172.9	169.6	175.6	168.1	0	111.7	I90 L483 D486	K86-I90 HydrophobicContact CG-CD1 4.2Å; K86-I90 VanDerWaalsContact O-CD1 3.28Å; K86-I90 WeakPolarHBondContact O-CD1 3.49Å; K86-I90 WeakPolarHBondContact O-CG1 3.46Å; K86-I90 PolarHBondContact O-N 3.29Å; K86-L483 HydrophobicContact CG-CD1 4.42Å; K86-D486 IonicContact NZ-OD2 3.26Å; K86-D486 PolarHBondContact NZ-OD2 2.7Å
87	K	53	Low	43.3	Very low	168 Å²	168	124.7 Å²	124.7	73%	0.73	58%	0.576	S	S	*	*	H	α-helix	trans	-71.1	-47.3	177.5	-163.3	179	179.3	-175	0	112.3	T85 L89 I90 Q91	T85-K87 PolarHBondContact O-N 3.42Å; K87-L89 VanDerWaalsContact C-N 3.32Å; K87-L89 PolarHBondContact O-N 3.45Å; K87-I90 PolarHBondContact O-N 2.85Å; K87-Q91 PolarHBondContact O-N 3.04Å
88	D	52	Low	44.2	Very low	67 Å²	67	122.2 Å²	122.2	36%	0.358	57%	0.57	S	S	.	*	H	α-helix	trans	-64.3	-38.3	-179	-52.6	-36.8	0	0	0	111.8	P84 T85 Q91 S92	P84-D88 HydrophobicContact CB-CB 4.18Å; T85-D88 PolarHBondContact N-OD2 3.33Å; T85-D88 PolarHBondContact O-N 3.34Å; T85-D88 PolarHBondContact OG1-N 3.34Å; T85-D88 PolarHBondContact OG1-OD2 3.24Å; D88-Q91 PolarHBondContact O-N 3.08Å; D88-S92 WeakPolarHBondContact O-CB 3.37Å; D88-S92 PolarHBondContact O-N 2.74Å
89	L	52.8	Low	45.1	Very low	54 Å²	54	120.3 Å²	120.3	28%	0.283	56%	0.559	S	S	.	*	H	α-helix	trans	-64.3	-43.2	175.4	-76.9	156.2	0	0	0	112	P84 T85 K87 Q91 S92 Y93 L483	P84-L89 HydrophobicContact CB-CD1 4.37Å; P84-L89 HydrophobicContact CB-CD2 4.49Å; P84-L89 HydrophobicContact CB-CG 4Å; P84-L89 HydrophobicContact CG-CD1 4.03Å; P84-L89 HydrophobicContact CG-CD2 4Å; P84-L89 HydrophobicContact CG-CG 3.89Å; T85-L89 PolarHBondContact O-N 3.48Å; K87-L89 VanDerWaalsContact C-N 3.32Å; K87-L89 PolarHBondContact O-N 3.45Å; L89-Q91 VanDerWaalsContact C-N 3.32Å; L89-S92 PolarHBondContact O-N 2.03Å; L89-Y93 WeakPolarHBondContact O-CD2 3.38Å; L89-Y93 PolarHBondContact O-N 2.86Å; L89-Y93 VanDerWaalsContact O-N 3.16Å; L89-L483 HydrophobicContact CB-CD2 4.06Å; L89-L483 HydrophobicContact CD1-CD2 3.79Å; L89-L483 HydrophobicContact CD2-CD2 4.05Å; L89-L483 HydrophobicContact CG-CD2 4.18Å
90	I	52.8	Low	46	Very low	44 Å²	44	113.5 Å²	113.5	23%	0.226	53%	0.532	C	S	.	.	H	α-helix	trans	-62.5	-42.6	175.8	-69.2	164.6	0	0	0	110	K86 K87 Y93 L94 V487 L490	K86-I90 HydrophobicContact CG-CD1 4.2Å; K86-I90 VanDerWaalsContact O-CD1 3.28Å; K86-I90 WeakPolarHBondContact O-CD1 3.49Å; K86-I90 WeakPolarHBondContact O-CG1 3.46Å; K86-I90 PolarHBondContact O-N 3.29Å; K87-I90 PolarHBondContact O-N 2.85Å; I90-Y93 WeakPolarHBondContact O-CB 2.92Å; I90-Y93 PolarHBondContact O-N 3.01Å; I90-L94 HydrophobicContact CG2-CD1 4.08Å; I90-L94 HydrophobicContact CG2-CG 4.5Å; I90-L94 WeakPolarHBondContact O-CG 2.92Å; I90-L94 PolarHBondContact O-N 2.81Å; I90-L94 VanDerWaalsContact O-N 3.08Å; I90-V487 HydrophobicContact CG1-CG2 4.09Å; I90-L490 HydrophobicContact CD1-CD1 4.01Å
91	Q	55.8	Low	46.6	Very low	98 Å²	98	107.7 Å²	107.7	46%	0.458	52%	0.515	S	S	.	.	H	α-helix	trans	-62.7	-46.7	178.7	-167.3	61.1	40.2	0	0	111.7	K87 D88 L89 Y93 L94 D95	K87-Q91 PolarHBondContact O-N 3.04Å; D88-Q91 PolarHBondContact O-N 3.08Å; L89-Q91 VanDerWaalsContact C-N 3.32Å; Q91-Y93 PolarHBondContact O-N 3.24Å; Q91-L94 PolarHBondContact O-N 2.84Å; Q91-D95 PolarHBondContact NE2-OD1 3.3Å; Q91-D95 VanDerWaalsContact O-CG 3.29Å; Q91-D95 PolarHBondContact O-N 2.04Å
92	S	56.8	Low	47.3	Very low	64 Å²	64	105.3 Å²	105.3	45%	0.448	51%	0.507	S	S	.	.	H	α-helix	trans	-56.9	-32.5	175	178.1	0	0	0	0	113.4	D88 L89	D88-S92 WeakPolarHBondContact O-CB 3.37Å; D88-S92 PolarHBondContact O-N 2.74Å; L89-S92 PolarHBondContact O-N 2.03Å
93	Y	50.2	Low	47.6	Very low	72 Å²	72	102.6 Å²	102.6	28%	0.282	50%	0.502	S	S	.	.	H	α-helix	trans	-72.2	-40.1	174.1	-99.2	-91.9	0	0	0	112.8	L89 I90 Q91 D95 W100 V487	L89-Y93 WeakPolarHBondContact O-CD2 3.38Å; L89-Y93 PolarHBondContact O-N 2.86Å; L89-Y93 VanDerWaalsContact O-N 3.16Å; I90-Y93 WeakPolarHBondContact O-CB 2.92Å; I90-Y93 PolarHBondContact O-N 3.01Å; Q91-Y93 PolarHBondContact O-N 3.24Å; Y93-D95 VanDerWaalsContact C-N 3.32Å; Y93-W100 HydrophobicContact CD1-CH2 4.1Å; Y93-W100 HydrophobicContact CD1-CZ3 4.06Å; Y93-W100 AromaticContact CE1-CH2 3.71Å; Y93-W100 HydrophobicContact CE1-CH2 3.71Å; Y93-W100 HydrophobicContact CE1-CZ3 4.1Å; Y93-V487 HydrophobicContact CD1-CG1 4.32Å; Y93-V487 HydrophobicContact CG-CG1 4.34Å
94	L	53.6	Low	47.7	Very low	84 Å²	84	98.8 Å²	98.8	44%	0.44	49%	0.492	S	S	.	.	H	α-helix	trans	-68.7	-30.5	179.4	-69.2	171.4	0	0	0	112.4	I90 Q91 K96 L491	I90-L94 HydrophobicContact CG2-CD1 4.08Å; I90-L94 HydrophobicContact CG2-CG 4.5Å; I90-L94 WeakPolarHBondContact O-CG 2.92Å; I90-L94 PolarHBondContact O-N 2.81Å; I90-L94 VanDerWaalsContact O-N 3.08Å; Q91-L94 PolarHBondContact O-N 2.84Å; L94-K96 VanDerWaalsContact C-N 3.28Å; L94-K96 PolarHBondContact O-N 2.9Å; L94-L491 HydrophobicContact CD2-CD2 3.8Å
95	D	55.7	Low	47.5	Very low	114 Å²	114	101.2 Å²	101.2	61%	0.61	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-6.3	-176.8	-63.3	-22.2	0	0	0	113.7	Q91 Y93	Q91-D95 PolarHBondContact NE2-OD1 3.3Å; Q91-D95 VanDerWaalsContact O-CG 3.29Å; Q91-D95 PolarHBondContact O-N 2.04Å; Y93-D95 VanDerWaalsContact C-N 3.32Å
96	K	49.3	Very low	46.7	Very low	94 Å²	94	104.6 Å²	104.6	41%	0.409	52%	0.521	S	S	.	.	S	Bend	trans	-79.5	136.3	-179.4	-78.9	-179.5	179.6	177.8	0	112.5	L94 W100	L94-K96 VanDerWaalsContact C-N 3.28Å; L94-K96 PolarHBondContact O-N 2.9Å; K96-W100 HydrophobicContact CB-CD2 4.47Å; K96-W100 HydrophobicContact CB-CE3 3.65Å; K96-W100 HydrophobicContact CB-CZ3 4.05Å; K96-W100 HydrophobicContact CD-CD2 3.7Å; K96-W100 HydrophobicContact CD-CE3 3.23Å; K96-W100 HydrophobicContact CD-CH2 3.55Å; K96-W100 HydrophobicContact CD-CZ2 3.99Å; K96-W100 HydrophobicContact CD-CZ3 3.15Å; K96-W100 HydrophobicContact CG-CE3 4.07Å; K96-W100 HydrophobicContact CG-CZ3 4.23Å; K96-W100 VanDerWaalsContact NZ-CH2 3.25Å
97	P	45.1	Very low	45.8	Very low	99 Å²	99	103.5 Å²	103.5	64%	0.643	52%	0.52	S	S	*	.			trans	-67.9	151.6	-175.6	26.2	-33.4	0	0	0	113.5	N99 W100	P97-N99 PolarHBondContact O-N 3.49Å; P97-W100 PolarHBondContact O-N 3.47Å; P97-W100 VanDerWaalsContact O-N 3.15Å
98	K	45.9	Very low	44.6	Very low	165 Å²	165	100.2 Å²	100.2	72%	0.717	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-36.5	-39.5	-179.6	-100.6	179.8	173.9	179.4	0	116.1
99	N	45.3	Very low	43.9	Very low	116 Å²	116	102.9 Å²	102.9	62%	0.62	53%	0.525	S	S	*	.	H	α-helix	trans	-79.4	-19.6	-169.8	-73.3	-3.8	0	0	0	114.4	P97 L101 L102 Q103	P97-N99 PolarHBondContact O-N 3.49Å; N99-L101 PolarHBondContact O-N 2.98Å; N99-L102 PolarHBondContact O-N 3.4Å; N99-Q103 PolarHBondContact O-N 2.98Å
100	W	43.4	Very low	43	Very low	72 Å²	72	103.1 Å²	103.1	27%	0.273	53%	0.526	S	S	.	.	H	α-helix	trans	-66.6	-39.5	-174.3	167.9	55.7	0	0	0	113.1	Y93 K96 P97 Q103	Y93-W100 HydrophobicContact CD1-CH2 4.1Å; Y93-W100 HydrophobicContact CD1-CZ3 4.06Å; Y93-W100 AromaticContact CE1-CH2 3.71Å; Y93-W100 HydrophobicContact CE1-CH2 3.71Å; Y93-W100 HydrophobicContact CE1-CZ3 4.1Å; K96-W100 HydrophobicContact CB-CD2 4.47Å; K96-W100 HydrophobicContact CB-CE3 3.65Å; K96-W100 HydrophobicContact CB-CZ3 4.05Å; K96-W100 HydrophobicContact CD-CD2 3.7Å; K96-W100 HydrophobicContact CD-CE3 3.23Å; K96-W100 HydrophobicContact CD-CH2 3.55Å; K96-W100 HydrophobicContact CD-CZ2 3.99Å; K96-W100 HydrophobicContact CD-CZ3 3.15Å; K96-W100 HydrophobicContact CG-CE3 4.07Å; K96-W100 HydrophobicContact CG-CZ3 4.23Å; K96-W100 VanDerWaalsContact NZ-CH2 3.25Å; P97-W100 PolarHBondContact O-N 3.47Å; P97-W100 VanDerWaalsContact O-N 3.15Å; W100-Q103 PolarHBondContact O-N 3.26Å
101	L	39.4	Very low	41.8	Very low	84 Å²	84	104.1 Å²	104.1	44%	0.44	54%	0.537	S	S	.	.	H	α-helix	trans	-74	-33.6	-179.4	-78.6	169	0	0	0	112.4	N99 Q103	N99-L101 PolarHBondContact O-N 2.98Å; L101-Q103 VanDerWaalsContact C-N 3.3Å; L101-Q103 PolarHBondContact O-N 3.47Å
102	L	40.2	Very low	40.5	Very low	128 Å²	128	104.2 Å²	104.2	67%	0.67	54%	0.541	S	S	*	.	H	α-helix	trans	-70.6	-24.7	176.4	-75.3	162.5	0	0	0	112.9	N99 K104 T105	N99-L102 PolarHBondContact O-N 3.4Å; L102-K104 PolarHBondContact O-N 3.44Å; L102-T105 PolarHBondContact O-OG1 2.9Å
103	Q	38.5	Very low	39.1	Very low	154 Å²	154	105 Å²	105	72%	0.72	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-16.6	-174.8	-104	180	-13.1	0	0	115.2	N99 W100 L101	N99-Q103 PolarHBondContact O-N 2.98Å; W100-Q103 PolarHBondContact O-N 3.26Å; L101-Q103 VanDerWaalsContact C-N 3.3Å; L101-Q103 PolarHBondContact O-N 3.47Å
104	K	33.9	Very low	38	Very low	146 Å²	146	106 Å²	106	64%	0.635	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-7.1	-176.7	-87.3	-168.1	174.4	-173.2	0	115.5	L102 N106	L102-K104 PolarHBondContact O-N 3.44Å; K104-N106 PolarHBondContact O-N 2.94Å
105	T	34.9	Very low	36.7	Very low	112 Å²	112	106.6 Å²	106.6	69%	0.687	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-19.3	175.8	54.2	0	0	0	0	112.7	L102 N107	L102-T105 PolarHBondContact O-OG1 2.9Å; T105-N107 PolarHBondContact O-N 3.31Å
106	N	31.3	Very low	35.5	Very low	148 Å²	148	106.4 Å²	106.4	79%	0.791	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	28.3	178.5	-77.3	-2.6	0	0	0	114.2	K104 P108	K104-N106 PolarHBondContact O-N 2.94Å; N106-P108 WeakPolarHBondContact O-CD 3.46Å
107	N	31.8	Very low	34.5	Very low	91 Å²	91	110.5 Å²	110.5	49%	0.487	57%	0.573	S	S	.	*			trans	-88.7	104.7	167.6	-157.5	-17.6	0	0	0	109	T105 F109 L110	T105-N107 PolarHBondContact O-N 3.31Å; N107-F109 PolarHBondContact O-N 3.36Å; N107-L110 HydrophobicContact CB-CD1 4.45Å; N107-L110 PolarHBondContact O-N 3.07Å
108	P	28.7	Very low	33.7	Very low	99 Å²	99	111.7 Å²	111.7	64%	0.643	57%	0.573	S	S	*	*	H	α-helix	trans	-64	-5.4	-172.1	26.2	-34.8	0	0	0	114	N106 S111	N106-P108 WeakPolarHBondContact O-CD 3.46Å; P108-S111 PolarHBondContact O-OG 3.29Å
109	F	35.7	Very low	32.9	Very low	123 Å²	123	110.5 Å²	110.5	54%	0.539	57%	0.57	S	S	.	*	H	α-helix	trans	-82.7	-29.2	173.2	-148.8	-93.4	0	0	0	113.4	N107 L113	N107-F109 PolarHBondContact O-N 3.36Å; F109-L113 HydrophobicContact CD1-CD1 4.46Å; F109-L113 HydrophobicContact CE1-CD1 4.49Å
110	L	33.7	Very low	32	Very low	59 Å²	59	112 Å²	112	31%	0.309	58%	0.577	S	S	.	*	H	α-helix	trans	-74.7	-34.8	-179.6	-86.3	162	0	0	0	111.9	N107 N112 L113 I114	N107-L110 HydrophobicContact CB-CD1 4.45Å; N107-L110 PolarHBondContact O-N 3.07Å; L110-N112 PolarHBondContact O-N 3.38Å; L110-L113 PolarHBondContact O-N 3.43Å; L110-L113 VanDerWaalsContact O-N 3.14Å; L110-I114 HydrophobicContact CB-CD1 4.39Å; L110-I114 WeakPolarHBondContact O-CD1 3.41Å; L110-I114 VanDerWaalsContact O-CG1 3.22Å; L110-I114 WeakPolarHBondContact O-CG1 3.03Å; L110-I114 PolarHBondContact O-N 3.47Å; L110-I114 VanDerWaalsContact O-N 3.16Å
111	S	29.5	Very low	31.3	Very low	65 Å²	65	114.7 Å²	114.7	46%	0.455	60%	0.596	S	S	.	*	H	α-helix	trans	-60.7	-30.8	177.1	60.3	0	0	0	0	112.6	P108 I114 T115	P108-S111 PolarHBondContact O-OG 3.29Å; S111-I114 PolarHBondContact O-N 2.78Å; S111-T115 WeakPolarHBondContact O-CG2 3.42Å; S111-T115 PolarHBondContact O-N 3.33Å
112	N	27.8	Very low	30.9	Very low	100 Å²	100	114.7 Å²	114.7	54%	0.535	60%	0.602	S	S	.	*	H	α-helix	trans	-85.7	-5.8	179.9	-76.4	-20.2	0	0	0	115.2	L110 K154	L110-N112 PolarHBondContact O-N 3.38Å; N112-K154 PolarHBondContact O-NZ 3.09Å
113	L	26.4	Very low	30.3	Very low	81 Å²	81	117.3 Å²	117.3	42%	0.424	60%	0.604	S	S	.	*	H	α-helix	trans	-94.5	-24.3	165.2	-76.5	166.2	0	0	0	111.4	F109 L110	F109-L113 HydrophobicContact CD1-CD1 4.46Å; F109-L113 HydrophobicContact CE1-CD1 4.49Å; L110-L113 PolarHBondContact O-N 3.43Å; L110-L113 VanDerWaalsContact O-N 3.14Å
114	I	28.1	Very low	29.8	Very low	92 Å²	92	116.7 Å²	116.7	47%	0.472	61%	0.605	S	S	.	*	H	α-helix	trans	-82.8	-13.9	-176.8	-65.3	165.7	0	0	0	112.7	L110 S111 N116	L110-I114 HydrophobicContact CB-CD1 4.39Å; L110-I114 WeakPolarHBondContact O-CD1 3.41Å; L110-I114 VanDerWaalsContact O-CG1 3.22Å; L110-I114 WeakPolarHBondContact O-CG1 3.03Å; L110-I114 PolarHBondContact O-N 3.47Å; L110-I114 VanDerWaalsContact O-N 3.16Å; S111-I114 PolarHBondContact O-N 2.78Å; I114-N116 VanDerWaalsContact C-N 3.26Å; I114-N116 PolarHBondContact O-N 2.93Å
115	T	26.8	Very low	29.5	Very low	97 Å²	97	115.7 Å²	115.7	60%	0.595	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.9	6.1	-179.5	49.5	0	0	0	0	116.1	S111 K117	S111-T115 WeakPolarHBondContact O-CG2 3.42Å; S111-T115 PolarHBondContact O-N 3.33Å; T115-K117 PolarHBondContact O-N 3.02Å
116	N	30.8	Very low	29.3	Very low	110 Å²	110	116.4 Å²	116.4	59%	0.588	61%	0.607	S	S	*	*			trans	-79.8	68.7	165.6	-79.9	-3.7	0	0	0	110.1	I114 D118	I114-N116 VanDerWaalsContact C-N 3.26Å; I114-N116 PolarHBondContact O-N 2.93Å; N116-D118 PolarHBondContact O-N 3Å
117	K	26.8	Very low	29.3	Very low	180 Å²	180	115.9 Å²	115.9	78%	0.783	60%	0.604	S	S	*	*			trans	-81.6	6.4	171.8	-94.1	-174.4	176.5	-179.9	0	113.8	T115 H119	T115-K117 PolarHBondContact O-N 3.02Å; K117-H119 PolarHBondContact O-N 3.17Å
118	D	29.8	Very low	29.6	Very low	123 Å²	123	116.9 Å²	116.9	66%	0.658	61%	0.609	S	S	*	*			trans	-81.2	69	175.6	-62.8	-18.7	0	0	0	111	N116 I120	N116-D118 PolarHBondContact O-N 3Å; D118-I120 PolarHBondContact O-N 3.16Å
119	H	28.6	Very low	30.1	Very low	141 Å²	141	118.5 Å²	118.5	65%	0.653	61%	0.613	S	S	*	*			trans	-73.2	77.4	161.1	-80.6	-61.5	0	0	0	109.2	K117	K117-H119 PolarHBondContact O-N 3.17Å
120	I	26.4	Very low	30.8	Very low	147 Å²	147	119.4 Å²	119.4	75%	0.754	62%	0.623	S	S	*	*			trans	-87.7	101.7	154.8	-61.8	175.3	0	0	0	105.9	D118 P122	D118-I120 PolarHBondContact O-N 3.16Å; I120-P122 VanDerWaalsContact O-CD 3.29Å; I120-P122 WeakPolarHBondContact O-CD 3.15Å
121	N	27.6	Very low	31.3	Very low	128 Å²	128	124.6 Å²	124.6	68%	0.684	65%	0.645	S	S	*	*			trans	-62.9	115.8	164.6	-104.6	-15.7	0	0	0	107.6	Y123	N121-Y123 VanDerWaalsContact C-N 3.25Å; N121-Y123 PolarHBondContact O-N 3.39Å
122	P	31.1	Very low	31.8	Very low	85 Å²	85	125.1 Å²	125.1	55%	0.552	64%	0.643	S	S	*	*			trans	-80.8	-5.8	-178.7	27.6	-24.4	0	0	0	113.1	I120 N124	I120-P122 VanDerWaalsContact O-CD 3.29Å; I120-P122 WeakPolarHBondContact O-CD 3.15Å; P122-N124 PolarHBondContact O-N 3.46Å
123	Y	28.9	Very low	32.5	Very low	182 Å²	182	124.4 Å²	124.4	71%	0.714	64%	0.64	S	S	*	*			trans	-91.2	79.5	172.9	-77.7	-82.1	0	0	0	110.5	N121 Y440	N121-Y123 VanDerWaalsContact C-N 3.25Å; N121-Y123 PolarHBondContact O-N 3.39Å; Y123-Y440 WeakPolarHBondContact CE2-OH 3.23Å
124	N	27.8	Very low	33.3	Very low	141 Å²	141	130.3 Å²	130.3	75%	0.754	66%	0.656	S	S	*	*			trans	-98.6	102.6	146.7	-151.5	9.7	0	0	0	106.3	P122 N126	P122-N124 PolarHBondContact O-N 3.46Å; N124-N126 VanDerWaalsContact C-N 3.27Å; N124-N126 PolarHBondContact O-N 3.11Å
125	N	27	Very low	34.2	Very low	125 Å²	125	129.5 Å²	129.5	67%	0.668	66%	0.655	S	S	*	*			trans	-73	76.9	-170.7	-163.1	27.1	0	0	0	109.9
126	N	31.5	Very low	35.2	Very low	128 Å²	128	130.3 Å²	130.3	68%	0.684	65%	0.653	S	S	*	*			trans	-99.6	95.5	167.3	-79.7	-7.9	0	0	0	108.1	N124 N128	N124-N126 VanDerWaalsContact C-N 3.27Å; N124-N126 PolarHBondContact O-N 3.11Å; N126-N128 PolarHBondContact O-N 3Å
127	N	30.9	Very low	36.2	Very low	136 Å²	136	131.3 Å²	131.3	73%	0.727	65%	0.654	S	S	*	*			trans	-42.9	103.8	162.5	-69.7	-28.3	0	0	0	109.2
128	N	37	Very low	37.3	Very low	112 Å²	112	129.4 Å²	129.4	60%	0.599	65%	0.646	S	S	*	*			trans	-169.9	104.6	160.5	-89.7	-26.6	0	0	0	110.6	N126 N132	N126-N128 PolarHBondContact O-N 3Å; N128-N132 PolarHBondContact O-ND2 3.3Å
129	N	40.6	Very low	38.6	Very low	134 Å²	134	128.1 Å²	128.1	72%	0.717	64%	0.639	S	S	*	*			trans	58	116.4	141.9	-55.5	-21.6	0	0	0	119.4	E131 N132	N129-E131 PolarHBondContact O-N 2.62Å; N129-N132 PolarHBondContact O-N 3.19Å; N129-N132 VanDerWaalsContact O-N 3.11Å
130	N	48.7	Very low	40.1	Very low	141 Å²	141	125 Å²	125	75%	0.754	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-19.3	-16.8	173.6	-60.9	-13.6	0	0	0	121.6
131	E	45.1	Very low	41.9	Very low	168 Å²	168	122.2 Å²	122.2	79%	0.785	61%	0.611	S	S	*	*	H	α-helix	trans	-77.4	-28.9	171.1	-79.8	-177.3	153.9	0	0	111.9	N129 D133 R134	N129-E131 PolarHBondContact O-N 2.62Å; E131-D133 VanDerWaalsContact C-N 3.29Å; E131-D133 PolarHBondContact O-N 3.14Å; E131-R134 PolarHBondContact O-N 3.32Å
132	N	40.3	Very low	43.9	Very low	76 Å²	76	120.3 Å²	120.3	41%	0.406	60%	0.598	S	S	.	*	H	α-helix	trans	-69.1	-24.8	177.4	-74.4	-30.9	0	0	0	113.1	N128 N129 R134 T135 Q136	N128-N132 PolarHBondContact O-ND2 3.3Å; N129-N132 PolarHBondContact O-N 3.19Å; N129-N132 VanDerWaalsContact O-N 3.11Å; N132-R134 VanDerWaalsContact C-N 3.35Å; N132-R134 PolarHBondContact O-N 3.08Å; N132-T135 WeakPolarHBondContact CA-OG1 3.5Å; N132-T135 PolarHBondContact O-N 3.37Å; N132-T135 PolarHBondContact O-OG1 3.11Å; N132-Q136 WeakPolarHBondContact O-CB 3.23Å; N132-Q136 WeakPolarHBondContact O-CG 3.39Å; N132-Q136 PolarHBondContact O-N 2.73Å
133	D	42.9	Very low	45.6	Very low	86 Å²	86	121.2 Å²	121.2	46%	0.46	59%	0.591	S	S	.	*	H	α-helix	trans	-66.6	-37.5	179.1	-75.8	-16.8	0	0	0	112	E131 Q137	E131-D133 VanDerWaalsContact C-N 3.29Å; E131-D133 PolarHBondContact O-N 3.14Å; D133-Q137 VanDerWaalsContact O-CB 3.27Å; D133-Q137 WeakPolarHBondContact O-CB 3.28Å; D133-Q137 VanDerWaalsContact O-CG 3.3Å; D133-Q137 WeakPolarHBondContact O-CG 3.05Å; D133-Q137 PolarHBondContact O-N 2.64Å
134	R	43.6	Very low	47.4	Very low	205 Å²	205	114.4 Å²	114.4	77%	0.774	57%	0.567	S	S	*	*	H	α-helix	trans	-68.7	-43	177.7	-70.6	-172.5	-179.5	-146.9	1.6	111.4	E131 N132 F138	E131-R134 PolarHBondContact O-N 3.32Å; N132-R134 VanDerWaalsContact C-N 3.35Å; N132-R134 PolarHBondContact O-N 3.08Å; R134-F138 VanDerWaalsContact O-CB 3.24Å; R134-F138 WeakPolarHBondContact O-CB 3.38Å; R134-F138 PolarHBondContact O-N 3.49Å
135	T	45.8	Very low	49.7	Very low	74 Å²	74	112.4 Å²	112.4	45%	0.454	56%	0.556	S	S	.	*	H	α-helix	trans	-69.5	-38.1	177.5	55	0	0	0	0	111.5	N132 F138 N139	N132-T135 WeakPolarHBondContact CA-OG1 3.5Å; N132-T135 PolarHBondContact O-N 3.37Å; N132-T135 PolarHBondContact O-OG1 3.11Å; T135-F138 PolarHBondContact O-N 3.48Å; T135-N139 WeakPolarHBondContact O-CB 3.37Å; T135-N139 PolarHBondContact O-N 3.01Å; T135-N139 PolarHBondContact O-ND2 2.83Å
136	Q	48	Very low	52.3	Low	115 Å²	115	112.6 Å²	112.6	54%	0.537	55%	0.551	S	S	.	*	H	α-helix	trans	-64.9	-45.8	173.7	-74	175.6	19.4	0	0	112	N132 F138 N139 H140	N132-Q136 WeakPolarHBondContact O-CB 3.23Å; N132-Q136 WeakPolarHBondContact O-CG 3.39Å; N132-Q136 PolarHBondContact O-N 2.73Å; Q136-F138 VanDerWaalsContact C-N 3.32Å; Q136-F138 PolarHBondContact O-N 2.76Å; Q136-N139 PolarHBondContact O-N 2.83Å; Q136-H140 WeakPolarHBondContact O-CB 3.46Å; Q136-H140 PolarHBondContact O-N 2.77Å
137	Q	50.9	Low	54.5	Low	131 Å²	131	108.3 Å²	108.3	61%	0.612	53%	0.527	S	S	*	.	H	α-helix	trans	-61.3	-41.1	173.5	-79.8	-179.1	-3.1	0	0	111.7	D133 H140 N141	D133-Q137 VanDerWaalsContact O-CB 3.27Å; D133-Q137 WeakPolarHBondContact O-CB 3.28Å; D133-Q137 VanDerWaalsContact O-CG 3.3Å; D133-Q137 WeakPolarHBondContact O-CG 3.05Å; D133-Q137 PolarHBondContact O-N 2.64Å; Q137-H140 PolarHBondContact O-N 3.21Å; Q137-N141 WeakPolarHBondContact O-CB 3.27Å; Q137-N141 PolarHBondContact O-N 2.01Å; Q137-N141 PolarHBondContact O-ND2 2.99Å
138	F	50	Low	56.8	Low	140 Å²	140	103.1 Å²	103.1	61%	0.614	50%	0.5	S	S	*	.	H	α-helix	trans	-62.1	-48.2	176.7	-172	-92.6	0	0	0	111.7	R134 T135 Q136 H140 N141 Q142	R134-F138 VanDerWaalsContact O-CB 3.24Å; R134-F138 WeakPolarHBondContact O-CB 3.38Å; R134-F138 PolarHBondContact O-N 3.49Å; T135-F138 PolarHBondContact O-N 3.48Å; Q136-F138 VanDerWaalsContact C-N 3.32Å; Q136-F138 PolarHBondContact O-N 2.76Å; F138-H140 VanDerWaalsContact C-N 3.34Å; F138-H140 PolarHBondContact O-N 2.86Å; F138-N141 PolarHBondContact O-N 2.92Å; F138-Q142 WeakPolarHBondContact O-CB 3.24Å; F138-Q142 PolarHBondContact O-N 3.35Å
139	N	58	Low	59.1	Low	95 Å²	95	102.9 Å²	102.9	51%	0.508	50%	0.498	S	S	.	.	H	α-helix	trans	-62.9	-39.8	177.4	-72.3	-21.6	0	0	0	111.8	T135 Q136 Q142 Y143	T135-N139 WeakPolarHBondContact O-CB 3.37Å; T135-N139 PolarHBondContact O-N 3.01Å; T135-N139 PolarHBondContact O-ND2 2.83Å; Q136-N139 PolarHBondContact O-N 2.83Å; N139-Q142 PolarHBondContact O-N 2.97Å; N139-Y143 WeakPolarHBondContact O-CB 3.44Å; N139-Y143 PolarHBondContact O-N 3.24Å
140	H	60	Low	61.3	Low	75 Å²	75	99.1 Å²	99.1	35%	0.347	48%	0.482	S	S	.	.	H	α-helix	trans	-65.5	-45.6	177	-168.8	69.5	0	0	0	112.1	Q136 Q137 F138 Q142 Y143 I144	Q136-H140 WeakPolarHBondContact O-CB 3.46Å; Q136-H140 PolarHBondContact O-N 2.77Å; Q137-H140 PolarHBondContact O-N 3.21Å; F138-H140 VanDerWaalsContact C-N 3.34Å; F138-H140 PolarHBondContact O-N 2.86Å; H140-Q142 VanDerWaalsContact C-N 3.33Å; H140-Q142 PolarHBondContact O-N 3.45Å; H140-Y143 PolarHBondContact O-N 3.4Å; H140-I144 VanDerWaalsContact CD2-CD1 3.48Å; H140-I144 WeakPolarHBondContact CD2-CD1 3.05Å; H140-I144 VanDerWaalsContact NE2-CD1 3.32Å; H140-I144 WeakPolarHBondContact NE2-CD1 3.04Å; H140-I144 WeakPolarHBondContact O-CG1 3.36Å; H140-I144 PolarHBondContact O-N 3.31Å
141	N	64.6	Low	63.1	Low	90 Å²	90	94 Å²	94	48%	0.481	45%	0.454	S	S	.	.	H	α-helix	trans	-63	-40.9	176.1	-72.9	-21.7	0	0	0	111.3	Q137 F138 Y143 I144 N145	Q137-N141 WeakPolarHBondContact O-CB 3.27Å; Q137-N141 PolarHBondContact O-N 2.01Å; Q137-N141 PolarHBondContact O-ND2 2.99Å; F138-N141 PolarHBondContact O-N 2.92Å; N141-Y143 VanDerWaalsContact C-N 3.35Å; N141-Y143 PolarHBondContact O-N 2.99Å; N141-I144 PolarHBondContact O-N 3.12Å; N141-N145 WeakPolarHBondContact O-CB 3.4Å; N141-N145 PolarHBondContact O-N 2.79Å; N141-N145 PolarHBondContact O-ND2 2.93Å
142	Q	69.4	Low	65.1	Low	88 Å²	88	87.5 Å²	87.5	41%	0.411	43%	0.425	S	S	.	.	H	α-helix	trans	-62.9	-41.2	176.1	-165.7	-176.8	9	0	0	111.8	F138 N139 H140 N145 K146	F138-Q142 WeakPolarHBondContact O-CB 3.24Å; F138-Q142 PolarHBondContact O-N 3.35Å; N139-Q142 PolarHBondContact O-N 2.97Å; H140-Q142 VanDerWaalsContact C-N 3.33Å; H140-Q142 PolarHBondContact O-N 3.45Å; Q142-N145 PolarHBondContact O-N 3.45Å; Q142-K146 WeakPolarHBondContact O-CG 3.04Å; Q142-K146 PolarHBondContact O-N 3.3Å
143	Y	65.9	Low	67.4	Low	104 Å²	104	89.3 Å²	89.3	41%	0.408	43%	0.431	S	S	.	.	H	α-helix	trans	-63.9	-47	176	179.5	-98	0	0	0	112.2	N139 H140 N141 N145 K146 Q147	N139-Y143 WeakPolarHBondContact O-CB 3.44Å; N139-Y143 PolarHBondContact O-N 3.24Å; H140-Y143 PolarHBondContact O-N 3.4Å; N141-Y143 VanDerWaalsContact C-N 3.35Å; N141-Y143 PolarHBondContact O-N 2.99Å; Y143-N145 VanDerWaalsContact C-N 3.29Å; Y143-N145 PolarHBondContact O-N 3.45Å; Y143-K146 PolarHBondContact O-N 3.1Å; Y143-Q147 HydrophobicContact CD1-CG 4.35Å; Y143-Q147 HydrophobicContact CE1-CG 3.99Å; Y143-Q147 PolarHBondContact O-N 3.03Å; Y143-Q147 PolarHBondContact OH-NE2 3.15Å
144	I	66.5	Low	69.6	Low	39 Å²	39	89.6 Å²	89.6	20%	0.2	43%	0.428	C	S	.	.	H	α-helix	trans	-60.3	-41.9	177.1	-69.2	169.9	0	0	0	110.9	H140 N141 Q147 T148	H140-I144 VanDerWaalsContact CD2-CD1 3.48Å; H140-I144 WeakPolarHBondContact CD2-CD1 3.05Å; H140-I144 VanDerWaalsContact NE2-CD1 3.32Å; H140-I144 WeakPolarHBondContact NE2-CD1 3.04Å; H140-I144 WeakPolarHBondContact O-CG1 3.36Å; H140-I144 PolarHBondContact O-N 3.31Å; N141-I144 PolarHBondContact O-N 3.12Å; I144-Q147 PolarHBondContact O-N 3.25Å; I144-T148 WeakPolarHBondContact O-CB 3.4Å; I144-T148 PolarHBondContact O-N 3.15Å; I144-T148 PolarHBondContact O-OG1 3.44Å
145	N	77.8	Confident	71.7	Confident	98 Å²	98	81.3 Å²	81.3	52%	0.524	40%	0.398	S	S	.	.	H	α-helix	trans	-63.1	-44.9	177.6	-71.9	-16.1	0	0	0	111.4	N141 Q142 Y143 Q147 T148 L149	N141-N145 WeakPolarHBondContact O-CB 3.4Å; N141-N145 PolarHBondContact O-N 2.79Å; N141-N145 PolarHBondContact O-ND2 2.93Å; Q142-N145 PolarHBondContact O-N 3.45Å; Y143-N145 VanDerWaalsContact C-N 3.29Å; Y143-N145 PolarHBondContact O-N 3.45Å; N145-Q147 PolarHBondContact O-N 3.48Å; N145-T148 PolarHBondContact O-N 2.93Å; N145-L149 WeakPolarHBondContact O-CG 3.39Å; N145-L149 PolarHBondContact O-N 3.33Å
146	K	81.3	Confident	73.8	Confident	129 Å²	129	80.6 Å²	80.6	56%	0.561	39%	0.388	S	S	*	.	H	α-helix	trans	-59.3	-44.2	175.1	-75.3	178.1	179.3	-179.9	0	112.3	Q142 Y143 L149 S150	Q142-K146 WeakPolarHBondContact O-CG 3.04Å; Q142-K146 PolarHBondContact O-N 3.3Å; Y143-K146 PolarHBondContact O-N 3.1Å; K146-L149 PolarHBondContact O-N 3.28Å; K146-S150 PolarHBondContact O-N 3.31Å
147	Q	77.9	Confident	75.8	Confident	38 Å²	38	81.8 Å²	81.8	18%	0.178	39%	0.392	C	S	.	.	H	α-helix	trans	-61.8	-45.5	176.2	-73.4	-168.7	-26.4	0	0	112	Y143 I144 N145 L149 S150 I151	Y143-Q147 HydrophobicContact CD1-CG 4.35Å; Y143-Q147 HydrophobicContact CE1-CG 3.99Å; Y143-Q147 PolarHBondContact O-N 3.03Å; Y143-Q147 PolarHBondContact OH-NE2 3.15Å; I144-Q147 PolarHBondContact O-N 3.25Å; N145-Q147 PolarHBondContact O-N 3.48Å; Q147-L149 VanDerWaalsContact C-N 3.35Å; Q147-L149 PolarHBondContact O-N 2.92Å; Q147-S150 PolarHBondContact O-N 2.81Å; Q147-I151 WeakPolarHBondContact O-CD1 3.49Å; Q147-I151 VanDerWaalsContact O-CG1 3.26Å; Q147-I151 WeakPolarHBondContact O-CG1 3.24Å; Q147-I151 PolarHBondContact O-N 2.98Å
148	T	78.9	Confident	77.6	Confident	28 Å²	28	78.2 Å²	78.2	17%	0.172	37%	0.374	C	S	.	.	H	α-helix	trans	-63	-42.6	-178.9	-54.1	0	0	0	0	111.1	I144 N145 I151 I152 L447	I144-T148 WeakPolarHBondContact O-CB 3.4Å; I144-T148 PolarHBondContact O-N 3.15Å; I144-T148 PolarHBondContact O-OG1 3.44Å; N145-T148 PolarHBondContact O-N 2.93Å; T148-I151 WeakPolarHBondContact O-CB 3.46Å; T148-I151 PolarHBondContact O-N 3.5Å; T148-I152 HydrophobicContact CG2-CD1 4.07Å; T148-I152 VanDerWaalsContact O-CG1 3.29Å; T148-I152 WeakPolarHBondContact O-CG1 3.49Å; T148-I152 PolarHBondContact O-N 3.38Å; T148-L447 HydrophobicContact CG2-CD1 3.79Å
149	L	85.6	Confident	79.5	Confident	106 Å²	106	71.8 Å²	71.8	56%	0.555	35%	0.346	S	S	*	.	H	α-helix	trans	-61.7	-45.4	174.8	-71.2	170	0	0	0	112.1	N145 K146 Q147 I151 I152 E153	N145-L149 WeakPolarHBondContact O-CG 3.39Å; N145-L149 PolarHBondContact O-N 3.33Å; K146-L149 PolarHBondContact O-N 3.28Å; Q147-L149 VanDerWaalsContact C-N 3.35Å; Q147-L149 PolarHBondContact O-N 2.92Å; L149-I151 VanDerWaalsContact C-N 3.26Å; L149-I151 PolarHBondContact O-N 2.83Å; L149-I152 PolarHBondContact O-N 3.33Å; L149-I152 VanDerWaalsContact O-N 3.17Å; L149-E153 PolarHBondContact O-N 3.16Å
150	S	87	Confident	81	Confident	55 Å²	55	68.6 Å²	68.6	39%	0.385	33%	0.329	S	S	.	.	H	α-helix	trans	-58.7	-39.5	176	-177.1	0	0	0	0	112	K146 Q147 E153 K154	K146-S150 PolarHBondContact O-N 3.31Å; Q147-S150 PolarHBondContact O-N 2.81Å; S150-E153 PolarHBondContact O-N 3.14Å; S150-K154 WeakPolarHBondContact O-CG 3.16Å; S150-K154 PolarHBondContact O-N 3.05Å
151	I	84.9	Confident	82.5	Confident	33 Å²	33	71 Å²	71	17%	0.169	34%	0.343	C	S	.	.	H	α-helix	trans	-66.2	-45.8	176.5	-70.2	164	0	0	0	110.8	Q147 T148 L149 E153 K154 F155 L447 Y470	Q147-I151 WeakPolarHBondContact O-CD1 3.49Å; Q147-I151 VanDerWaalsContact O-CG1 3.26Å; Q147-I151 WeakPolarHBondContact O-CG1 3.24Å; Q147-I151 PolarHBondContact O-N 2.98Å; T148-I151 WeakPolarHBondContact O-CB 3.46Å; T148-I151 PolarHBondContact O-N 3.5Å; L149-I151 VanDerWaalsContact C-N 3.26Å; L149-I151 PolarHBondContact O-N 2.83Å; I151-E153 VanDerWaalsContact C-N 3.3Å; I151-E153 PolarHBondContact O-N 3.04Å; I151-K154 WeakPolarHBondContact O-CB 3.36Å; I151-K154 PolarHBondContact O-N 3.09Å; I151-K154 VanDerWaalsContact O-N 3.16Å; I151-F155 HydrophobicContact CG2-CD2 3.59Å; I151-F155 HydrophobicContact CG2-CE2 3.36Å; I151-F155 WeakPolarHBondContact O-CD2 3.1Å; I151-F155 PolarHBondContact O-N 3.46Å; I151-L447 HydrophobicContact CG2-CD2 4.11Å; I151-Y470 HydrophobicContact CD1-CD1 4.14Å; I151-Y470 HydrophobicContact CD1-CD2 3.49Å; I151-Y470 VanDerWaalsContact CD1-CD2 3.49Å; I151-Y470 HydrophobicContact CD1-CE1 4.04Å; I151-Y470 HydrophobicContact CD1-CE2 3.38Å; I151-Y470 HydrophobicContact CD1-CG 3.86Å; I151-Y470 HydrophobicContact CG2-CD1 4.21Å; I151-Y470 HydrophobicContact CG2-CG 4.26Å
152	I	87.2	Confident	83.7	Confident	32 Å²	32	69.2 Å²	69.2	16%	0.164	33%	0.332	C	S	.	.	H	α-helix	trans	-58.2	-42.6	176.3	-69.8	166.1	0	0	0	110.7	T148 L149 F155 K156 L447 V449 I454	T148-I152 HydrophobicContact CG2-CD1 4.07Å; T148-I152 VanDerWaalsContact O-CG1 3.29Å; T148-I152 WeakPolarHBondContact O-CG1 3.49Å; T148-I152 PolarHBondContact O-N 3.38Å; L149-I152 PolarHBondContact O-N 3.33Å; L149-I152 VanDerWaalsContact O-N 3.17Å; I152-F155 WeakPolarHBondContact O-CB 3.3Å; I152-F155 PolarHBondContact O-N 3.2Å; I152-K156 WeakPolarHBondContact O-CG 3.41Å; I152-K156 PolarHBondContact O-N 3.39Å; I152-L447 HydrophobicContact CG1-CD2 4.49Å; I152-V449 HydrophobicContact CG1-CG2 4.36Å; I152-I454 HydrophobicContact CG2-CG2 3.74Å
153	E	89.3	Confident	84.6	Confident	115 Å²	115	65.3 Å²	65.3	54%	0.537	31%	0.314	S	S	.	.	H	α-helix	trans	-63.7	-40.8	175.8	-72.8	-175.6	171.2	0	0	113	L149 S150 I151 F155 K156 K157	L149-E153 PolarHBondContact O-N 3.16Å; S150-E153 PolarHBondContact O-N 3.14Å; I151-E153 VanDerWaalsContact C-N 3.3Å; I151-E153 PolarHBondContact O-N 3.04Å; E153-F155 VanDerWaalsContact C-N 3.3Å; E153-F155 PolarHBondContact O-N 2.95Å; E153-K156 PolarHBondContact O-N 3.26Å; E153-K157 WeakPolarHBondContact O-CG 3.2Å; E153-K157 PolarHBondContact O-N 2.99Å; E153-K157 VanDerWaalsContact O-N 3.1Å
154	K	88.1	Confident	85.7	Confident	92 Å²	92	67.1 Å²	67.1	40%	0.4	33%	0.331	S	S	.	.	H	α-helix	trans	-61.2	-40.8	173.4	-71.9	-179.8	-174.5	-173.8	0	111	N112 S150 I151 K157 K158	N112-K154 PolarHBondContact O-NZ 3.09Å; S150-K154 WeakPolarHBondContact O-CG 3.16Å; S150-K154 PolarHBondContact O-N 3.05Å; I151-K154 WeakPolarHBondContact O-CB 3.36Å; I151-K154 PolarHBondContact O-N 3.09Å; I151-K154 VanDerWaalsContact O-N 3.16Å; K154-K157 PolarHBondContact O-N 3.32Å; K154-K158 PolarHBondContact O-N 3.27Å
155	F	88.1	Confident	86.7	Confident	30 Å²	30	66.3 Å²	66.3	13%	0.132	33%	0.327	C	S	.	.	H	α-helix	trans	-63.2	-46	175.2	-82.9	-65.8	0	0	0	112.4	I151 I152 E153 K157 K158 L159 L447 P468 N469 L538	I151-F155 HydrophobicContact CG2-CD2 3.59Å; I151-F155 HydrophobicContact CG2-CE2 3.36Å; I151-F155 WeakPolarHBondContact O-CD2 3.1Å; I151-F155 PolarHBondContact O-N 3.46Å; I152-F155 WeakPolarHBondContact O-CB 3.3Å; I152-F155 PolarHBondContact O-N 3.2Å; E153-F155 VanDerWaalsContact C-N 3.3Å; E153-F155 PolarHBondContact O-N 2.95Å; F155-K157 VanDerWaalsContact C-N 3.3Å; F155-K157 PolarHBondContact O-N 3.47Å; F155-K158 PolarHBondContact O-N 3.48Å; F155-K158 VanDerWaalsContact O-N 3.16Å; F155-L159 WeakPolarHBondContact O-CB 3.45Å; F155-L159 PolarHBondContact O-N 2.97Å; F155-L447 HydrophobicContact CE2-CD2 4.43Å; F155-P468 HydrophobicContact CD1-CB 4.11Å; F155-P468 HydrophobicContact CD2-CB 4.47Å; F155-P468 HydrophobicContact CD2-CG 4.42Å; F155-P468 HydrophobicContact CE1-CB 3.61Å; F155-P468 HydrophobicContact CE2-CB 4Å; F155-P468 HydrophobicContact CE2-CG 4.19Å; F155-P468 HydrophobicContact CZ-CB 3.57Å; F155-P468 HydrophobicContact CZ-CG 4.26Å; F155-N469 WeakPolarHBondContact CZ-O 3.4Å; F155-L538 HydrophobicContact CD1-CD1 4.41Å
156	K	90.2	Very high	86.9	Confident	60 Å²	60	71.6 Å²	71.6	26%	0.261	35%	0.345	S	S	.	.	H	α-helix	trans	-52.5	-49.9	174.8	-75.5	-177.8	169.9	-170.4	0	111.2	I152 E153 K158 L159 L160 I454 W456	I152-K156 WeakPolarHBondContact O-CG 3.41Å; I152-K156 PolarHBondContact O-N 3.39Å; E153-K156 PolarHBondContact O-N 3.26Å; K156-K158 PolarHBondContact O-N 3.04Å; K156-L159 PolarHBondContact O-N 2.94Å; K156-L160 PolarHBondContact O-N 2.94Å; K156-L160 VanDerWaalsContact O-N 3.13Å; K156-I454 VanDerWaalsContact CE-CB 3.42Å; K156-I454 HydrophobicContact CG-CD1 4.39Å; K156-I454 PolarHBondContact NZ-O 3.26Å; K156-I454 VanDerWaalsContact NZ-O 3.11Å; K156-W456 HydrophobicContact CB-CH2 3.59Å; K156-W456 HydrophobicContact CB-CZ2 3.78Å; K156-W456 HydrophobicContact CB-CZ3 4.41Å; K156-W456 HydrophobicContact CD-CZ2 4Å; K156-W456 HydrophobicContact CG-CH2 3.74Å; K156-W456 HydrophobicContact CG-CZ2 3.71Å; K156-W456 HydrophobicContact CG-CZ3 4.25Å; K156-W456 WeakPolarHBondContact O-CH2 3.41Å
157	K	90	Very high	87.2	Confident	139 Å²	139	70.6 Å²	70.6	60%	0.604	35%	0.35	S	S	*	.	H	α-helix	trans	-60.8	-45.2	178.4	-68.8	176.7	-176.5	177.8	0	112	E153 K154 F155 L159 L160 I161	E153-K157 WeakPolarHBondContact O-CG 3.2Å; E153-K157 PolarHBondContact O-N 2.99Å; E153-K157 VanDerWaalsContact O-N 3.1Å; K154-K157 PolarHBondContact O-N 3.32Å; F155-K157 VanDerWaalsContact C-N 3.3Å; F155-K157 PolarHBondContact O-N 3.47Å; K157-L159 VanDerWaalsContact C-N 3.34Å; K157-L159 PolarHBondContact O-N 3.13Å; K157-L160 PolarHBondContact O-N 3.29Å; K157-I161 WeakPolarHBondContact O-CD1 3.5Å; K157-I161 VanDerWaalsContact O-CG1 3.28Å; K157-I161 WeakPolarHBondContact O-CG1 3.24Å; K157-I161 PolarHBondContact O-N 3.37Å; K157-I161 VanDerWaalsContact O-N 3.15Å
158	K	89.2	Confident	87.6	Confident	56 Å²	56	71.4 Å²	71.4	24%	0.243	36%	0.357	C	S	.	.	H	α-helix	trans	-61.1	-42.1	178.1	-175.5	177.2	175.4	-174.6	0	112	K154 F155 K156 I161 Q162 N537 L538	K154-K158 PolarHBondContact O-N 3.27Å; F155-K158 PolarHBondContact O-N 3.48Å; F155-K158 VanDerWaalsContact O-N 3.16Å; K156-K158 PolarHBondContact O-N 3.04Å; K158-I161 PolarHBondContact O-N 3.32Å; K158-Q162 WeakPolarHBondContact O-CG 2.99Å; K158-Q162 PolarHBondContact O-N 3.24Å; K158-N537 PolarHBondContact NZ-O 3.1Å; K158-L538 HydrophobicContact CD-CD1 3.93Å; K158-L538 HydrophobicContact CG-CD1 4.39Å
159	L	89.9	Confident	87.9	Confident	5 Å²	5	70.3 Å²	70.3	3%	0.026	35%	0.351	C	S	.	.	H	α-helix	trans	-64.3	-48	-178.7	-162.7	157.5	0	0	0	110.9	F155 K156 K157 I161 Q162 L163 F451 W456 W459 I460 L535	F155-L159 WeakPolarHBondContact O-CB 3.45Å; F155-L159 PolarHBondContact O-N 2.97Å; K156-L159 PolarHBondContact O-N 2.94Å; K157-L159 VanDerWaalsContact C-N 3.34Å; K157-L159 PolarHBondContact O-N 3.13Å; L159-I161 VanDerWaalsContact C-N 3.32Å; L159-I161 PolarHBondContact O-N 3.18Å; L159-Q162 PolarHBondContact O-N 3.21Å; L159-L163 HydrophobicContact CD2-CD1 3.34Å; L159-L163 HydrophobicContact CD2-CG 3.87Å; L159-L163 WeakPolarHBondContact O-CG 3.1Å; L159-L163 PolarHBondContact O-N 3.26Å; L159-F451 HydrophobicContact CD1-CE1 3.99Å; L159-F451 HydrophobicContact CD1-CZ 4.28Å; L159-W456 HydrophobicContact CB-CZ3 4.16Å; L159-W456 HydrophobicContact CD1-CZ3 4.1Å; L159-W456 HydrophobicContact CD2-CZ3 3.95Å; L159-W456 HydrophobicContact CG-CZ3 4.29Å; L159-W459 HydrophobicContact CD2-CH2 4.13Å; L159-I460 HydrophobicContact CD2-CD1 4.42Å; L159-L535 HydrophobicContact CD1-CD1 4.24Å; L159-L535 HydrophobicContact CG-CD1 3.95Å
160	L	90.1	Very high	87.6	Confident	29 Å²	29	72.5 Å²	72.5	15%	0.152	36%	0.363	C	S	.	.	H	α-helix	trans	-58.7	-43.2	176.7	-71.1	171.3	0	0	0	112.3	K156 K157 L163 N164 L165 V168 W456 W459	K156-L160 PolarHBondContact O-N 2.94Å; K156-L160 VanDerWaalsContact O-N 3.13Å; K157-L160 PolarHBondContact O-N 3.29Å; L160-L163 PolarHBondContact O-N 3.48Å; L160-N164 PolarHBondContact O-N 3.43Å; L160-N164 VanDerWaalsContact O-N 3.14Å; L160-L165 HydrophobicContact CD2-CB 3.96Å; L160-L165 HydrophobicContact CD2-CD1 4.35Å; L160-L165 PolarHBondContact O-N 3.48Å; L160-V168 HydrophobicContact CD1-CG2 4.26Å; L160-V168 HydrophobicContact CD2-CG2 4.2Å; L160-W456 HydrophobicContact CD1-CH2 4.17Å; L160-W456 HydrophobicContact CD1-CZ2 4.21Å; L160-W456 HydrophobicContact CD2-CH2 4.27Å; L160-W456 HydrophobicContact CG-CH2 3.86Å; L160-W456 HydrophobicContact CG-CZ2 4.32Å; L160-W459 HydrophobicContact CD2-CH2 4.3Å; L160-W459 HydrophobicContact CD2-CZ2 4.49Å
161	I	90.8	Very high	87	Confident	124 Å²	124	70.5 Å²	70.5	64%	0.636	35%	0.347	S	S	*	.	H	α-helix	trans	-62.1	-46.6	177	-67.8	166	0	0	0	111	K157 K158 L159 L163 N164	K157-I161 WeakPolarHBondContact O-CD1 3.5Å; K157-I161 VanDerWaalsContact O-CG1 3.28Å; K157-I161 WeakPolarHBondContact O-CG1 3.24Å; K157-I161 PolarHBondContact O-N 3.37Å; K157-I161 VanDerWaalsContact O-N 3.15Å; K158-I161 PolarHBondContact O-N 3.32Å; L159-I161 VanDerWaalsContact C-N 3.32Å; L159-I161 PolarHBondContact O-N 3.18Å; I161-L163 VanDerWaalsContact C-N 3.3Å; I161-L163 PolarHBondContact O-N 3.19Å; I161-N164 PolarHBondContact O-N 2.77Å; I161-N164 PolarHBondContact O-OD1 3.15Å
162	Q	90	Very high	86.3	Confident	53 Å²	53	72.6 Å²	72.6	25%	0.248	36%	0.359	C	S	.	.	H	α-helix	trans	-68.9	-27.6	-179.4	-74.8	-167.4	-15.1	0	0	113.5	K158 L159 N164 L535 H536	K158-Q162 WeakPolarHBondContact O-CG 2.99Å; K158-Q162 PolarHBondContact O-N 3.24Å; L159-Q162 PolarHBondContact O-N 3.21Å; Q162-N164 VanDerWaalsContact C-N 3.26Å; Q162-L535 HydrophobicContact CB-CD2 3.72Å; Q162-H536 PolarHBondContact NE2-O 3.45Å; Q162-H536 VanDerWaalsContact NE2-O 3.13Å
163	L	88.3	Confident	85.2	Confident	7 Å²	7	74.1 Å²	74.1	4%	0.037	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-1.3	172.2	-66.9	-172.7	0	0	0	113.3	L159 L160 I161 L165 W459 Y523 H533 L535	L159-L163 HydrophobicContact CD2-CD1 3.34Å; L159-L163 HydrophobicContact CD2-CG 3.87Å; L159-L163 WeakPolarHBondContact O-CG 3.1Å; L159-L163 PolarHBondContact O-N 3.26Å; L160-L163 PolarHBondContact O-N 3.48Å; I161-L163 VanDerWaalsContact C-N 3.3Å; I161-L163 PolarHBondContact O-N 3.19Å; L163-L165 HydrophobicContact CB-CD1 3.92Å; L163-L165 HydrophobicContact CB-CG 3.86Å; L163-L165 HydrophobicContact CD1-CD1 3.97Å; L163-L165 PolarHBondContact O-N 3.5Å; L163-W459 HydrophobicContact CD1-CH2 4.05Å; L163-W459 HydrophobicContact CD1-CZ3 3.9Å; L163-Y523 HydrophobicContact CD1-CD1 4.06Å; L163-Y523 HydrophobicContact CD1-CD2 4.45Å; L163-Y523 HydrophobicContact CD1-CE1 3.99Å; L163-Y523 HydrophobicContact CD1-CE2 4.38Å; L163-Y523 HydrophobicContact CD1-CG 4.29Å; L163-Y523 HydrophobicContact CD2-CD1 4.22Å; L163-Y523 HydrophobicContact CD2-CE1 3.59Å; L163-Y523 HydrophobicContact CG-CE1 4.33Å; L163-H533 HydrophobicContact CD2-CB 3.66Å; L163-L535 HydrophobicContact CD2-CD2 3.66Å; L163-L535 HydrophobicContact CG-CD2 4.16Å
164	N	89.2	Confident	84.2	Confident	142 Å²	142	75.2 Å²	75.2	76%	0.759	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	32.2	-173.2	-63.2	-31.6	0	0	0	113.6	L160 I161 Q162	L160-N164 PolarHBondContact O-N 3.43Å; L160-N164 VanDerWaalsContact O-N 3.14Å; I161-N164 PolarHBondContact O-N 2.77Å; I161-N164 PolarHBondContact O-OD1 3.15Å; Q162-N164 VanDerWaalsContact C-N 3.26Å
165	L	86.4	Confident	83.2	Confident	22 Å²	22	73.6 Å²	73.6	12%	0.115	37%	0.372	C	S	.	.			trans	-95.9	127.1	177.6	-63.6	176.5	0	0	0	110.2	L160 L163 P169 W459 Y523 D525	L160-L165 HydrophobicContact CD2-CB 3.96Å; L160-L165 HydrophobicContact CD2-CD1 4.35Å; L160-L165 PolarHBondContact O-N 3.48Å; L163-L165 HydrophobicContact CB-CD1 3.92Å; L163-L165 HydrophobicContact CB-CG 3.86Å; L163-L165 HydrophobicContact CD1-CD1 3.97Å; L163-L165 PolarHBondContact O-N 3.5Å; L165-P169 HydrophobicContact CD1-CG 4.23Å; L165-W459 HydrophobicContact CD1-CE3 4.44Å; L165-W459 HydrophobicContact CD1-CH2 4.03Å; L165-W459 HydrophobicContact CD1-CZ3 3.64Å; L165-Y523 HydrophobicContact CD1-CD2 4.29Å; L165-Y523 HydrophobicContact CD1-CE2 3.95Å; L165-Y523 HydrophobicContact CD2-CE2 4.39Å; L165-D525 WeakPolarHBondContact CD2-OD1 3.03Å
166	K	83	Confident	82.4	Confident	208 Å²	208	79.8 Å²	79.8	90%	0.904	40%	0.402	S	S	*	.	S	Bend	trans	-73.7	-38.8	177.4	-67.1	-177.6	179.8	178.1	0	112.1
167	T	86.2	Confident	81.3	Confident	108 Å²	108	80.4 Å²	80.4	66%	0.663	41%	0.413	S	S	*	.	S	Bend	trans	-141.1	158.6	-179.2	53.8	0	0	0	0	109.2
168	V	87.6	Confident	80.4	Confident	56 Å²	56	74.2 Å²	74.2	34%	0.339	39%	0.386	S	S	.	.			trans	-60.9	129.3	173.1	177.1	0	0	0	0	109.1	L160 N170 W456 W459	L160-V168 HydrophobicContact CD1-CG2 4.26Å; L160-V168 HydrophobicContact CD2-CG2 4.2Å; V168-N170 PolarHBondContact O-N 2.88Å; V168-W456 HydrophobicContact CG2-CZ2 3.87Å; V168-W459 HydrophobicContact CG1-CG 4.44Å; V168-W459 HydrophobicContact CG1-CZ2 4.38Å; V168-W459 VanDerWaalsContact CG1-NE1 3.29Å
169	P	85.2	Confident	79.5	Confident	5 Å²	5	72.8 Å²	72.8	3%	0.032	38%	0.38	C	S	.	.			trans	-59.6	129.3	174.2	-23.9	34.6	0	0	0	111	L165 I171 W459	L165-P169 HydrophobicContact CD1-CG 4.23Å; P169-I171 HydrophobicContact CB-CD1 4.16Å; P169-I171 HydrophobicContact CB-CG1 4.07Å; P169-I171 PolarHBondContact O-N 3.43Å; P169-W459 HydrophobicContact CB-CB 4.27Å; P169-W459 HydrophobicContact CG-CD2 4.21Å; P169-W459 HydrophobicContact CG-CE3 3.95Å; P169-W459 HydrophobicContact CG-CG 4.46Å
170	N	79.6	Confident	78.9	Confident	151 Å²	151	77 Å²	77	81%	0.807	40%	0.402	S	S	*	.			trans	-91.2	103.8	173.9	-170.6	14.1	0	0	0	109.1	V168	V168-N170 PolarHBondContact O-N 2.88Å
171	I	74.1	Confident	78.5	Confident	13 Å²	13	77.5 Å²	77.5	7%	0.067	41%	0.408	C	S	.	.			trans	-115.5	126.7	-175.3	-56.5	-170.9	0	0	0	107.9	P169 E178 W459 L524	P169-I171 HydrophobicContact CB-CD1 4.16Å; P169-I171 HydrophobicContact CB-CG1 4.07Å; P169-I171 PolarHBondContact O-N 3.43Å; I171-E178 WeakPolarHBondContact CG2-OE2 3.44Å; I171-W459 HydrophobicContact CD1-CB 3.49Å; I171-W459 VanDerWaalsContact CD1-CB 3.49Å; I171-W459 HydrophobicContact CG1-CB 4.08Å; I171-L524 HydrophobicContact CD1-CB 3.19Å; I171-L524 HydrophobicContact CD1-CD1 3.78Å; I171-L524 HydrophobicContact CD1-CG 4.13Å; I171-L524 HydrophobicContact CG2-CD1 4.23Å
172	N	70.2	Confident	78.2	Confident	78 Å²	78	71.9 Å²	71.9	42%	0.417	38%	0.38	S	S	.	.			trans	-111.2	92.6	-178.7	-175.5	5.9	0	0	0	109.6	N174 N175 E178	N172-N174 PolarHBondContact O-N 3.39Å; N172-N174 PolarHBondContact OD1-N 2.99Å; N172-N175 WeakPolarHBondContact O-CB 3.24Å; N172-N175 PolarHBondContact O-N 2.78Å; N172-E178 WeakPolarHBondContact CA-OE2 3.29Å; N172-E178 PolarHBondContact N-OE1 3.35Å; N172-E178 PolarHBondContact N-OE2 2.88Å
173	I	64.4	Low	78.2	Confident	63 Å²	63	69.5 Å²	69.5	32%	0.323	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-19.4	-176	-63.2	163.5	0	0	0	113.3	N175 W179 I194 N458	I173-N175 PolarHBondContact O-N 3.12Å; I173-W179 HydrophobicContact CG2-CH2 4.08Å; I173-W179 HydrophobicContact CG2-CZ2 3.42Å; I173-W179 VanDerWaalsContact CG2-CZ2 3.42Å; I173-W179 PolarHBondContact O-NE1 2.92Å; I173-I194 HydrophobicContact CG2-CD1 3.71Å; I173-N458 HydrophobicContact CD1-CB 4.11Å
174	N	66.6	Low	78.1	Confident	138 Å²	138	70.7 Å²	70.7	74%	0.738	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-14.3	179	-61.3	-12.5	0	0	0	113.7	N172	N172-N174 PolarHBondContact O-N 3.39Å; N172-N174 PolarHBondContact OD1-N 2.99Å
175	N	68.5	Low	78.1	Confident	58 Å²	58	65.9 Å²	65.9	31%	0.31	35%	0.348	S	S	.	.			trans	-82.5	122.5	-177.2	-68.4	-25.4	0	0	0	112.1	N172 I173 S177 E178 W179	N172-N175 WeakPolarHBondContact O-CB 3.24Å; N172-N175 PolarHBondContact O-N 2.78Å; I173-N175 PolarHBondContact O-N 3.12Å; N175-S177 PolarHBondContact O-N 2.89Å; N175-E178 HydrophobicContact CB-CB 4.31Å; N175-E178 HydrophobicContact CB-CG 3.81Å; N175-E178 PolarHBondContact ND2-OE1 3.16Å; N175-E178 WeakPolarHBondContact O-CB 3.03Å; N175-E178 PolarHBondContact O-N 3.25Å; N175-W179 PolarHBondContact O-N 2.92Å
176	E	70.7	Confident	78.2	Confident	161 Å²	161	64.9 Å²	64.9	75%	0.752	34%	0.343	S	S	*	.	H	α-helix	trans	-57.5	-34.1	175.7	-71.4	-172	165	0	0	113.7	E178 W179 N180	E176-E178 PolarHBondContact O-N 2.74Å; E176-W179 WeakPolarHBondContact O-CB 3.39Å; E176-W179 PolarHBondContact O-N 3.22Å; E176-N180 PolarHBondContact O-N 3.46Å; E176-N180 VanDerWaalsContact O-N 3.12Å
177	S	68.2	Low	78.4	Confident	72 Å²	72	56.9 Å²	56.9	50%	0.503	31%	0.307	S	S	.	.	H	α-helix	trans	-61.3	-32.4	176.4	56.4	0	0	0	0	112.9	N175 N180 R528	N175-S177 PolarHBondContact O-N 2.89Å; S177-N180 PolarHBondContact O-N 2.9Å; S177-R528 PolarHBondContact OG-NH1 3.25Å
178	E	70.1	Confident	78.4	Confident	9 Å²	9	55.6 Å²	55.6	4%	0.042	30%	0.296	C	S	.	.	H	α-helix	trans	-74.5	-35.7	177.9	-63.5	179.7	-158.8	0	0	111	I171 N172 N175 E176 N180 S181 R528	I171-E178 WeakPolarHBondContact CG2-OE2 3.44Å; N172-E178 WeakPolarHBondContact CA-OE2 3.29Å; N172-E178 PolarHBondContact N-OE1 3.35Å; N172-E178 PolarHBondContact N-OE2 2.88Å; N175-E178 HydrophobicContact CB-CB 4.31Å; N175-E178 HydrophobicContact CB-CG 3.81Å; N175-E178 PolarHBondContact ND2-OE1 3.16Å; N175-E178 WeakPolarHBondContact O-CB 3.03Å; N175-E178 PolarHBondContact O-N 3.25Å; E176-E178 PolarHBondContact O-N 2.74Å; E178-N180 VanDerWaalsContact C-N 3.3Å; E178-N180 PolarHBondContact O-N 3.17Å; E178-S181 PolarHBondContact O-OG 2.75Å; E178-S181 VanDerWaalsContact O-OG 3.09Å; E178-R528 IonicContact OE1-CZ 3.57Å; E178-R528 IonicContact OE1-NE 2.7Å; E178-R528 IonicContact OE1-NH1 3.97Å; E178-R528 IonicContact OE1-NH2 3.85Å
179	W	70.4	Confident	78.3	Confident	27 Å²	27	56.1 Å²	56.1	10%	0.102	29%	0.292	C	S	.	.	H	α-helix	trans	-63.7	-37.4	173.3	-71.8	108.7	0	0	0	112.5	I173 N175 E176 S181 L182 R187 L190 K191 I194	I173-W179 HydrophobicContact CG2-CH2 4.08Å; I173-W179 HydrophobicContact CG2-CZ2 3.42Å; I173-W179 VanDerWaalsContact CG2-CZ2 3.42Å; I173-W179 PolarHBondContact O-NE1 2.92Å; N175-W179 PolarHBondContact O-N 2.92Å; E176-W179 WeakPolarHBondContact O-CB 3.39Å; E176-W179 PolarHBondContact O-N 3.22Å; W179-S181 VanDerWaalsContact C-N 3.33Å; W179-S181 PolarHBondContact O-N 2.92Å; W179-L182 HydrophobicContact CE3-CD1 4.16Å; W179-L182 HydrophobicContact CZ3-CD1 4.38Å; W179-L182 PolarHBondContact O-N 3.38Å; W179-R187 HydrophobicContact CB-CG 4.31Å; W179-R187 HydrophobicContact CD2-CG 4.27Å; W179-R187 HydrophobicContact CE3-CB 4.12Å; W179-R187 HydrophobicContact CE3-CG 3.58Å; W179-R187 HydrophobicContact CZ3-CG 4.19Å; W179-R187 WeakPolarHBondContact CZ3-O 3.46Å; W179-R187 PolarHBondContact O-NE 3.41Å; W179-R187 PolarHBondContact O-NH2 3.05Å; W179-L190 HydrophobicContact CH2-CB 3.53Å; W179-L190 HydrophobicContact CH2-CD1 4.46Å; W179-L190 HydrophobicContact CZ3-CB 3.58Å; W179-L190 HydrophobicContact CZ3-CD1 4.04Å; W179-L190 HydrophobicContact CZ3-CG 4.45Å; W179-K191 HydrophobicContact CH2-CG 3.84Å; W179-K191 HydrophobicContact CZ2-CG 4.07Å; W179-K191 HydrophobicContact CZ3-CG 4.12Å; W179-I194 HydrophobicContact CH2-CD1 3.89Å; W179-I194 HydrophobicContact CZ2-CD1 3.71Å
180	N	77.9	Confident	78.2	Confident	92 Å²	92	57.2 Å²	57.2	49%	0.492	30%	0.298	S	S	.	.	H	α-helix	trans	-69.9	-26.1	-175.5	-72.8	-17.6	0	0	0	114.1	E176 S177 E178 L182 R187 K404	E176-N180 PolarHBondContact O-N 3.46Å; E176-N180 VanDerWaalsContact O-N 3.12Å; S177-N180 PolarHBondContact O-N 2.9Å; E178-N180 VanDerWaalsContact C-N 3.3Å; E178-N180 PolarHBondContact O-N 3.17Å; N180-L182 VanDerWaalsContact C-N 3.35Å; N180-R187 PolarHBondContact O-NH2 2.97Å; N180-K404 PolarHBondContact O-NZ 3Å
181	S	80.3	Confident	78.3	Confident	41 Å²	41	54.4 Å²	54.4	29%	0.287	28%	0.278	S	S	.	.	H	α-helix	trans	-75	-27	174.5	72.5	0	0	0	0	112.5	E178 W179 R528	E178-S181 PolarHBondContact O-OG 2.75Å; E178-S181 VanDerWaalsContact O-OG 3.09Å; W179-S181 VanDerWaalsContact C-N 3.33Å; W179-S181 PolarHBondContact O-N 2.92Å; S181-R528 WeakPolarHBondContact CB-O 3.17Å; S181-R528 PolarHBondContact OG-O 2.98Å
182	L	85.9	Confident	78.7	Confident	6 Å²	6	58.4 Å²	58.4	3%	0.031	30%	0.3	C	S	.	.	S	Bend	trans	-74.6	140.1	176.4	-69.6	172.8	0	0	0	111.6	W179 N180 R187 L190 I461 L524 L530	W179-L182 HydrophobicContact CE3-CD1 4.16Å; W179-L182 HydrophobicContact CZ3-CD1 4.38Å; W179-L182 PolarHBondContact O-N 3.38Å; N180-L182 VanDerWaalsContact C-N 3.35Å; L182-R187 PolarHBondContact O-NH2 3.16Å; L182-L190 HydrophobicContact CD1-CD1 3.86Å; L182-I461 HydrophobicContact CD2-CD1 3.64Å; L182-L524 HydrophobicContact CD2-CD1 4.14Å; L182-L524 HydrophobicContact CD2-CD2 3.66Å; L182-L524 HydrophobicContact CD2-CG 4.18Å; L182-L524 HydrophobicContact CG-CD2 4.45Å; L182-L530 HydrophobicContact CD2-CD1 4.09Å
183	P	88.6	Confident	79	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.013	29%	0.292	C	S	.	.			trans	-53.4	142.3	167.8	-24.7	32.7	0	0	0	111.7	I185 L186 R187 E253 K404 V406 L530	P183-I185 HydrophobicContact CB-CG2 4.17Å; P183-I185 PolarHBondContact O-N 2.92Å; P183-I185 VanDerWaalsContact O-N 3.1Å; P183-L186 HydrophobicContact CG-CD1 4.29Å; P183-L186 PolarHBondContact O-N 3.48Å; P183-R187 PolarHBondContact O-N 3.05Å; P183-E253 WeakPolarHBondContact CA-OE2 3.41Å; P183-K404 HydrophobicContact CB-CB 4.3Å; P183-K404 HydrophobicContact CG-CB 4.06Å; P183-K404 HydrophobicContact CG-CG 4.12Å; P183-V406 HydrophobicContact CB-CG2 4.1Å; P183-V406 HydrophobicContact CG-CG2 3.82Å; P183-L530 HydrophobicContact CG-CD2 3.8Å
184	I	87.7	Confident	79.6	Confident	32 Å²	32	57 Å²	57	16%	0.164	29%	0.29	C	S	.	.	H	α-helix	trans	-51.4	-40.1	-176.4	-69.7	163.2	0	0	0	111.9	L186 R187 N188 E253 S355 M356	I184-L186 PolarHBondContact O-N 3.34Å; I184-R187 PolarHBondContact O-N 2.59Å; I184-N188 WeakPolarHBondContact CG2-ND2 3.45Å; I184-N188 WeakPolarHBondContact O-CB 3.22Å; I184-N188 VanDerWaalsContact O-CG 3.22Å; I184-N188 PolarHBondContact O-N 3.43Å; I184-E253 HydrophobicContact CD1-CG 3.99Å; I184-E253 HydrophobicContact CG1-CG 4.48Å; I184-E253 WeakPolarHBondContact CG1-OE2 3.5Å; I184-E253 PolarHBondContact N-OE2 3.23Å; I184-S355 WeakPolarHBondContact CD1-OG 3.44Å; I184-M356 HydrophobicContact CB-SD 4.19Å; I184-M356 HydrophobicContact CD1-CB 4.39Å; I184-M356 HydrophobicContact CG2-SD 4.19Å
185	I	89	Confident	80.1	Confident	41 Å²	41	54.2 Å²	54.2	21%	0.21	28%	0.276	C	S	.	.	H	α-helix	trans	-60.4	-44	177.8	-174.2	61.3	0	0	0	112.8	P183 R189 H251 M356 V406	P183-I185 HydrophobicContact CB-CG2 4.17Å; P183-I185 PolarHBondContact O-N 2.92Å; P183-I185 VanDerWaalsContact O-N 3.1Å; I185-R189 VanDerWaalsContact O-CB 3.31Å; I185-R189 WeakPolarHBondContact O-CB 3.38Å; I185-R189 PolarHBondContact O-N 3.44Å; I185-R189 VanDerWaalsContact O-N 3.09Å; I185-H251 HydrophobicContact CG2-CB 4.28Å; I185-M356 HydrophobicContact CB-CE 4.28Å; I185-V406 HydrophobicContact CG2-CB 4.33Å
186	L	87.8	Confident	80.2	Confident	1 Å²	1	55.3 Å²	55.3	1%	0.005	28%	0.28	C	S	.	.	H	α-helix	trans	-74.1	-37.6	179.4	-60.2	-175.8	0	0	0	110.9	P183 I184 R189 L190 L214 I461 L522 L530	P183-L186 HydrophobicContact CG-CD1 4.29Å; P183-L186 PolarHBondContact O-N 3.48Å; I184-L186 PolarHBondContact O-N 3.34Å; L186-R189 PolarHBondContact O-N 2.95Å; L186-L190 WeakPolarHBondContact O-CG 3.47Å; L186-L190 PolarHBondContact O-N 2.97Å; L186-L214 HydrophobicContact CD2-CD1 3.66Å; L186-L214 HydrophobicContact CD2-CD2 4.5Å; L186-I461 HydrophobicContact CD1-CG2 4.43Å; L186-I461 HydrophobicContact CD2-CG2 4.49Å; L186-L522 HydrophobicContact CD1-CD2 3.94Å; L186-L530 HydrophobicContact CD1-CD1 4.33Å; L186-L530 HydrophobicContact CD1-CD2 3.64Å
187	R	86.8	Confident	80.3	Confident	41 Å²	41	52.2 Å²	52.2	16%	0.155	27%	0.273	C	S	.	.	H	α-helix	trans	-57.7	-54.5	174	-179.6	-175.1	-49.6	160.2	17.8	111.2	W179 N180 L182 P183 I184 R189 L190 K191	W179-R187 HydrophobicContact CB-CG 4.31Å; W179-R187 HydrophobicContact CD2-CG 4.27Å; W179-R187 HydrophobicContact CE3-CB 4.12Å; W179-R187 HydrophobicContact CE3-CG 3.58Å; W179-R187 HydrophobicContact CZ3-CG 4.19Å; W179-R187 WeakPolarHBondContact CZ3-O 3.46Å; W179-R187 PolarHBondContact O-NE 3.41Å; W179-R187 PolarHBondContact O-NH2 3.05Å; N180-R187 PolarHBondContact O-NH2 2.97Å; L182-R187 PolarHBondContact O-NH2 3.16Å; P183-R187 PolarHBondContact O-N 3.05Å; I184-R187 PolarHBondContact O-N 2.59Å; R187-R189 VanDerWaalsContact C-N 3.28Å; R187-R189 PolarHBondContact O-N 3.38Å; R187-L190 PolarHBondContact O-N 3.49Å; R187-K191 HydrophobicContact CG-CD 4.4Å; R187-K191 WeakPolarHBondContact O-CB 3.28Å; R187-K191 WeakPolarHBondContact O-CG 3.28Å; R187-K191 PolarHBondContact O-N 2.89Å
188	N	87	Confident	80.5	Confident	80 Å²	80	54.3 Å²	54.3	43%	0.428	28%	0.278	S	S	.	.	H	α-helix	trans	-61.8	-39.8	-179.3	-69.2	-9.6	0	0	0	111.1	I184 N192	I184-N188 WeakPolarHBondContact CG2-ND2 3.45Å; I184-N188 WeakPolarHBondContact O-CB 3.22Å; I184-N188 VanDerWaalsContact O-CG 3.22Å; I184-N188 PolarHBondContact O-N 3.43Å; N188-N192 WeakPolarHBondContact O-CB 3.36Å; N188-N192 PolarHBondContact O-N 3.37Å; N188-N192 PolarHBondContact O-OD1 3.45Å
189	R	85.3	Confident	80.4	Confident	68 Å²	68	61.3 Å²	61.3	26%	0.257	31%	0.311	S	S	.	.	H	α-helix	trans	-59.5	-54.8	175.7	-177.5	-161.9	173.1	84.8	-1.2	112.3	I185 L186 R187 K191 N192 E193 E212	I185-R189 VanDerWaalsContact O-CB 3.31Å; I185-R189 WeakPolarHBondContact O-CB 3.38Å; I185-R189 PolarHBondContact O-N 3.44Å; I185-R189 VanDerWaalsContact O-N 3.09Å; L186-R189 PolarHBondContact O-N 2.95Å; R187-R189 VanDerWaalsContact C-N 3.28Å; R187-R189 PolarHBondContact O-N 3.38Å; R189-K191 VanDerWaalsContact C-N 3.31Å; R189-K191 PolarHBondContact O-N 2.92Å; R189-N192 WeakPolarHBondContact O-CB 3.32Å; R189-N192 PolarHBondContact O-N 2.95Å; R189-E193 IonicContact CZ-OE1 3.89Å; R189-E193 IonicContact NE-OE1 3.65Å; R189-E193 PolarHBondContact NE-OE1 3.38Å; R189-E193 IonicContact NH2-OE1 3.53Å; R189-E193 PolarHBondContact NH2-OE1 3.44Å; R189-E193 PolarHBondContact O-N 3.11Å; R189-E212 IonicContact CZ-OE1 2.97Å; R189-E212 IonicContact CZ-OE2 3.41Å; R189-E212 IonicContact NE-OE1 2.78Å; R189-E212 IonicContact NH1-OE1 3.46Å; R189-E212 PolarHBondContact NH1-OE1 3.01Å; R189-E212 IonicContact NH1-OE2 3.18Å; R189-E212 PolarHBondContact NH1-OE2 3.41Å; R189-E212 IonicContact NH2-OE1 2.7Å; R189-E212 PolarHBondContact NH2-OE1 3.47Å
190	L	82.4	Confident	79.8	Confident	28 Å²	28	63.4 Å²	63.4	15%	0.147	32%	0.324	C	S	.	.	H	α-helix	trans	-66.9	-34.5	-176.6	-67.6	172.2	0	0	0	111.4	W179 L182 L186 R187 E193 I194	W179-L190 HydrophobicContact CH2-CB 3.53Å; W179-L190 HydrophobicContact CH2-CD1 4.46Å; W179-L190 HydrophobicContact CZ3-CB 3.58Å; W179-L190 HydrophobicContact CZ3-CD1 4.04Å; W179-L190 HydrophobicContact CZ3-CG 4.45Å; L182-L190 HydrophobicContact CD1-CD1 3.86Å; L186-L190 WeakPolarHBondContact O-CG 3.47Å; L186-L190 PolarHBondContact O-N 2.97Å; R187-L190 PolarHBondContact O-N 3.49Å; L190-E193 PolarHBondContact O-N 3.43Å; L190-I194 VanDerWaalsContact O-CG1 3.3Å; L190-I194 WeakPolarHBondContact O-CG1 3.36Å; L190-I194 PolarHBondContact O-N 2.77Å
191	K	82.9	Confident	78.6	Confident	92 Å²	92	66.7 Å²	66.7	40%	0.4	34%	0.34	S	S	.	.	H	α-helix	trans	-59.8	-47.4	170.6	-76.5	-174.6	175	-170.5	0	111.6	W179 R187 R189 E193 I194 D195	W179-K191 HydrophobicContact CH2-CG 3.84Å; W179-K191 HydrophobicContact CZ2-CG 4.07Å; W179-K191 HydrophobicContact CZ3-CG 4.12Å; R187-K191 HydrophobicContact CG-CD 4.4Å; R187-K191 WeakPolarHBondContact O-CB 3.28Å; R187-K191 WeakPolarHBondContact O-CG 3.28Å; R187-K191 PolarHBondContact O-N 2.89Å; R189-K191 VanDerWaalsContact C-N 3.31Å; R189-K191 PolarHBondContact O-N 2.92Å; K191-E193 VanDerWaalsContact C-N 3.3Å; K191-E193 PolarHBondContact O-N 2.97Å; K191-I194 PolarHBondContact O-N 3.36Å; K191-I194 VanDerWaalsContact O-N 3.14Å; K191-D195 VanDerWaalsContact O-CG 3.3Å; K191-D195 PolarHBondContact O-N 3.46Å
192	N	81.7	Confident	77.4	Confident	96 Å²	96	70.9 Å²	70.9	51%	0.513	36%	0.359	S	S	.	.	H	α-helix	trans	-59.9	-39.9	175.6	-68	-7.4	0	0	0	111.9	N188 R189 D195 I196	N188-N192 WeakPolarHBondContact O-CB 3.36Å; N188-N192 PolarHBondContact O-N 3.37Å; N188-N192 PolarHBondContact O-OD1 3.45Å; R189-N192 WeakPolarHBondContact O-CB 3.32Å; R189-N192 PolarHBondContact O-N 2.95Å; N192-D195 PolarHBondContact O-N 2.91Å; N192-I196 VanDerWaalsContact O-CB 3.3Å; N192-I196 WeakPolarHBondContact O-CB 3.43Å; N192-I196 WeakPolarHBondContact O-CD1 3.45Å; N192-I196 WeakPolarHBondContact O-CG1 3.49Å; N192-I196 PolarHBondContact O-N 2.76Å
193	E	77.2	Confident	75.6	Confident	55 Å²	55	80 Å²	80	26%	0.257	40%	0.398	S	S	.	.	H	α-helix	trans	-62	-42.4	175.6	-71.7	177.1	-177.1	0	0	111.5	R189 L190 K191 I196 T197 K464	R189-E193 IonicContact CZ-OE1 3.89Å; R189-E193 IonicContact NE-OE1 3.65Å; R189-E193 PolarHBondContact NE-OE1 3.38Å; R189-E193 IonicContact NH2-OE1 3.53Å; R189-E193 PolarHBondContact NH2-OE1 3.44Å; R189-E193 PolarHBondContact O-N 3.11Å; L190-E193 PolarHBondContact O-N 3.43Å; K191-E193 VanDerWaalsContact C-N 3.3Å; K191-E193 PolarHBondContact O-N 2.97Å; E193-I196 PolarHBondContact O-N 2.91Å; E193-T197 WeakPolarHBondContact O-CG2 3.26Å; E193-T197 PolarHBondContact O-N 3.33Å; E193-T197 PolarHBondContact O-OG1 3.32Å; E193-K464 VanDerWaalsContact OE1-CE 3.29Å; E193-K464 WeakPolarHBondContact OE1-CE 3.35Å; E193-K464 IonicContact OE1-NZ 3.77Å; E193-K464 PolarHBondContact OE1-NZ 3.11Å; E193-K464 WeakPolarHBondContact OE2-CE 3.37Å; E193-K464 IonicContact OE2-NZ 3.72Å; E193-K464 PolarHBondContact OE2-NZ 3.14Å
194	I	76.2	Confident	73.7	Confident	57 Å²	57	83.7 Å²	83.7	29%	0.292	42%	0.422	S	S	.	.	H	α-helix	trans	-65.8	-46	176.7	-66.5	162	0	0	0	110.9	I173 W179 L190 K191 I196 T197 N198	I173-I194 HydrophobicContact CG2-CD1 3.71Å; W179-I194 HydrophobicContact CH2-CD1 3.89Å; W179-I194 HydrophobicContact CZ2-CD1 3.71Å; L190-I194 VanDerWaalsContact O-CG1 3.3Å; L190-I194 WeakPolarHBondContact O-CG1 3.36Å; L190-I194 PolarHBondContact O-N 2.77Å; K191-I194 PolarHBondContact O-N 3.36Å; K191-I194 VanDerWaalsContact O-N 3.14Å; I194-I196 VanDerWaalsContact C-N 3.31Å; I194-I196 PolarHBondContact O-N 2.77Å; I194-T197 WeakPolarHBondContact CA-OG1 3.39Å; I194-T197 PolarHBondContact O-N 3.23Å; I194-T197 VanDerWaalsContact O-N 3.08Å; I194-T197 PolarHBondContact O-OG1 2.79Å; I194-N198 WeakPolarHBondContact CG2-ND2 3.29Å; I194-N198 WeakPolarHBondContact O-CB 3.49Å; I194-N198 VanDerWaalsContact O-CG 3.29Å; I194-N198 PolarHBondContact O-N 2.85Å; I194-N198 PolarHBondContact O-ND2 3.24Å
195	D	76.9	Confident	71.8	Confident	80 Å²	80	89.4 Å²	89.4	43%	0.428	45%	0.452	S	S	.	.	H	α-helix	trans	-60.6	-42.7	178.5	-69.9	-19.8	0	0	0	110.9	K191 N192 N198 Q199	K191-D195 VanDerWaalsContact O-CG 3.3Å; K191-D195 PolarHBondContact O-N 3.46Å; N192-D195 PolarHBondContact O-N 2.91Å; D195-N198 PolarHBondContact O-N 3.5Å; D195-Q199 VanDerWaalsContact O-CB 3.29Å; D195-Q199 WeakPolarHBondContact O-CB 3.33Å; D195-Q199 WeakPolarHBondContact O-CG 3.49Å; D195-Q199 PolarHBondContact O-N 3.06Å
196	I	72.2	Confident	70	Confident	80 Å²	80	97.1 Å²	97.1	41%	0.41	48%	0.484	S	S	.	.	H	α-helix	trans	-58.4	-48.4	172	-73.5	167.8	0	0	0	110.1	N192 E193 I194 N198 Q199 L200	N192-I196 VanDerWaalsContact O-CB 3.3Å; N192-I196 WeakPolarHBondContact O-CB 3.43Å; N192-I196 WeakPolarHBondContact O-CD1 3.45Å; N192-I196 WeakPolarHBondContact O-CG1 3.49Å; N192-I196 PolarHBondContact O-N 2.76Å; E193-I196 PolarHBondContact O-N 2.91Å; I194-I196 VanDerWaalsContact C-N 3.31Å; I194-I196 PolarHBondContact O-N 2.77Å; I196-N198 VanDerWaalsContact C-N 3.31Å; I196-N198 PolarHBondContact O-N 3.23Å; I196-Q199 PolarHBondContact O-N 2.95Å; I196-L200 HydrophobicContact CB-CD1 4.42Å; I196-L200 HydrophobicContact CG2-CD1 3.62Å; I196-L200 WeakPolarHBondContact O-CB 3.31Å; I196-L200 PolarHBondContact O-N 3.31Å
197	T	72.3	Confident	68	Low	96 Å²	96	104.7 Å²	104.7	59%	0.589	52%	0.519	S	S	*	.	H	α-helix	trans	-65.4	-33.2	-179.1	62.1	0	0	0	0	113.2	E193 I194	E193-T197 WeakPolarHBondContact O-CG2 3.26Å; E193-T197 PolarHBondContact O-N 3.33Å; E193-T197 PolarHBondContact O-OG1 3.32Å; I194-T197 WeakPolarHBondContact CA-OG1 3.39Å; I194-T197 PolarHBondContact O-N 3.23Å; I194-T197 VanDerWaalsContact O-N 3.08Å; I194-T197 PolarHBondContact O-OG1 2.79Å
198	N	72.4	Confident	66.3	Low	117 Å²	117	108.8 Å²	108.8	63%	0.626	54%	0.544	S	S	*	.	H	α-helix	trans	-76	-38.8	177.9	-71.2	-23.7	0	0	0	112.1	I194 D195 I196	I194-N198 WeakPolarHBondContact CG2-ND2 3.29Å; I194-N198 WeakPolarHBondContact O-CB 3.49Å; I194-N198 VanDerWaalsContact O-CG 3.29Å; I194-N198 PolarHBondContact O-N 2.85Å; I194-N198 PolarHBondContact O-ND2 3.24Å; D195-N198 PolarHBondContact O-N 3.5Å; I196-N198 VanDerWaalsContact C-N 3.31Å; I196-N198 PolarHBondContact O-N 3.23Å
199	Q	67.5	Low	64.8	Low	156 Å²	156	112 Å²	112	73%	0.729	56%	0.557	S	S	*	*	H	α-helix	trans	-76.8	-34.9	179.8	-71.7	176.2	1.4	0	0	112.4	D195 I196 I201	D195-Q199 VanDerWaalsContact O-CB 3.29Å; D195-Q199 WeakPolarHBondContact O-CB 3.33Å; D195-Q199 WeakPolarHBondContact O-CG 3.49Å; D195-Q199 PolarHBondContact O-N 3.06Å; I196-Q199 PolarHBondContact O-N 2.95Å; Q199-I201 PolarHBondContact O-N 3.13Å
200	L	58.4	Low	63.4	Low	70 Å²	70	114.8 Å²	114.8	37%	0.366	57%	0.572	S	S	.	*			trans	-104.4	81	-171	-66.7	161.5	0	0	0	111.4	I196 N202 P204	I196-L200 HydrophobicContact CB-CD1 4.42Å; I196-L200 HydrophobicContact CG2-CD1 3.62Å; I196-L200 WeakPolarHBondContact O-CB 3.31Å; I196-L200 PolarHBondContact O-N 3.31Å; L200-N202 WeakPolarHBondContact CB-O 3.39Å; L200-N202 WeakPolarHBondContact CD2-O 3.45Å; L200-N202 PolarHBondContact O-N 2.99Å; L200-P204 HydrophobicContact CD1-CB 4.48Å; L200-P204 HydrophobicContact CD1-CG 4.49Å
201	I	52.8	Low	63.1	Low	161 Å²	161	120.7 Å²	120.7	83%	0.826	60%	0.597	S	S	*	*	S	Bend	trans	-59.1	-16.8	151.1	-65.3	173.9	0	0	0	110.2	Q199	Q199-I201 PolarHBondContact O-N 3.13Å
202	N	55	Low	63.2	Low	130 Å²	130	117.8 Å²	117.8	70%	0.695	59%	0.585	S	S	*	*	S	Bend	trans	-104.9	99.8	173.5	-62.9	-24.9	0	0	0	110.7	L200	L200-N202 WeakPolarHBondContact CB-O 3.39Å; L200-N202 WeakPolarHBondContact CD2-O 3.45Å; L200-N202 PolarHBondContact O-N 2.99Å
203	K	48.2	Very low	63.5	Low	196 Å²	196	114.3 Å²	114.3	85%	0.852	57%	0.567	S	S	*	*			trans	-37.8	128.5	176.4	-75.1	175.5	178.1	173	0	111.4	I205	K203-I205 PolarHBondContact O-N 2.75Å
204	P	47.5	Very low	64.2	Low	80 Å²	80	111.9 Å²	111.9	52%	0.519	56%	0.556	S	S	.	*			trans	-57.5	144.9	174.5	23.4	-30.2	0	0	0	109.5	L200 K206	L200-P204 HydrophobicContact CD1-CB 4.48Å; L200-P204 HydrophobicContact CD1-CG 4.49Å; P204-K206 PolarHBondContact O-N 3.28Å
205	I	47.6	Very low	65	Low	152 Å²	152	109.6 Å²	109.6	78%	0.779	54%	0.544	S	S	*	.			trans	-43.6	139.3	164.9	-65.7	158	0	0	0	106.7	K203 Q207	K203-I205 PolarHBondContact O-N 2.75Å; I205-Q207 PolarHBondContact O-N 3.32Å
206	K	51.1	Low	65.7	Low	203 Å²	203	106.5 Å²	106.5	88%	0.883	53%	0.527	S	S	*	.			trans	-58.7	72.2	170	-67.8	175.5	179.1	176.3	0	108.8	P204 D208	P204-K206 PolarHBondContact O-N 3.28Å; K206-D208 PolarHBondContact O-N 2.9Å; K206-D208 VanDerWaalsContact O-N 3.16Å
207	Q	47.5	Very low	66.7	Low	160 Å²	160	102.8 Å²	102.8	75%	0.748	51%	0.509	S	S	*	.			trans	-55.1	119.3	155.7	-79.2	177.3	-32.7	0	0	102.6	I205 E209	I205-Q207 PolarHBondContact O-N 3.32Å; Q207-E209 VanDerWaalsContact C-N 3.29Å; Q207-E209 PolarHBondContact O-N 2.99Å
208	D	50	Low	67.5	Low	128 Å²	128	103.3 Å²	103.3	68%	0.684	50%	0.503	S	S	*	.			trans	-43.4	104.5	171.7	-68.7	-46.5	0	0	0	105.9	K206 E210 P413	K206-D208 PolarHBondContact O-N 2.9Å; K206-D208 VanDerWaalsContact O-N 3.16Å; D208-E210 VanDerWaalsContact C-N 3.34Å; D208-E210 PolarHBondContact O-N 3.45Å; D208-P413 HydrophobicContact CB-CB 4.38Å
209	E	56.5	Low	68.3	Low	148 Å²	148	99.8 Å²	99.8	69%	0.692	48%	0.482	S	S	*	.			trans	-53.9	107.4	-173.4	-72.2	174	-172.8	0	0	104.5	Q207 K211	Q207-E209 VanDerWaalsContact C-N 3.29Å; Q207-E209 PolarHBondContact O-N 2.99Å; E209-K211 VanDerWaalsContact C-N 3.29Å; E209-K211 PolarHBondContact O-N 3.34Å
210	E	55.5	Low	69.1	Low	125 Å²	125	94.6 Å²	94.6	58%	0.584	46%	0.456	S	S	*	.			trans	-56.2	106.3	177.9	-76.5	-170.8	167.9	0	0	104.2	D208 E212	D208-E210 VanDerWaalsContact C-N 3.34Å; D208-E210 PolarHBondContact O-N 3.45Å; E210-E212 PolarHBondContact O-N 3.16Å
211	K	75.6	Confident	70.1	Confident	152 Å²	152	96.1 Å²	96.1	66%	0.661	46%	0.462	S	S	*	.			trans	-60.8	137.5	-179.3	-70.2	-169	176.5	-167.1	0	105.5	E209 Y411	E209-K211 VanDerWaalsContact C-N 3.29Å; E209-K211 PolarHBondContact O-N 3.34Å; K211-Y411 HydrophobicContact CB-CD2 4.08Å; K211-Y411 WeakPolarHBondContact O-CB 3.18Å; K211-Y411 WeakPolarHBondContact O-CD2 3.36Å; K211-Y411 PolarHBondContact O-N 3.18Å
212	E	84.9	Confident	70.9	Confident	32 Å²	32	88.9 Å²	88.9	15%	0.15	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	152.1	174.5	56.1	164.5	-131.8	0	0	109	R189 E210 I409 H462	R189-E212 IonicContact CZ-OE1 2.97Å; R189-E212 IonicContact CZ-OE2 3.41Å; R189-E212 IonicContact NE-OE1 2.78Å; R189-E212 IonicContact NH1-OE1 3.46Å; R189-E212 PolarHBondContact NH1-OE1 3.01Å; R189-E212 IonicContact NH1-OE2 3.18Å; R189-E212 PolarHBondContact NH1-OE2 3.41Å; R189-E212 IonicContact NH2-OE1 2.7Å; R189-E212 PolarHBondContact NH2-OE1 3.47Å; E210-E212 PolarHBondContact O-N 3.16Å; E212-I409 CarbonylContact C-O 3.55Å; E212-I409 WeakPolarHBondContact CA-O 3.44Å; E212-H462 PolarHBondContact O-NE2 3.35Å
213	T	88.9	Confident	71.4	Confident	22 Å²	22	87.2 Å²	87.2	14%	0.135	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	126.8	171.5	51.1	0	0	0	0	109.3	I409 Y411	T213-I409 PolarHBondContact N-O 2.82Å; T213-I409 PolarHBondContact O-N 2.97Å; T213-I409 WeakPolarHBondContact OG1-CB 3.5Å; T213-Y411 HydrophobicContact CG2-CE2 3.7Å; T213-Y411 WeakPolarHBondContact OG1-CE2 3.48Å; T213-Y411 PolarHBondContact OG1-OH 2.9Å
214	L	91.1	Very high	72.4	Confident	5 Å²	5	81.6 Å²	81.6	3%	0.026	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	129.8	178.3	-63.4	171.2	0	0	0	109	L186 V406 M407 E408 H462 L522	L186-L214 HydrophobicContact CD2-CD1 3.66Å; L186-L214 HydrophobicContact CD2-CD2 4.5Å; L214-V406 HydrophobicContact CD2-CG1 4.37Å; L214-M407 WeakPolarHBondContact CA-O 3.3Å; L214-E408 HydrophobicContact CD2-CB 3.92Å; L214-E408 HydrophobicContact CD2-CG 3.96Å; L214-H462 HydrophobicContact CB-CB 4.26Å; L214-H462 HydrophobicContact CD1-CB 4.06Å; L214-L522 HydrophobicContact CB-CD2 4.32Å
215	I	92.3	Very high	73	Confident	8 Å²	8	87.3 Å²	87.3	4%	0.041	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	112.8	-178.8	-53.1	-178.3	0	0	0	108.7	L234 V236 M407 I409 M532	I215-L234 HydrophobicContact CD1-CD1 4.42Å; I215-L234 HydrophobicContact CG2-CD1 4.07Å; I215-V236 HydrophobicContact CD1-CG1 4.48Å; I215-V236 HydrophobicContact CD1-CG2 3.9Å; I215-M407 HydrophobicContact CB-CB 4.31Å; I215-M407 PolarHBondContact N-O 2.73Å; I215-M407 PolarHBondContact O-N 3.1Å; I215-I409 HydrophobicContact CD1-CD1 3.93Å; I215-M532 HydrophobicContact CB-CE 4.23Å; I215-M532 HydrophobicContact CB-SD 4.43Å; I215-M532 HydrophobicContact CG1-CE 4.25Å; I215-M532 HydrophobicContact CG2-CE 4Å; I215-M532 HydrophobicContact CG2-SD 3.97Å
216	L	93.2	Very high	73.7	Confident	15 Å²	15	81 Å²	81	8%	0.079	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	123.3	170.2	-175.5	70.3	0	0	0	109.5	V406 L522 L530 M532	L216-V406 HydrophobicContact CD1-CG2 3.94Å; L216-L522 HydrophobicContact CB-CD1 3.78Å; L216-L522 HydrophobicContact CD2-CD1 4.12Å; L216-L530 HydrophobicContact CD1-CD2 3.85Å; L216-L530 HydrophobicContact CD2-CD2 4.28Å; L216-L530 HydrophobicContact CD2-CG 4.06Å; L216-M532 HydrophobicContact CB-CB 3.81Å; L216-M532 HydrophobicContact CB-SD 3.99Å; L216-M532 HydrophobicContact CD2-CB 4.2Å; L216-M532 PolarHBondContact N-SD 3.36Å
217	L	92.2	Very high	74	Confident	3 Å²	3	74.6 Å²	74.6	2%	0.016	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-83.3	140	178.3	-73.7	162.1	0	0	0	110.6	F232 I233 L234 L250 V405 M407	L217-F232 HydrophobicContact CB-CB 4.16Å; L217-F232 HydrophobicContact CB-CD1 4.21Å; L217-I233 VanDerWaalsContact CD2-O 3.23Å; L217-I233 WeakPolarHBondContact CD2-O 3.39Å; L217-L234 VanDerWaalsContact CD2-CA 3.4Å; L217-L234 HydrophobicContact CD2-CB 3.66Å; L217-L234 HydrophobicContact CD2-CD1 3.81Å; L217-L234 HydrophobicContact CD2-CG 4.34Å; L217-L250 HydrophobicContact CD1-CD1 3.2Å; L217-V405 HydrophobicContact CB-CB 4.26Å; L217-V405 HydrophobicContact CB-CG1 4.02Å; L217-V405 HydrophobicContact CD1-CG1 3.6Å; L217-V405 HydrophobicContact CG-CG1 4.41Å; L217-V405 PolarHBondContact N-O 2.97Å; L217-M407 HydrophobicContact CD1-CB 4.48Å; L217-M407 HydrophobicContact CD1-CE 4.39Å
218	K	89.6	Confident	74.6	Confident	107 Å²	107	70.6 Å²	70.6	47%	0.465	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.4	174.9	-65	-171.6	-178.6	-175.4	0	109.5	Y220 F232 I233 M532	K218-Y220 PolarHBondContact O-N 3.48Å; K218-F232 WeakPolarHBondContact O-CA 3.2Å; K218-I233 PolarHBondContact O-N 2.88Å; K218-M532 WeakPolarHBondContact CE-O 3.32Å; K218-M532 PolarHBondContact NZ-O 3Å
219	Q	89.1	Confident	75.4	Confident	43 Å²	43	64.9 Å²	64.9	20%	0.201	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	130	172.3	-169.4	-177.3	24.3	0	0	109.9	Q221 P229 I231 F232 P402	Q219-Q221 VanDerWaalsContact CD-NE2 3.26Å; Q219-Q221 VanDerWaalsContact OE1-NE2 3.09Å; Q219-P229 WeakPolarHBondContact CG-O 3.46Å; Q219-P229 PolarHBondContact NE2-O 3.49Å; Q219-I231 CarbonylContact C-O 3.6Å; Q219-I231 WeakPolarHBondContact CA-O 3.42Å; Q219-F232 HydrophobicContact CB-CD1 4.3Å; Q219-F232 HydrophobicContact CB-CE1 4.08Å; Q219-F232 HydrophobicContact CG-CE1 4.44Å; Q219-P402 HydrophobicContact CB-CB 3.81Å; Q219-P402 HydrophobicContact CG-CB 4.14Å
220	Y	84.5	Confident	76.7	Confident	46 Å²	46	59.6 Å²	59.6	18%	0.18	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-83.5	120.7	174.6	-177.8	-122.5	0	0	0	109.7	K218 P222 P229 I231 I233 F336 Y384	K218-Y220 PolarHBondContact O-N 3.48Å; Y220-P222 HydrophobicContact CD1-CB 4.43Å; Y220-P222 HydrophobicContact CE1-CB 3.87Å; Y220-P222 WeakPolarHBondContact O-CD 3.4Å; Y220-P229 WeakPolarHBondContact O-CG 3.44Å; Y220-I231 HydrophobicContact CD1-CG2 4.05Å; Y220-I231 HydrophobicContact CG-CG2 4.39Å; Y220-I231 PolarHBondContact N-O 3.17Å; Y220-I233 HydrophobicContact CD2-CD1 3.51Å; Y220-I233 HydrophobicContact CD2-CG1 4.01Å; Y220-I233 HydrophobicContact CE2-CD1 4.42Å; Y220-I233 HydrophobicContact CG-CD1 4.15Å; Y220-I233 HydrophobicContact CG-CG1 4.14Å; Y220-F336 AromaticContact CD1-CE1 3.96Å; Y220-F336 HydrophobicContact CD1-CE1 3.96Å; Y220-F336 AromaticContact CD1-CZ 3.83Å; Y220-F336 HydrophobicContact CD1-CZ 3.83Å; Y220-F336 AromaticContact CE1-CE1 3.66Å; Y220-F336 HydrophobicContact CE1-CE1 3.66Å; Y220-F336 AromaticContact CE1-CZ 3.57Å; Y220-F336 HydrophobicContact CE1-CZ 3.57Å; Y220-Y384 HydrophobicContact CD1-CD1 4.41Å; Y220-Y384 HydrophobicContact CD1-CE1 4.48Å; Y220-Y384 HydrophobicContact CD2-CE1 4.12Å; Y220-Y384 HydrophobicContact CE2-CE1 4.26Å; Y220-Y384 HydrophobicContact CG-CD1 4.3Å; Y220-Y384 HydrophobicContact CG-CE1 4.23Å
221	Q	78.2	Confident	78.3	Confident	102 Å²	102	53.8 Å²	53.8	48%	0.477	27%	0.27	S	S	.	.			trans	-100.1	106.1	171.5	-63.6	-64.6	-18.8	0	0	108.5	Q219	Q219-Q221 VanDerWaalsContact CD-NE2 3.26Å; Q219-Q221 VanDerWaalsContact OE1-NE2 3.09Å
222	P	70.2	Confident	79.1	Confident	9 Å²	9	46.7 Å²	46.7	6%	0.058	24%	0.239	C	C	.	.			trans	-69.1	160.5	178.4	22.4	-23	0	0	0	111.5	Y220 V224 L226 M335 F336	Y220-P222 HydrophobicContact CD1-CB 4.43Å; Y220-P222 HydrophobicContact CE1-CB 3.87Å; Y220-P222 WeakPolarHBondContact O-CD 3.4Å; P222-V224 CarbonylContact O-C 3.54Å; P222-V224 PolarHBondContact O-N 2.85Å; P222-L226 HydrophobicContact CG-CB 4.44Å; P222-L226 HydrophobicContact CG-CD1 3.59Å; P222-L226 HydrophobicContact CG-CG 4.1Å; P222-M335 HydrophobicContact CB-CE 3.47Å; P222-M335 VanDerWaalsContact CB-CE 3.47Å; P222-M335 HydrophobicContact CG-CE 3.99Å; P222-F336 HydrophobicContact CB-CZ 4.17Å; P222-F336 HydrophobicContact CG-CZ 4.38Å
223	P	66.5	Low	79.3	Confident	95 Å²	95	47.2 Å²	47.2	62%	0.617	24%	0.243	S	C	*	.	S	Bend	trans	-61.4	-30.5	-176.7	23.7	-34.2	0	0	0	113.1	L273	P223-L273 HydrophobicContact CG-CD1 3.97Å
224	V	68.7	Low	79.5	Confident	79 Å²	79	46.2 Å²	46.2	48%	0.479	24%	0.236	S	C	.	.	S	Bend	trans	-85.1	120.4	167.9	-176.4	0	0	0	0	107.2	P222 L226 M335	P222-V224 CarbonylContact O-C 3.54Å; P222-V224 PolarHBondContact O-N 2.85Å; V224-L226 VanDerWaalsContact C-N 3.33Å; V224-L226 PolarHBondContact O-N 3.1Å; V224-M335 HydrophobicContact CB-CE 3.77Å; V224-M335 HydrophobicContact CB-SD 4.1Å; V224-M335 HydrophobicContact CG2-CE 4.07Å; V224-M335 HydrophobicContact CG2-SD 4.25Å
225	K	60.4	Low	79.4	Confident	200 Å²	200	50.7 Å²	50.7	87%	0.87	26%	0.256	S	S	*	.			trans	-60.3	93.8	177.2	-69.6	-177.1	179.2	-179.6	0	109.6
226	L	61.8	Low	79.1	Confident	18 Å²	18	51 Å²	51	9%	0.094	26%	0.258	C	S	.	.			trans	-79.8	135.3	162.5	-66.5	169.6	0	0	0	106.8	P222 V224 N228 Y328 M332 M335 F336	P222-L226 HydrophobicContact CG-CB 4.44Å; P222-L226 HydrophobicContact CG-CD1 3.59Å; P222-L226 HydrophobicContact CG-CG 4.1Å; V224-L226 VanDerWaalsContact C-N 3.33Å; V224-L226 PolarHBondContact O-N 3.1Å; L226-N228 PolarHBondContact O-N 3.34Å; L226-Y328 HydrophobicContact CD2-CD1 3.97Å; L226-Y328 HydrophobicContact CD2-CE1 4.16Å; L226-M332 HydrophobicContact CD1-SD 3.87Å; L226-M335 HydrophobicContact CD1-CE 4.38Å; L226-F336 HydrophobicContact CD1-CE2 4.47Å
227	P	57.5	Low	78.4	Confident	69 Å²	69	51.8 Å²	51.8	45%	0.448	27%	0.266	S	S	.	.	S	Bend	trans	-60.7	113.9	168.2	28.4	-34.5	0	0	0	107.6	Y328	P227-Y328 HydrophobicContact CG-CE1 4.14Å; P227-Y328 WeakPolarHBondContact CG-OH 3.24Å
228	N	60.2	Low	77.9	Confident	76 Å²	76	54.6 Å²	54.6	41%	0.406	28%	0.28	S	S	.	.	S	Bend	trans	38.1	77.4	176.3	-70.2	-7.2	0	0	0	115	L226 N230 N398	L226-N228 PolarHBondContact O-N 3.34Å; N228-N230 PolarHBondContact O-N 3.11Å; N228-N398 WeakPolarHBondContact CB-OD1 3.15Å; N228-N398 PolarHBondContact ND2-ND2 3.17Å; N228-N398 PolarHBondContact ND2-OD1 3.46Å
229	P	67.6	Low	77.4	Confident	9 Å²	9	56.9 Å²	56.9	6%	0.058	29%	0.292	C	S	.	.			trans	-61.5	117.8	172.2	28.5	-35.7	0	0	0	108.6	Q219 Y220 I231	Q219-P229 WeakPolarHBondContact CG-O 3.46Å; Q219-P229 PolarHBondContact NE2-O 3.49Å; Y220-P229 WeakPolarHBondContact O-CG 3.44Å; P229-I231 HydrophobicContact CB-CB 4.09Å; P229-I231 HydrophobicContact CB-CD1 3.84Å; P229-I231 HydrophobicContact CB-CG1 3.87Å; P229-I231 PolarHBondContact O-N 3.04Å
230	N	83.7	Confident	77.1	Confident	37 Å²	37	55.9 Å²	55.9	20%	0.198	29%	0.288	C	S	.	.			trans	-71.2	43.6	167.7	-67.7	-23.9	0	0	0	110.6	N228 M386 I387 I400	N228-N230 PolarHBondContact O-N 3.11Å; N230-M386 CarbonylContact O-C 3.55Å; N230-M386 VanDerWaalsContact O-CA 3.3Å; N230-M386 WeakPolarHBondContact O-CA 3.46Å; N230-I387 WeakPolarHBondContact CB-O 3.29Å; N230-I387 PolarHBondContact ND2-O 3.43Å; N230-I387 PolarHBondContact O-N 3.07Å; N230-I400 HydrophobicContact CB-CD1 4.43Å
231	I	87.7	Confident	77.1	Confident	3 Å²	3	56 Å²	56	2%	0.015	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	129.2	-176.4	-56.4	174.4	0	0	0	107	Q219 Y220 P229 I269 M332 F336 I385 M386	Q219-I231 CarbonylContact C-O 3.6Å; Q219-I231 WeakPolarHBondContact CA-O 3.42Å; Y220-I231 HydrophobicContact CD1-CG2 4.05Å; Y220-I231 HydrophobicContact CG-CG2 4.39Å; Y220-I231 PolarHBondContact N-O 3.17Å; P229-I231 HydrophobicContact CB-CB 4.09Å; P229-I231 HydrophobicContact CB-CD1 3.84Å; P229-I231 HydrophobicContact CB-CG1 3.87Å; P229-I231 PolarHBondContact O-N 3.04Å; I231-I269 HydrophobicContact CB-CD1 4.33Å; I231-I269 HydrophobicContact CD1-CD1 3.74Å; I231-I269 HydrophobicContact CG1-CD1 3.89Å; I231-I269 HydrophobicContact CG2-CD1 3.52Å; I231-I269 HydrophobicContact CG2-CG1 4.39Å; I231-M332 HydrophobicContact CD1-CE 4.13Å; I231-M332 HydrophobicContact CD1-SD 4.47Å; I231-F336 HydrophobicContact CD1-CD2 4.25Å; I231-F336 HydrophobicContact CD1-CE1 4.22Å; I231-F336 HydrophobicContact CD1-CE2 3.61Å; I231-F336 HydrophobicContact CD1-CZ 3.58Å; I231-I385 CarbonylContact C-O 3.49Å; I231-I385 VanDerWaalsContact CA-O 3.31Å; I231-I385 WeakPolarHBondContact CA-O 3.38Å; I231-M386 HydrophobicContact CG1-CB 4.41Å; I231-M386 HydrophobicContact CG1-CG 4.15Å
232	F	91.9	Very high	77.4	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.009	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	142.1	-174.7	-65.9	-83	0	0	0	110.5	L217 K218 Q219 Y384 I385 I387 I400 P402 V405	L217-F232 HydrophobicContact CB-CB 4.16Å; L217-F232 HydrophobicContact CB-CD1 4.21Å; K218-F232 WeakPolarHBondContact O-CA 3.2Å; Q219-F232 HydrophobicContact CB-CD1 4.3Å; Q219-F232 HydrophobicContact CB-CE1 4.08Å; Q219-F232 HydrophobicContact CG-CE1 4.44Å; F232-Y384 WeakPolarHBondContact O-CA 3.47Å; F232-I385 PolarHBondContact N-O 2.95Å; F232-I385 PolarHBondContact O-N 3.18Å; F232-I387 HydrophobicContact CD2-CD1 3.88Å; F232-I387 HydrophobicContact CE2-CD1 3.83Å; F232-I400 HydrophobicContact CE2-CG2 4.46Å; F232-I400 HydrophobicContact CZ-CG2 4.04Å; F232-P402 HydrophobicContact CE1-CB 4.35Å; F232-V405 HydrophobicContact CD1-CB 4.24Å; F232-V405 HydrophobicContact CD1-CG1 4.33Å; F232-V405 HydrophobicContact CD1-CG2 4.2Å; F232-V405 HydrophobicContact CE1-CB 4.03Å; F232-V405 HydrophobicContact CE1-CG1 4.44Å; F232-V405 HydrophobicContact CE1-CG2 3.52Å; F232-V405 HydrophobicContact CE2-CG2 4.26Å; F232-V405 HydrophobicContact CG-CG1 4.47Å; F232-V405 HydrophobicContact CZ-CB 4.44Å; F232-V405 HydrophobicContact CZ-CG2 3.56Å
233	I	91.1	Very high	78.1	Confident	44 Å²	44	55.3 Å²	55.3	23%	0.226	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	117.6	177.2	-45.8	177.1	0	0	0	108.8	L217 K218 Y220 I382 Y384	L217-I233 VanDerWaalsContact CD2-O 3.23Å; L217-I233 WeakPolarHBondContact CD2-O 3.39Å; K218-I233 PolarHBondContact O-N 2.88Å; Y220-I233 HydrophobicContact CD2-CD1 3.51Å; Y220-I233 HydrophobicContact CD2-CG1 4.01Å; Y220-I233 HydrophobicContact CE2-CD1 4.42Å; Y220-I233 HydrophobicContact CG-CD1 4.15Å; Y220-I233 HydrophobicContact CG-CG1 4.14Å; I233-I382 HydrophobicContact CG2-CG2 3.78Å; I233-Y384 HydrophobicContact CD1-CE1 4.24Å; I233-Y384 HydrophobicContact CG1-CD1 4.04Å; I233-Y384 HydrophobicContact CG1-CE1 3.96Å; I233-Y384 HydrophobicContact CG2-CE1 4.35Å
234	L	91.8	Very high	79	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	108.1	167	178.7	63.1	0	0	0	108.9	I215 L217 V236 M365 W368 F381 I382 R383 I385 M407	I215-L234 HydrophobicContact CD1-CD1 4.42Å; I215-L234 HydrophobicContact CG2-CD1 4.07Å; L217-L234 VanDerWaalsContact CD2-CA 3.4Å; L217-L234 HydrophobicContact CD2-CB 3.66Å; L217-L234 HydrophobicContact CD2-CD1 3.81Å; L217-L234 HydrophobicContact CD2-CG 4.34Å; L234-V236 HydrophobicContact CD1-CG2 4.3Å; L234-V236 HydrophobicContact CG-CG2 4.45Å; L234-M365 HydrophobicContact CD2-CE 4.48Å; L234-M365 HydrophobicContact CD2-SD 4.06Å; L234-W368 HydrophobicContact CD2-CE3 4.28Å; L234-W368 HydrophobicContact CD2-CZ3 3.84Å; L234-F381 HydrophobicContact CD2-CE1 3.78Å; L234-F381 HydrophobicContact CD2-CZ 4.48Å; L234-F381 HydrophobicContact CG-CE1 4.05Å; L234-I382 CarbonylContact O-C 3.57Å; L234-I382 VanDerWaalsContact O-CA 3.31Å; L234-I382 WeakPolarHBondContact O-CA 3.43Å; L234-R383 HydrophobicContact CB-CB 4.32Å; L234-R383 PolarHBondContact N-O 2.9Å; L234-R383 PolarHBondContact O-N 3.48Å; L234-I385 HydrophobicContact CB-CD1 4.39Å; L234-I385 HydrophobicContact CD2-CD1 4.41Å; L234-M407 HydrophobicContact CD1-CE 3.94Å; L234-M407 HydrophobicContact CD1-SD 3.73Å; L234-M407 HydrophobicContact CD2-CE 3.84Å; L234-M407 HydrophobicContact CD2-SD 4Å; L234-M407 HydrophobicContact CG-CE 4.45Å
235	K	89	Confident	80	Confident	99 Å²	99	49.6 Å²	49.6	43%	0.43	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	120.7	173.4	-177.7	-179	178	-173.7	0	109.1	F381 I382	K235-F381 WeakPolarHBondContact CA-O 2.79Å; K235-I382 HydrophobicContact CG-CG1 4.34Å
236	V	86.9	Confident	81.5	Confident	16 Å²	16	42.8 Å²	42.8	10%	0.097	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	127	176.6	-172.7	0	0	0	0	108.4	I215 L234 E238 I240 M365 F381	I215-V236 HydrophobicContact CD1-CG1 4.48Å; I215-V236 HydrophobicContact CD1-CG2 3.9Å; L234-V236 HydrophobicContact CD1-CG2 4.3Å; L234-V236 HydrophobicContact CG-CG2 4.45Å; V236-E238 VanDerWaalsContact CG1-O 3.24Å; V236-E238 WeakPolarHBondContact CG1-O 3.24Å; V236-I240 HydrophobicContact CG1-CD1 3.54Å; V236-I240 HydrophobicContact CG1-CG1 3.98Å; V236-M365 HydrophobicContact CG2-CE 4.15Å; V236-F381 HydrophobicContact CB-CB 4.36Å; V236-F381 HydrophobicContact CB-CD1 3.94Å; V236-F381 HydrophobicContact CB-CG 4.45Å; V236-F381 HydrophobicContact CG2-CD1 3.51Å; V236-F381 HydrophobicContact CG2-CE1 3.87Å; V236-F381 HydrophobicContact CG2-CG 4.42Å; V236-F381 PolarHBondContact N-O 3.38Å
237	A	78	Confident	83	Confident	30 Å²	30	47.2 Å²	47.2	25%	0.248	25%	0.247	C	C	.	.			trans	-94.7	-21.8	-178	0	0	0	0	0	113.7	T534	A237-T534 HydrophobicContact CB-CG2 3.57Å
238	E	80.6	Confident	84.8	Confident	63 Å²	63	43.9 Å²	43.9	29%	0.294	23%	0.226	S	C	.	.	S	Bend	trans	-102	150.3	-179.1	-68.4	165.2	-147.8	0	0	109.9	V236 I240 M519 S520	V236-E238 VanDerWaalsContact CG1-O 3.24Å; V236-E238 WeakPolarHBondContact CG1-O 3.24Å; E238-I240 PolarHBondContact O-N 3.49Å; E238-M519 HydrophobicContact CG-CB 4.23Å; E238-M519 VanDerWaalsContact OE1-CA 3.24Å; E238-M519 WeakPolarHBondContact OE1-CA 3.39Å; E238-M519 VanDerWaalsContact OE1-CB 3.26Å; E238-M519 WeakPolarHBondContact OE1-CB 3.36Å; E238-S520 PolarHBondContact OE1-N 3.21Å
239	E	79.4	Confident	86.5	Confident	155 Å²	155	40.3 Å²	40.3	72%	0.724	21%	0.207	S	C	*	.	P	Polyproline II helix	trans	-76.3	117.1	171.7	-68.8	-175.5	-160.4	0	0	108.8
240	I	83.7	Confident	87.9	Confident	22 Å²	22	39.9 Å²	39.9	11%	0.113	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-103.7	118.6	179.1	-60	177.1	0	0	0	108.5	V236 E238 P242 I245 L369 I409 Y411	V236-I240 HydrophobicContact CG1-CD1 3.54Å; V236-I240 HydrophobicContact CG1-CG1 3.98Å; E238-I240 PolarHBondContact O-N 3.49Å; I240-P242 VanDerWaalsContact O-CD 3.25Å; I240-P242 WeakPolarHBondContact O-CD 3.21Å; I240-I245 HydrophobicContact CG2-CD1 3.97Å; I240-I245 HydrophobicContact CG2-CG1 4.29Å; I240-L369 HydrophobicContact CB-CD1 4.14Å; I240-L369 HydrophobicContact CB-CD2 4.32Å; I240-L369 HydrophobicContact CG2-CD1 3.92Å; I240-I409 HydrophobicContact CD1-CD1 3.75Å; I240-Y411 HydrophobicContact CG2-CE1 3.67Å; I240-Y411 VanDerWaalsContact CG2-OH 3.3Å; I240-Y411 WeakPolarHBondContact CG2-OH 3.24Å
241	D	83.5	Confident	88.4	Confident	49 Å²	49	38.7 Å²	38.7	26%	0.262	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-72.3	116.3	173.4	-173.5	6.6	0	0	0	110.7	T243 H244 R373	D241-T243 VanDerWaalsContact CG-OG1 3.24Å; D241-T243 PolarHBondContact O-N 3.23Å; D241-T243 VanDerWaalsContact O-N 3.15Å; D241-T243 WeakPolarHBondContact OD1-CG2 3.47Å; D241-T243 PolarHBondContact OD1-N 3.46Å; D241-T243 PolarHBondContact OD1-OG1 2.89Å; D241-T243 PolarHBondContact OD2-OG1 2.95Å; D241-H244 IonicContact OD2-CD2 2.83Å; D241-H244 IonicContact OD2-NE2 3.6Å; D241-R373 IonicContact OD1-NH1 2.71Å; D241-R373 PolarHBondContact OD1-NH1 3.4Å
242	P	85.8	Confident	88.6	Confident	10 Å²	10	38.6 Å²	38.6	7%	0.065	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-63.9	-19.1	-179.1	24.9	-35.8	0	0	0	114.1	I240 H244 I366 L369 K370	I240-P242 VanDerWaalsContact O-CD 3.25Å; I240-P242 WeakPolarHBondContact O-CD 3.21Å; P242-H244 VanDerWaalsContact C-N 3.32Å; P242-H244 PolarHBondContact O-N 3.41Å; P242-I366 HydrophobicContact CB-CG2 4.32Å; P242-L369 HydrophobicContact CB-CB 3.99Å; P242-L369 HydrophobicContact CB-CD1 4.33Å; P242-L369 HydrophobicContact CG-CB 4.31Å; P242-K370 HydrophobicContact CB-CG 4.18Å; P242-K370 HydrophobicContact CG-CG 3.98Å
243	T	84.4	Confident	88.6	Confident	86 Å²	86	39.1 Å²	39.1	53%	0.528	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-68.9	-30.5	-174.8	67.8	0	0	0	0	113.2	D241	D241-T243 VanDerWaalsContact CG-OG1 3.24Å; D241-T243 PolarHBondContact O-N 3.23Å; D241-T243 VanDerWaalsContact O-N 3.15Å; D241-T243 WeakPolarHBondContact OD1-CG2 3.47Å; D241-T243 PolarHBondContact OD1-N 3.46Å; D241-T243 PolarHBondContact OD1-OG1 2.89Å; D241-T243 PolarHBondContact OD2-OG1 2.95Å
244	H	85	Confident	88.4	Confident	52 Å²	52	37.3 Å²	37.3	24%	0.241	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-95.5	-2.1	-174.5	-66.1	-56.7	0	0	0	113.6	D241 P242 S246 Y411 R412 R414	D241-H244 IonicContact OD2-CD2 2.83Å; D241-H244 IonicContact OD2-NE2 3.6Å; P242-H244 VanDerWaalsContact C-N 3.32Å; P242-H244 PolarHBondContact O-N 3.41Å; H244-S246 PolarHBondContact O-N 3.19Å; H244-Y411 HydrophobicContact CB-CD1 4.34Å; H244-Y411 CarbonylContact O-C 3.5Å; H244-Y411 VanDerWaalsContact O-CA 3.28Å; H244-Y411 WeakPolarHBondContact O-CA 3.44Å; H244-R412 PolarHBondContact O-N 3.07Å; H244-R414 PolarHBondContact NE2-NE 3.02Å
245	I	90.3	Very high	87.9	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	119.8	-179.1	-62.9	178.1	0	0	0	109.8	I240 V248 I366 L369 I409 Y411 R412	I240-I245 HydrophobicContact CG2-CD1 3.97Å; I240-I245 HydrophobicContact CG2-CG1 4.29Å; I245-V248 HydrophobicContact CG2-CG2 3.46Å; I245-V248 VanDerWaalsContact CG2-CG2 3.46Å; I245-I366 HydrophobicContact CB-CD1 4.5Å; I245-I366 HydrophobicContact CB-CG1 4.3Å; I245-I366 HydrophobicContact CD1-CG1 4.33Å; I245-I366 HydrophobicContact CG2-CD1 4.43Å; I245-I366 HydrophobicContact CG2-CG1 4.32Å; I245-L369 HydrophobicContact CD1-CD1 3.37Å; I245-I409 HydrophobicContact CG1-CG2 4.28Å; I245-I409 HydrophobicContact CG2-CG2 4.29Å; I245-Y411 HydrophobicContact CG1-CD1 4.2Å; I245-Y411 HydrophobicContact CG1-CE1 3.91Å; I245-R412 PolarHBondContact O-NH1 3.28Å
246	S	91	Very high	87.5	Confident	57 Å²	57	39.6 Å²	39.6	40%	0.399	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-56.9	174.1	-173.7	0	0	0	0	110.7	H244 K410	H244-S246 PolarHBondContact O-N 3.19Å; S246-K410 WeakPolarHBondContact CA-O 3.47Å; S246-K410 WeakPolarHBondContact CB-O 3.26Å; S246-K410 PolarHBondContact N-O 3.45Å
247	R	93.8	Very high	87	Confident	111 Å²	111	45.4 Å²	45.4	42%	0.419	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	145.1	-176.2	-176.3	164.7	134.8	95.6	-8.1	110.5	T249 T362 I409 K410	R247-T249 HydrophobicContact CG-CG2 3.94Å; R247-T249 VanDerWaalsContact NE-CG2 3.34Å; R247-T249 VanDerWaalsContact NH1-CG2 3.32Å; R247-T362 VanDerWaalsContact CA-CG2 3.48Å; R247-T362 HydrophobicContact CB-CG2 4.31Å; R247-T362 HydrophobicContact CG-CG2 4.14Å; R247-I409 CarbonylContact O-C 3.51Å; R247-I409 WeakPolarHBondContact O-CA 3.3Å; R247-K410 HydrophobicContact CB-CB 4.48Å; R247-K410 PolarHBondContact N-O 2.82Å; R247-K410 PolarHBondContact O-N 3.47Å
248	V	95.8	Very high	87	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	119.8	175.4	-177.6	0	0	0	0	107.6	I245 N360 I361 T362 M365 M407 E408 I409	I245-V248 HydrophobicContact CG2-CG2 3.46Å; I245-V248 VanDerWaalsContact CG2-CG2 3.46Å; V248-N360 PolarHBondContact O-OD1 2.94Å; V248-I361 HydrophobicContact CG1-CB 4.39Å; V248-I361 PolarHBondContact O-N 3.28Å; V248-T362 HydrophobicContact CB-CG2 4.17Å; V248-T362 HydrophobicContact CG2-CG2 4.48Å; V248-M365 HydrophobicContact CB-CB 4.42Å; V248-M365 HydrophobicContact CG1-CB 4.21Å; V248-M365 HydrophobicContact CG1-CG 4.28Å; V248-M365 HydrophobicContact CG2-CB 4.12Å; V248-M365 HydrophobicContact CG2-CG 4.14Å; V248-M407 HydrophobicContact CG1-CG 4Å; V248-M407 HydrophobicContact CG1-SD 3.98Å; V248-E408 CarbonylContact C-O 3.51Å; V248-E408 VanDerWaalsContact CA-O 3.3Å; V248-E408 WeakPolarHBondContact CA-O 3.37Å; V248-I409 HydrophobicContact CG1-CG1 4.07Å; V248-I409 HydrophobicContact CG2-CB 4.48Å; V248-I409 HydrophobicContact CG2-CG1 4.19Å; V248-I409 HydrophobicContact CG2-CG2 4.12Å
249	T	96	Very high	86.9	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.006	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	134.5	-176.8	42.7	0	0	0	0	110.7	R247 H251 F359 M407 E408	R247-T249 HydrophobicContact CG-CG2 3.94Å; R247-T249 VanDerWaalsContact NE-CG2 3.34Å; R247-T249 VanDerWaalsContact NH1-CG2 3.32Å; T249-H251 PolarHBondContact OG1-NE2 3.44Å; T249-F359 CarbonylContact C-O 3.56Å; T249-F359 VanDerWaalsContact CA-O 3.3Å; T249-F359 WeakPolarHBondContact CA-O 3.18Å; T249-M407 CarbonylContact O-C 3.49Å; T249-M407 WeakPolarHBondContact O-CA 3.46Å; T249-E408 PolarHBondContact N-O 3.31Å; T249-E408 PolarHBondContact O-N 2.94Å; T249-E408 PolarHBondContact OG1-OE2 3.47Å
250	L	96.3	Very high	86.7	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	114	173.3	176.5	64.8	0	0	0	108.6	L217 V252 T358 F359 I361 I385 I387 V405 M407	L217-L250 HydrophobicContact CD1-CD1 3.2Å; L250-V252 HydrophobicContact CD2-CG2 4.32Å; L250-V252 HydrophobicContact CG-CG2 3.96Å; L250-T358 CarbonylContact O-C 3.58Å; L250-T358 VanDerWaalsContact O-CA 3.29Å; L250-T358 WeakPolarHBondContact O-CA 3.23Å; L250-F359 HydrophobicContact CB-CB 4.21Å; L250-F359 HydrophobicContact CB-CD2 4.46Å; L250-F359 HydrophobicContact CD2-CD2 4.07Å; L250-F359 HydrophobicContact CG-CD2 4.29Å; L250-F359 PolarHBondContact N-O 3.3Å; L250-F359 PolarHBondContact O-N 2.94Å; L250-I361 HydrophobicContact CB-CD1 3.56Å; L250-I361 HydrophobicContact CB-CG1 4.19Å; L250-I361 HydrophobicContact CD2-CD1 3.6Å; L250-I361 HydrophobicContact CG-CD1 4.19Å; L250-I385 HydrophobicContact CD2-CG2 4.4Å; L250-I387 HydrophobicContact CD2-CD1 4.29Å; L250-V405 HydrophobicContact CD1-CG1 3.79Å; L250-M407 HydrophobicContact CD1-CB 4.29Å; L250-M407 HydrophobicContact CD1-CE 4.3Å
251	H	94.6	Very high	86.6	Confident	12 Å²	12	45.9 Å²	45.9	6%	0.056	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	123.4	178.7	-59.5	-65	0	0	0	108.9	I185 T249 M356 T358 V405 V406 E408	I185-H251 HydrophobicContact CG2-CB 4.28Å; T249-H251 PolarHBondContact OG1-NE2 3.44Å; H251-M356 HydrophobicContact CB-CE 3.62Å; H251-M356 WeakPolarHBondContact ND1-CE 3.3Å; H251-T358 VanDerWaalsContact ND1-CG2 3.33Å; H251-T358 WeakPolarHBondContact ND1-CG2 3.28Å; H251-V405 CarbonylContact O-C 3.5Å; H251-V405 WeakPolarHBondContact O-CA 3.47Å; H251-V406 WeakPolarHBondContact CB-O 3.47Å; H251-V406 PolarHBondContact N-O 3.48Å; H251-V406 PolarHBondContact O-N 2.78Å; H251-E408 IonicContact CD2-OE2 3.03Å; H251-E408 IonicContact CE1-OE2 2.83Å; H251-E408 IonicContact NE2-OE2 3.8Å; H251-E408 PolarHBondContact NE2-OE2 2.9Å
252	V	92.7	Very high	86.7	Confident	1 Å²	1	43.7 Å²	43.7	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	115.7	-175.4	-173.2	0	0	0	0	108.2	L250 M356 V357 F359 I387 I400 V405	L250-V252 HydrophobicContact CD2-CG2 4.32Å; L250-V252 HydrophobicContact CG-CG2 3.96Å; V252-M356 CarbonylContact O-C 3.55Å; V252-M356 WeakPolarHBondContact O-CA 3.2Å; V252-V357 HydrophobicContact CB-CB 4.43Å; V252-V357 PolarHBondContact N-O 2.97Å; V252-V357 PolarHBondContact O-N 2.98Å; V252-F359 HydrophobicContact CG2-CD2 3.99Å; V252-F359 HydrophobicContact CG2-CE2 3.76Å; V252-I387 HydrophobicContact CG1-CD1 4.09Å; V252-I387 HydrophobicContact CG2-CD1 3.65Å; V252-I400 HydrophobicContact CG1-CB 4.46Å; V252-I400 HydrophobicContact CG1-CD1 4.15Å; V252-I400 HydrophobicContact CG1-CG1 4.1Å; V252-I400 HydrophobicContact CG1-CG2 3.56Å; V252-V405 HydrophobicContact CG1-CG2 4.17Å; V252-V405 HydrophobicContact CG2-CG1 4.24Å
253	E	90.2	Very high	86.7	Confident	13 Å²	13	45.4 Å²	45.4	6%	0.061	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	147.1	175.7	-166.6	174.8	142.3	0	0	111.4	P183 I184 S355 D401 K404	P183-E253 WeakPolarHBondContact CA-OE2 3.41Å; I184-E253 HydrophobicContact CD1-CG 3.99Å; I184-E253 HydrophobicContact CG1-CG 4.48Å; I184-E253 WeakPolarHBondContact CG1-OE2 3.5Å; I184-E253 PolarHBondContact N-OE2 3.23Å; E253-S355 CarbonylContact C-O 3.5Å; E253-S355 WeakPolarHBondContact CA-O 3.49Å; E253-S355 WeakPolarHBondContact CG-O 3.49Å; E253-D401 PolarHBondContact O-N 2.94Å; E253-K404 HydrophobicContact CB-CB 3.68Å; E253-K404 HydrophobicContact CB-CD 4.12Å; E253-K404 HydrophobicContact CG-CB 4.49Å; E253-K404 HydrophobicContact CG-CD 4.04Å; E253-K404 PolarHBondContact N-O 2.94Å; E253-K404 VanDerWaalsContact N-O 3.13Å; E253-K404 VanDerWaalsContact OE1-CD 3.23Å; E253-K404 WeakPolarHBondContact OE1-CD 3.31Å; E253-K404 IonicContact OE1-NZ 2.78Å; E253-K404 PolarHBondContact OE1-NZ 2.95Å
254	T	87.6	Confident	86.9	Confident	5 Å²	5	41.4 Å²	41.4	3%	0.031	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	148.9	-179	58.3	0	0	0	0	111.1	G256 I258 S355 I399 I400	T254-G256 PolarHBondContact O-N 3.46Å; T254-G256 PolarHBondContact OG1-O 2.97Å; T254-I258 HydrophobicContact CG2-CD1 3.57Å; T254-I258 HydrophobicContact CG2-CG1 3.84Å; T254-I258 WeakPolarHBondContact OG1-CG1 3.41Å; T254-S355 PolarHBondContact N-O 2.96Å; T254-S355 VanDerWaalsContact OG1-CA 3.32Å; T254-S355 WeakPolarHBondContact OG1-CA 3.3Å; T254-S355 PolarHBondContact OG1-O 3.31Å; T254-S355 VanDerWaalsContact OG1-O 3.07Å; T254-I399 CarbonylContact C-O 3.42Å; T254-I399 WeakPolarHBondContact CA-O 3.44Å; T254-I399 WeakPolarHBondContact CB-O 3.33Å; T254-I399 HydrophobicContact CG2-CG2 3.51Å; T254-I400 HydrophobicContact CG2-CG1 4.44Å
255	N	82.3	Confident	87.2	Confident	108 Å²	108	39.2 Å²	39.2	58%	0.578	20%	0.202	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-66.4	-19.8	179.2	-70	-45.2	0	0	0	113	I399 D401	N255-I399 PolarHBondContact N-O 3.46Å; N255-D401 VanDerWaalsContact OD1-CB 3.27Å; N255-D401 WeakPolarHBondContact OD1-CB 3.46Å
256	G	78.7	Confident	87.3	Confident	39 Å²	39	39.1 Å²	39.1	40%	0.402	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	-178.8	179.3	0	0	0	0	0	111.9	T254	T254-G256 PolarHBondContact O-N 3.46Å; T254-G256 PolarHBondContact OG1-O 2.97Å
257	E	77	Confident	87.3	Confident	138 Å²	138	38.1 Å²	38.1	65%	0.645	19%	0.189	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	133.6	178.2	-65.9	176.1	170.9	0	0	110.7	L353	E257-L353 HydrophobicContact CB-CB 4.49Å; E257-L353 WeakPolarHBondContact OE2-CD1 3.32Å
258	I	78.2	Confident	87.2	Confident	5 Å²	5	33.6 Å²	33.6	3%	0.026	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	138.8	-180	-47.4	166.6	0	0	0	108.6	T254 S262 F264 L348 T354 V357 I399	T254-I258 HydrophobicContact CG2-CD1 3.57Å; T254-I258 HydrophobicContact CG2-CG1 3.84Å; T254-I258 WeakPolarHBondContact OG1-CG1 3.41Å; I258-S262 WeakPolarHBondContact CG2-OG 3.37Å; I258-F264 HydrophobicContact CD1-CE2 4.18Å; I258-F264 HydrophobicContact CD1-CZ 4.08Å; I258-F264 HydrophobicContact CG2-CE2 3.73Å; I258-F264 HydrophobicContact CG2-CZ 3.88Å; I258-L348 HydrophobicContact CB-CD1 3.65Å; I258-L348 HydrophobicContact CD1-CD1 3.73Å; I258-L348 HydrophobicContact CG1-CD1 4.31Å; I258-L348 HydrophobicContact CG2-CD1 3.51Å; I258-T354 WeakPolarHBondContact CB-O 3.05Å; I258-T354 WeakPolarHBondContact CD1-O 3.47Å; I258-T354 VanDerWaalsContact CG1-O 3.24Å; I258-T354 WeakPolarHBondContact CG1-O 3.47Å; I258-T354 PolarHBondContact N-O 3.46Å; I258-V357 HydrophobicContact CD1-CG2 3.49Å; I258-V357 VanDerWaalsContact CD1-CG2 3.49Å; I258-I399 HydrophobicContact CG1-CG2 4.47Å
259	R	77.8	Confident	86.8	Confident	141 Å²	141	33.8 Å²	33.8	53%	0.532	17%	0.174	S	C	.	.	P	Polyproline II helix	trans	-58.8	138.8	173.1	-73.1	-172.5	178.2	153.5	6.2	111.2	S262 D393	R259-S262 WeakPolarHBondContact O-CB 3.5Å; R259-S262 PolarHBondContact O-N 3.07Å; R259-S262 PolarHBondContact O-OG 3.08Å; R259-D393 IonicContact CZ-OD1 3.67Å; R259-D393 IonicContact CZ-OD2 3.06Å; R259-D393 IonicContact NH1-OD1 2.71Å; R259-D393 PolarHBondContact NH1-OD1 2.73Å; R259-D393 IonicContact NH1-OD2 2.89Å; R259-D393 PolarHBondContact NH1-OD2 2.84Å; R259-D393 IonicContact NH2-OD1 3.94Å; R259-D393 IonicContact NH2-OD2 2.61Å; R259-D393 PolarHBondContact NH2-OD2 2.82Å
260	P	77	Confident	86.2	Confident	51 Å²	51	40.7 Å²	40.7	33%	0.331	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	150.4	171.5	-19.3	30.5	0	0	0	111.4	S262 E350 L353	P260-S262 PolarHBondContact O-N 3.47Å; P260-S262 VanDerWaalsContact O-N 3.14Å; P260-E350 WeakPolarHBondContact CB-O 3.24Å; P260-E350 WeakPolarHBondContact CG-O 3.46Å; P260-L353 HydrophobicContact CG-CD2 4.15Å
261	N	81.3	Confident	85.3	Confident	83 Å²	83	41.8 Å²	41.8	44%	0.444	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	15.4	-178.5	-148.2	23.4	0	0	0	115.4	L348 E350	N261-L348 WeakPolarHBondContact CA-O 3.26Å; N261-L348 PolarHBondContact N-O 3.23Å; N261-L348 VanDerWaalsContact N-O 3.13Å; N261-E350 HydrophobicContact CB-CG 4.47Å
262	S	84.6	Confident	84	Confident	3 Å²	3	43.4 Å²	43.4	2%	0.021	22%	0.219	C	C	.	.			trans	-70.5	146.7	167.8	55.5	0	0	0	0	110.9	I258 R259 P260 L348	I258-S262 WeakPolarHBondContact CG2-OG 3.37Å; R259-S262 WeakPolarHBondContact O-CB 3.5Å; R259-S262 PolarHBondContact O-N 3.07Å; R259-S262 PolarHBondContact O-OG 3.08Å; P260-S262 PolarHBondContact O-N 3.47Å; P260-S262 VanDerWaalsContact O-N 3.14Å; S262-L348 PolarHBondContact O-N 3.39Å; S262-L348 VanDerWaalsContact O-N 3.15Å; S262-L348 WeakPolarHBondContact OG-CD1 3.48Å
263	I	85.6	Confident	82.2	Confident	47 Å²	47	46.9 Å²	46.9	24%	0.241	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	121.2	-175.3	-55.6	172.5	0	0	0	108.3	T265 I347 N390	I263-T265 HydrophobicContact CG2-CG2 4.4Å; I263-I347 HydrophobicContact CG1-CG1 4.32Å; I263-I347 HydrophobicContact CG1-CG2 4.44Å; I263-N390 PolarHBondContact O-N 3.39Å
264	F	89.8	Confident	80.1	Confident	1 Å²	1	54.7 Å²	54.7	0%	0.004	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	141.2	170	-65.7	-105.6	0	0	0	110.8	I258 K345 T346 L348 V357 F359 I387 I388 C389	I258-F264 HydrophobicContact CD1-CE2 4.18Å; I258-F264 HydrophobicContact CD1-CZ 4.08Å; I258-F264 HydrophobicContact CG2-CE2 3.73Å; I258-F264 HydrophobicContact CG2-CZ 3.88Å; F264-K345 WeakPolarHBondContact O-CA 3.37Å; F264-T346 PolarHBondContact N-O 2.9Å; F264-T346 PolarHBondContact O-N 3.03Å; F264-L348 HydrophobicContact CE2-CD1 4.28Å; F264-V357 HydrophobicContact CB-CG1 4.1Å; F264-V357 HydrophobicContact CD1-CG2 4.46Å; F264-V357 HydrophobicContact CD2-CG1 4.21Å; F264-V357 HydrophobicContact CD2-CG2 3.83Å; F264-V357 HydrophobicContact CE1-CG2 4.39Å; F264-V357 HydrophobicContact CE2-CG2 3.8Å; F264-V357 HydrophobicContact CG-CG1 4.13Å; F264-V357 HydrophobicContact CG-CG2 4.19Å; F264-V357 HydrophobicContact CZ-CG2 4.08Å; F264-F359 HydrophobicContact CB-CE1 3.94Å; F264-F359 HydrophobicContact CB-CZ 3.57Å; F264-I387 HydrophobicContact CD1-CG2 4.16Å; F264-I388 CarbonylContact C-O 3.57Å; F264-I388 VanDerWaalsContact CA-O 3.27Å; F264-I388 WeakPolarHBondContact CA-O 3.38Å; F264-C389 HydrophobicContact CD1-CB 3.84Å; F264-C389 HydrophobicContact CE1-CB 3.6Å; F264-C389 HydrophobicContact CG-CB 4.46Å; F264-C389 HydrophobicContact CZ-CB 3.98Å
265	T	90.2	Very high	77.6	Confident	6 Å²	6	64 Å²	64	4%	0.037	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	137.7	176.7	60.4	0	0	0	0	110.1	I263 W267 K345 I388 N390	I263-T265 HydrophobicContact CG2-CG2 4.4Å; T265-W267 PolarHBondContact OG1-NE1 3.45Å; T265-K345 HydrophobicContact CG2-CB 4.21Å; T265-I388 PolarHBondContact N-O 3.39Å; T265-I388 PolarHBondContact O-N 3.3Å; T265-N390 PolarHBondContact OG1-OD1 3Å
266	C	92.8	Very high	75.2	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	124.5	-179.9	-174.9	0	0	0	0	109.2	I343 D344 F359 I385	C266-I343 HydrophobicContact CB-CB 4.32Å; C266-I343 WeakPolarHBondContact O-CB 3.28Å; C266-I343 PolarHBondContact O-N 3.08Å; C266-D344 PolarHBondContact N-O 3.38Å; C266-F359 HydrophobicContact CB-CD1 3.71Å; C266-F359 HydrophobicContact CB-CD2 4.41Å; C266-F359 HydrophobicContact CB-CE1 3.9Å; C266-F359 HydrophobicContact CB-CG 3.97Å; C266-F359 HydrophobicContact CB-CZ 4.32Å; C266-I385 WeakPolarHBondContact SG-CG2 3.43Å
267	W	91.1	Very high	73	Confident	35 Å²	35	70.6 Å²	70.6	13%	0.133	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	145.6	-173.3	-68.3	88.2	0	0	0	112	T265 L338 K340 E342 I385 M386	T265-W267 PolarHBondContact OG1-NE1 3.45Å; W267-L338 HydrophobicContact CB-CD1 3.68Å; W267-L338 HydrophobicContact CD2-CD1 3.86Å; W267-L338 HydrophobicContact CD2-CD2 4.3Å; W267-L338 HydrophobicContact CD2-CG 4.41Å; W267-L338 HydrophobicContact CE3-CD1 3.65Å; W267-L338 HydrophobicContact CE3-CD2 3.74Å; W267-L338 HydrophobicContact CE3-CG 3.76Å; W267-L338 HydrophobicContact CG-CD1 3.9Å; W267-L338 HydrophobicContact CH2-CD2 4.42Å; W267-L338 HydrophobicContact CZ3-CD2 3.81Å; W267-L338 HydrophobicContact CZ3-CG 4.22Å; W267-K340 HydrophobicContact CZ3-CG 4.44Å; W267-E342 HydrophobicContact CD2-CB 4Å; W267-E342 HydrophobicContact CE3-CB 4Å; W267-E342 HydrophobicContact CH2-CB 3.8Å; W267-E342 HydrophobicContact CZ2-CB 3.78Å; W267-E342 HydrophobicContact CZ3-CB 3.91Å; W267-I385 CarbonylContact O-C 3.6Å; W267-I385 WeakPolarHBondContact O-CA 3.28Å; W267-M386 HydrophobicContact CB-CB 4.44Å; W267-M386 HydrophobicContact CB-CE 4.24Å; W267-M386 PolarHBondContact N-O 3.36Å; W267-M386 PolarHBondContact O-N 3.45Å
268	E	91.9	Very high	70.8	Confident	16 Å²	16	73.1 Å²	73.1	8%	0.075	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	131	168	-171.9	-179.9	179.1	0	0	108.8	I339 I343 R364 W368	E268-I339 HydrophobicContact CB-CB 4.14Å; E268-I339 HydrophobicContact CG-CB 4.32Å; E268-I339 HydrophobicContact CG-CD1 4Å; E268-I339 PolarHBondContact O-N 2.7Å; E268-I343 HydrophobicContact CB-CD1 4Å; E268-I343 HydrophobicContact CB-CG1 4.23Å; E268-R364 IonicContact OE2-CZ 3.69Å; E268-R364 IonicContact OE2-NH1 2.71Å; E268-R364 PolarHBondContact OE2-NH1 2.8Å; E268-W368 HydrophobicContact CB-CZ2 4.2Å; E268-W368 VanDerWaalsContact CD-CZ2 3.41Å; E268-W368 HydrophobicContact CG-CZ2 3.79Å; E268-W368 PolarHBondContact OE1-NE1 3.37Å; E268-W368 WeakPolarHBondContact OE2-CZ2 3.45Å; E268-W368 PolarHBondContact OE2-NE1 3.28Å
269	I	87.9	Confident	68.3	Low	5 Å²	5	79.9 Å²	79.9	3%	0.026	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	156.9	175.3	66.2	170.6	0	0	0	110.5	I231 F336 K337 L338 Y384 M386	I231-I269 HydrophobicContact CB-CD1 4.33Å; I231-I269 HydrophobicContact CD1-CD1 3.74Å; I231-I269 HydrophobicContact CG1-CD1 3.89Å; I231-I269 HydrophobicContact CG2-CD1 3.52Å; I231-I269 HydrophobicContact CG2-CG1 4.39Å; I269-F336 HydrophobicContact CB-CB 4.34Å; I269-F336 HydrophobicContact CD1-CB 4.26Å; I269-F336 HydrophobicContact CD1-CD1 3.47Å; I269-F336 VanDerWaalsContact CD1-CD1 3.47Å; I269-F336 HydrophobicContact CD1-CD2 4.47Å; I269-F336 HydrophobicContact CD1-CE1 3.82Å; I269-F336 HydrophobicContact CD1-CG 3.83Å; I269-F336 HydrophobicContact CD1-CZ 4.45Å; I269-F336 HydrophobicContact CG1-CD1 4.17Å; I269-K337 CarbonylContact C-O 3.58Å; I269-K337 WeakPolarHBondContact CA-O 3.46Å; I269-L338 HydrophobicContact CG2-CD1 3.83Å; I269-Y384 PolarHBondContact N-O 2.94Å; I269-Y384 WeakPolarHBondContact O-CB 3.31Å; I269-M386 HydrophobicContact CD1-CB 4.23Å; I269-M386 HydrophobicContact CG2-CB 3.94Å; I269-M386 HydrophobicContact CG2-CE 3.86Å; I269-M386 HydrophobicContact CG2-SD 4.4Å
270	Y	82.2	Confident	66	Low	145 Å²	145	85.1 Å²	85.1	57%	0.569	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128	124.8	172.4	-173.6	-93.8	0	0	0	110.3	T272 F336 K337	Y270-T272 PolarHBondContact O-N 3.32Å; Y270-F336 CarbonylContact O-C 3.07Å; Y270-F336 VanDerWaalsContact O-CA 3.3Å; Y270-F336 WeakPolarHBondContact O-CA 3.44Å; Y270-K337 PolarHBondContact N-O 2.86Å; Y270-K337 PolarHBondContact O-N 3.34Å
271	P	77.7	Confident	63.6	Low	24 Å²	24	90.4 Å²	90.4	16%	0.156	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	129.2	178.7	27.6	-33.8	0	0	0	110.9	M335 F336 Y384	P271-M335 CarbonylContact C-O 3.53Å; P271-M335 WeakPolarHBondContact CA-O 3.42Å; P271-F336 HydrophobicContact CB-CD1 3.99Å; P271-F336 HydrophobicContact CB-CE1 3.97Å; P271-Y384 VanDerWaalsContact CD-CE2 3.46Å; P271-Y384 HydrophobicContact CG-CD2 4.04Å; P271-Y384 HydrophobicContact CG-CE1 4.41Å; P271-Y384 HydrophobicContact CG-CE2 3.6Å
272	T	68.3	Low	61	Low	45 Å²	45	91.9 Å²	91.9	28%	0.276	43%	0.429	S	S	.	.			trans	-96.6	-20.9	178.6	43.2	0	0	0	0	113.7	Y270 F274 R334 M335 F336 K337	Y270-T272 PolarHBondContact O-N 3.32Å; T272-F274 VanDerWaalsContact C-N 3.28Å; T272-F274 PolarHBondContact O-N 3.17Å; T272-R334 PolarHBondContact OG1-O 3.43Å; T272-M335 PolarHBondContact N-O 3.42Å; T272-M335 PolarHBondContact OG1-O 3.4Å; T272-M335 VanDerWaalsContact OG1-O 3.05Å; T272-F336 PolarHBondContact OG1-N 2.88Å; T272-K337 HydrophobicContact CG2-CB 4.17Å; T272-K337 HydrophobicContact CG2-CD 3.57Å; T272-K337 HydrophobicContact CG2-CG 3.51Å
273	L	53.5	Low	58.3	Low	75 Å²	75	99.9 Å²	99.9	39%	0.393	47%	0.471	S	S	.	.			trans	-69	83.1	176.9	-72	173.9	0	0	0	109.6	P223 M335	P223-L273 HydrophobicContact CG-CD1 3.97Å; L273-M335 HydrophobicContact CD1-CB 4.13Å; L273-M335 HydrophobicContact CD1-CE 3.81Å; L273-M335 HydrophobicContact CD1-CG 3.61Å; L273-M335 HydrophobicContact CD1-SD 4.42Å; L273-M335 HydrophobicContact CG-CB 4.38Å; L273-M335 HydrophobicContact CG-CG 4.1Å
274	F	47	Very low	55.5	Low	176 Å²	176	103.3 Å²	103.3	77%	0.772	49%	0.49	S	S	*	.			trans	175.9	74.4	150.4	-87.2	-64	0	0	0	109.1	T272	T272-F274 VanDerWaalsContact C-N 3.28Å; T272-F274 PolarHBondContact O-N 3.17Å
275	K	36	Very low	52.6	Low	201 Å²	201	109.4 Å²	109.4	87%	0.874	52%	0.523	S	S	*	.			trans	-102.9	95.9	136.4	-80.4	-171	177.8	-175.2	0	105.2	K277	K275-K277 PolarHBondContact O-N 3.5Å; K275-K277 VanDerWaalsContact O-N 3.07Å
276	P	31.7	Very low	49.8	Very low	83 Å²	83	115.4 Å²	115.4	54%	0.539	56%	0.555	S	S	.	*			trans	-61	118.7	171.4	27.1	-29.2	0	0	0	105.8	F278	P276-F278 PolarHBondContact O-N 2.78Å
277	K	32.7	Very low	46.7	Very low	203 Å²	203	122.3 Å²	122.3	88%	0.883	59%	0.592	S	S	*	*	S	Bend	trans	-68.6	13.7	178.4	-124	-179	-178	-175.9	0	113	K275	K275-K277 PolarHBondContact O-N 3.5Å; K275-K277 VanDerWaalsContact O-N 3.07Å
278	F	29.9	Very low	43.9	Very low	191 Å²	191	128.6 Å²	128.6	84%	0.838	63%	0.628	S	S	*	*			trans	-138.2	86.7	-177.5	-86.9	-87	0	0	0	108.5	P276	P276-F278 PolarHBondContact O-N 2.78Å
279	L	25.1	Very low	40.8	Very low	146 Å²	146	131.7 Å²	131.7	76%	0.764	66%	0.657	S	S	*	*			trans	-173.2	53.5	157.2	-97.3	157.6	0	0	0	108
280	W	30.8	Very low	37.9	Very low	251 Å²	251	138.6 Å²	138.6	95%	0.951	69%	0.693	S	S	*	*			trans	-111.4	82.4	151.3	-60.3	86.5	0	0	0	104.1
281	L	25.4	Very low	35.5	Very low	162 Å²	162	139.7 Å²	139.7	85%	0.848	71%	0.709	S	S	*	*			trans	-103.4	99.7	165.5	-141.3	89.5	0	0	0	104.9
282	N	26.8	Very low	33	Very low	114 Å²	114	146.9 Å²	146.9	61%	0.61	74%	0.741	S	S	*	*			trans	19.1	103.8	157.3	-56.5	21.9	0	0	0	116.5	D284	N282-D284 PolarHBondContact ND2-OD2 2.88Å
283	N	27.5	Very low	31.1	Very low	171 Å²	171	151.4 Å²	151.4	91%	0.914	76%	0.763	S	S	*	*			trans	-98.5	83.1	132.2	-86.8	-1.5	0	0	0	105.9
284	D	26.8	Very low	30	Very low	119 Å²	119	154.9 Å²	154.9	64%	0.636	78%	0.782	S	S	*	*			trans	-68.9	117	146.8	-61.4	-53.2	0	0	0	104.4	N282	N282-D284 PolarHBondContact ND2-OD2 2.88Å
285	N	29.9	Very low	28.8	Very low	130 Å²	130	153.1 Å²	153.1	70%	0.695	78%	0.781	S	S	*	*			trans	177.8	119.2	152.6	-89.6	-1.6	0	0	0	109.6
286	D	30.1	Very low	28.3	Very low	131 Å²	131	148.2 Å²	148.2	70%	0.701	77%	0.77	S	S	*	*			trans	80.9	90.1	141.3	-47.2	-25.2	0	0	0	117
287	D	27.8	Very low	28	Very low	146 Å²	146	149.3 Å²	149.3	78%	0.781	78%	0.775	S	S	*	*				30.8	107.1	115.5	-57.6	-22.8	0	0	0	116.3
288	D	33	Very low	27.6	Very low	167 Å²	167	143.6 Å²	143.6	89%	0.893	77%	0.765	S	S	*	*			trans	-163.7	107.5	139.6	-90.5	-33.1	0	0	0	110
289	A	27.6	Very low	27.4	Very low	81 Å²	81	141 Å²	141	67%	0.669	76%	0.755	S	S	*	*			trans	45.8	113.9	141.2	0	0	0	0	0	120.8
290	D	26.8	Very low	27.4	Very low	149 Å²	149	140.1 Å²	140.1	80%	0.797	76%	0.756	S	S	*	*				52.2	83.6	121.1	-48.6	-20.6	0	0	0	117.8
291	D	31.4	Very low	27	Very low	168 Å²	168	135.7 Å²	135.7	90%	0.898	74%	0.744	S	S	*	*			trans	-133.9	92.8	138.7	-85.9	-39.8	0	0	0	107.4	D293	D291-D293 PolarHBondContact O-N 2.93Å
292	E	25.7	Very low	27.1	Very low	176 Å²	176	132.1 Å²	132.1	82%	0.822	73%	0.733	S	S	*	*			trans	-57.7	121.9	159.4	-66.1	177.4	149	0	0	108.3
293	D	28.4	Very low	27.1	Very low	140 Å²	140	135.2 Å²	135.2	75%	0.749	74%	0.744	S	S	*	*				163.6	130.3	123.6	-83.8	-27	0	0	0	112.9	D291	D291-D293 PolarHBondContact O-N 2.93Å
294	N	29.3	Very low	27	Very low	147 Å²	147	133.5 Å²	133.5	79%	0.786	73%	0.733	S	S	*	*			trans	85.1	68.7	159.3	-54.3	-44.7	0	0	0	118.6	P296	N294-P296 WeakPolarHBondContact O-CD 3.25Å
295	D	22.5	Very low	26.9	Very low	139 Å²	139	134.4 Å²	134.4	74%	0.743	74%	0.738	S	S	*	*			trans	-86	121	145.2	-170.3	11.6	0	0	0	109.1	T297	D295-T297 PolarHBondContact OD1-N 2.73Å
296	P	24.5	Very low	26.8	Very low	99 Å²	99	136 Å²	136	64%	0.643	75%	0.745	S	S	*	*			trans	-114.8	115.6	144.7	31.3	-19.9	0	0	0	108.6	N294	N294-P296 WeakPolarHBondContact O-CD 3.25Å
297	T	26.9	Very low	26.6	Very low	106 Å²	106	136.4 Å²	136.4	65%	0.65	75%	0.747	S	S	*	*			trans	78	73.9	148.7	65.7	0	0	0	0	115.6	D295 E299	D295-T297 PolarHBondContact OD1-N 2.73Å; T297-E299 PolarHBondContact O-N 3.42Å
298	A	22.7	Very low	26.6	Very low	82 Å²	82	136.9 Å²	136.9	68%	0.678	75%	0.749	S	S	*	*			trans	-58.3	72.9	140.5	0	0	0	0	0	110.3	T300	A298-T300 PolarHBondContact O-N 2.9Å
299	E	25.9	Very low	26.2	Very low	136 Å²	136	137.2 Å²	137.2	64%	0.636	74%	0.743	S	S	*	*			trans	-64.4	119.1	166.4	-81.3	-176.2	178.4	0	0	108.7	T297 F301	T297-E299 PolarHBondContact O-N 3.42Å; E299-F301 VanDerWaalsContact C-N 3.32Å; E299-F301 HydrophobicContact CB-CD2 4.42Å; E299-F301 HydrophobicContact CB-CE2 4.11Å; E299-F301 PolarHBondContact O-N 2.96Å
300	T	25.4	Very low	26.3	Very low	128 Å²	128	140.5 Å²	140.5	79%	0.785	75%	0.75	S	S	*	*			trans	-66.6	87.2	-178.9	-46.9	0	0	0	0	108.5	A298 S302	A298-T300 PolarHBondContact O-N 2.9Å; T300-S302 PolarHBondContact O-N 2.84Å
301	F	23.5	Very low	26.6	Very low	159 Å²	159	142.2 Å²	142.2	70%	0.697	75%	0.753	S	S	*	*			trans	-76.3	79.4	168.7	-80.7	-80.8	0	0	0	109.4	E299 Q303 I304	E299-F301 VanDerWaalsContact C-N 3.32Å; E299-F301 HydrophobicContact CB-CD2 4.42Å; E299-F301 HydrophobicContact CB-CE2 4.11Å; E299-F301 PolarHBondContact O-N 2.96Å; F301-Q303 PolarHBondContact O-N 3.22Å; F301-I304 HydrophobicContact CD1-CD1 3.99Å
302	S	27	Very low	26.4	Very low	87 Å²	87	140.5 Å²	140.5	61%	0.608	74%	0.742	S	S	*	*			trans	-51	124.5	156.9	51.2	0	0	0	0	109.4	T300 I304	T300-S302 PolarHBondContact O-N 2.84Å; S302-I304 PolarHBondContact O-N 3.38Å; S302-I304 VanDerWaalsContact O-N 3.13Å
303	Q	26.7	Very low	26.5	Very low	179 Å²	179	140.7 Å²	140.7	84%	0.836	74%	0.743	S	S	*	*			trans	31.6	73.7	148	-66.2	172.8	-25	0	0	114.8	F301 D305	F301-Q303 PolarHBondContact O-N 3.22Å; Q303-D305 VanDerWaalsContact C-N 3.31Å; Q303-D305 PolarHBondContact O-N 2.98Å
304	I	24.5	Very low	26.7	Very low	134 Å²	134	141.1 Å²	141.1	69%	0.687	75%	0.745	S	S	*	*			trans	-71.6	99.4	161.6	-63.2	170.5	0	0	0	106.1	F301 S302	F301-I304 HydrophobicContact CD1-CD1 3.99Å; S302-I304 PolarHBondContact O-N 3.38Å; S302-I304 VanDerWaalsContact O-N 3.13Å
305	D	25.7	Very low	26.7	Very low	139 Å²	139	140.1 Å²	140.1	74%	0.743	74%	0.74	S	S	*	*			trans	-52.4	134.5	169.1	-87.6	-36.7	0	0	0	110	Q303 N307	Q303-D305 VanDerWaalsContact C-N 3.31Å; Q303-D305 PolarHBondContact O-N 2.98Å; D305-N307 PolarHBondContact O-N 3.42Å
306	I	26.7	Very low	27.2	Very low	163 Å²	163	139 Å²	139	84%	0.836	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.7	17.1	-161.1	-72.9	163	0	0	0	114.1
307	N	26.1	Very low	27.4	Very low	140 Å²	140	141.4 Å²	141.4	75%	0.749	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.5	10.4	-160.9	-69.8	-5.9	0	0	0	117.3	D305	D305-N307 PolarHBondContact O-N 3.42Å
308	N	28.6	Very low	27.4	Very low	155 Å²	155	142.4 Å²	142.4	83%	0.829	75%	0.748	S	S	*	*			trans	-138.4	73	178.7	-100.7	1.3	0	0	0	113
309	F	24.8	Very low	27.6	Very low	175 Å²	175	147.6 Å²	147.6	77%	0.768	76%	0.758	S	S	*	*			trans	-124.6	48.8	170	-124.2	-89.9	0	0	0	111.1	I312	F309-I312 HydrophobicContact CD1-CD1 4.26Å; F309-I312 HydrophobicContact CE1-CD1 3.44Å; F309-I312 VanDerWaalsContact CE1-CD1 3.44Å; F309-I312 HydrophobicContact CZ-CD1 3.78Å
310	D	30.2	Very low	27.7	Very low	150 Å²	150	145 Å²	145	80%	0.802	76%	0.755	S	S	*	*			trans	-105.3	12.4	172.9	-75.3	-14.9	0	0	0	113
311	E	32	Very low	27.7	Very low	184 Å²	184	144.2 Å²	144.2	86%	0.86	75%	0.75	S	S	*	*	S	Bend	trans	-116.2	12.6	-172.7	-72.2	-169.3	168.9	0	0	116.9
312	I	27.5	Very low	27.9	Very low	132 Å²	132	143.4 Å²	143.4	68%	0.677	75%	0.753	S	S	*	*			trans	-104.5	15.1	174.6	-63.3	161.7	0	0	0	112.8	F309 N314	F309-I312 HydrophobicContact CD1-CD1 4.26Å; F309-I312 HydrophobicContact CE1-CD1 3.44Å; F309-I312 VanDerWaalsContact CE1-CD1 3.44Å; F309-I312 HydrophobicContact CZ-CD1 3.78Å; I312-N314 VanDerWaalsContact C-N 3.32Å; I312-N314 PolarHBondContact O-N 3.15Å
313	E	28.7	Very low	28.1	Very low	181 Å²	181	143.4 Å²	143.4	85%	0.846	75%	0.746	S	S	*	*			trans	-80	4.6	178.2	-83.6	-164.7	159.9	0	0	116.4
314	N	31.9	Very low	28.3	Very low	148 Å²	148	138.1 Å²	138.1	79%	0.791	72%	0.72	S	S	*	*			trans	-114	40.4	-169	-67.9	-26	0	0	0	116.2	I312 P316	I312-N314 VanDerWaalsContact C-N 3.32Å; I312-N314 PolarHBondContact O-N 3.15Å; N314-P316 WeakPolarHBondContact O-CD 3.3Å
315	D	28.9	Very low	28.8	Very low	126 Å²	126	139.2 Å²	139.2	67%	0.674	73%	0.727	S	S	*	*			trans	-102.8	99	166.7	-131.8	-13.7	0	0	0	110.4	N317	D315-N317 PolarHBondContact O-N 2.71Å; D315-N317 VanDerWaalsContact O-N 3.11Å
316	P	32.1	Very low	29.4	Very low	115 Å²	115	136.2 Å²	136.2	75%	0.747	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	-1.5	-165.7	-5.6	21.3	0	0	0	114.6	N314	N314-P316 WeakPolarHBondContact O-CD 3.3Å
317	N	29.6	Very low	29.8	Very low	151 Å²	151	133.9 Å²	133.9	81%	0.807	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.5	5.4	-172	-78.8	-17.6	0	0	0	115	D315 Q319	D315-N317 PolarHBondContact O-N 2.71Å; D315-N317 VanDerWaalsContact O-N 3.11Å; N317-Q319 PolarHBondContact O-N 3.26Å
318	I	27.8	Very low	30.4	Very low	127 Å²	127	130 Å²	130	65%	0.651	68%	0.677	S	S	*	*			trans	-98.2	86.1	174.2	-54.5	177.6	0	0	0	108.8	S320	I318-S320 PolarHBondContact O-N 3.18Å
319	Q	26.6	Very low	30.9	Very low	190 Å²	190	127.4 Å²	127.4	89%	0.888	66%	0.658	S	S	*	*			trans	-68.2	68.7	163.6	-68.8	-174.5	-7.9	0	0	109.7	N317 T321	N317-Q319 PolarHBondContact O-N 3.26Å; Q319-T321 PolarHBondContact O-N 2.69Å; Q319-T321 VanDerWaalsContact O-N 3.15Å
320	S	26.5	Very low	31.6	Very low	82 Å²	82	125.4 Å²	125.4	57%	0.573	66%	0.655	S	S	*	*			trans	-76.6	100.9	169.7	61.7	0	0	0	0	108.4	I318 N322	I318-S320 PolarHBondContact O-N 3.18Å; S320-N322 PolarHBondContact O-N 3.2Å
321	T	25.7	Very low	32.4	Very low	111 Å²	111	121.1 Å²	121.1	68%	0.681	63%	0.634	S	S	*	*			trans	-42.1	126.6	169.2	51.5	0	0	0	0	111.2	Q319 L323	Q319-T321 PolarHBondContact O-N 2.69Å; Q319-T321 VanDerWaalsContact O-N 3.15Å; T321-L323 PolarHBondContact O-N 2.97Å
322	N	28.3	Very low	33.2	Very low	143 Å²	143	113.7 Å²	113.7	77%	0.765	60%	0.6	S	S	*	*			trans	-61.8	61.2	-176.2	-69.5	-33	0	0	0	114.6	S320 F324	S320-N322 PolarHBondContact O-N 3.2Å; N322-F324 VanDerWaalsContact C-N 3.27Å; N322-F324 PolarHBondContact O-N 3.13Å
323	L	31.6	Very low	34.6	Very low	87 Å²	87	112.9 Å²	112.9	46%	0.455	60%	0.597	S	S	.	*			trans	-81.1	-0.6	179.8	-93.2	145	0	0	0	114.2	T321	T321-L323 PolarHBondContact O-N 2.97Å
324	F	31.3	Very low	36.1	Very low	68 Å²	68	113.3 Å²	113.3	30%	0.298	59%	0.591	S	S	.	*			trans	-144.5	83.4	179.9	-68.1	-81.6	0	0	0	111.2	N322 K329 I388	N322-F324 VanDerWaalsContact C-N 3.27Å; N322-F324 PolarHBondContact O-N 3.13Å; F324-K329 HydrophobicContact CB-CD 4.12Å; F324-K329 HydrophobicContact CB-CG 3.92Å; F324-I388 HydrophobicContact CE1-CD1 4.43Å; F324-I388 HydrophobicContact CZ-CD1 4.39Å
325	N	34.3	Very low	37.7	Very low	156 Å²	156	106.7 Å²	106.7	83%	0.834	56%	0.555	S	S	*	*			trans	-90.6	20.1	166.1	-122.6	22.3	0	0	0	112.5
326	Y	37.7	Very low	39.9	Very low	76 Å²	76	101.1 Å²	101.1	30%	0.298	53%	0.525	S	S	.	.	S	Bend	trans	-95.9	150.3	-178.2	-77.1	-90.7	0	0	0	111.9	Y328 K329 H394	Y326-Y328 AromaticContact CD1-CD2 3.93Å; Y326-Y328 HydrophobicContact CD1-CD2 3.93Å; Y326-Y328 AromaticContact CD1-CE2 3.92Å; Y326-Y328 HydrophobicContact CD1-CE2 3.92Å; Y326-Y328 HydrophobicContact CG-CD2 4.04Å; Y326-Y328 HydrophobicContact CG-CE2 4.49Å; Y326-Y328 PolarHBondContact O-N 3.49Å; Y326-K329 PolarHBondContact O-N 3.46Å; Y326-H394 AromaticContact CE1-CE1 3.83Å; Y326-H394 AromaticContact CE1-ND1 3.54Å; Y326-H394 AromaticContact CZ-CE1 3.53Å; Y326-H394 AromaticContact CZ-ND1 3.58Å; Y326-H394 PolarHBondContact OH-CE1 2.89Å; Y326-H394 VanDerWaalsContact OH-CE1 3.3Å; Y326-H394 PolarHBondContact OH-ND1 2.8Å
327	P	36.5	Very low	42.3	Very low	115 Å²	115	102.3 Å²	102.3	75%	0.747	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-7.1	172.6	25.6	-33.2	0	0	0	113.6	K329	P327-K329 VanDerWaalsContact C-N 3.34Å; P327-K329 PolarHBondContact O-N 3.35Å
328	Y	37.3	Very low	44.8	Very low	57 Å²	57	98.1 Å²	98.1	22%	0.224	50%	0.496	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-14.9	175.9	-59.8	-62.1	0	0	0	115.3	L226 P227 Y326 L330 T331 M332	L226-Y328 HydrophobicContact CD2-CD1 3.97Å; L226-Y328 HydrophobicContact CD2-CE1 4.16Å; P227-Y328 HydrophobicContact CG-CE1 4.14Å; P227-Y328 WeakPolarHBondContact CG-OH 3.24Å; Y326-Y328 AromaticContact CD1-CD2 3.93Å; Y326-Y328 HydrophobicContact CD1-CD2 3.93Å; Y326-Y328 AromaticContact CD1-CE2 3.92Å; Y326-Y328 HydrophobicContact CD1-CE2 3.92Å; Y326-Y328 HydrophobicContact CG-CD2 4.04Å; Y326-Y328 HydrophobicContact CG-CE2 4.49Å; Y326-Y328 PolarHBondContact O-N 3.49Å; Y328-L330 VanDerWaalsContact C-N 3.33Å; Y328-L330 PolarHBondContact O-N 2.92Å; Y328-T331 PolarHBondContact O-N 3.41Å; Y328-T331 PolarHBondContact O-OG1 2.7Å; Y328-M332 VanDerWaalsContact O-CB 3.25Å; Y328-M332 WeakPolarHBondContact O-CB 3.39Å; Y328-M332 PolarHBondContact O-N 2.91Å
329	K	39.4	Very low	47.4	Very low	101 Å²	101	95 Å²	95	44%	0.439	48%	0.48	S	S	.	.	H	α-helix	trans	-56.7	-44.9	-169.3	-148.8	-178.7	-169.1	-178	0	112.5	F324 Y326 P327 N333	F324-K329 HydrophobicContact CB-CD 4.12Å; F324-K329 HydrophobicContact CB-CG 3.92Å; Y326-K329 PolarHBondContact O-N 3.46Å; P327-K329 VanDerWaalsContact C-N 3.34Å; P327-K329 PolarHBondContact O-N 3.35Å; K329-N333 VanDerWaalsContact O-CB 3.27Å; K329-N333 WeakPolarHBondContact O-CB 3.23Å; K329-N333 PolarHBondContact O-N 3.41Å
330	L	39	Very low	50.1	Low	134 Å²	134	94.2 Å²	94.2	70%	0.702	47%	0.473	S	S	*	.	H	α-helix	trans	-73	-41.3	-178.8	-79.5	162	0	0	0	113	Y328 R334	Y328-L330 VanDerWaalsContact C-N 3.33Å; Y328-L330 PolarHBondContact O-N 2.92Å; L330-R334 WeakPolarHBondContact O-CG 3.2Å
331	T	48.2	Very low	53.1	Low	59 Å²	59	94.8 Å²	94.8	36%	0.362	48%	0.475	S	S	.	.	H	α-helix	trans	-74.5	-46.2	-178.7	49.3	0	0	0	0	111.1	Y328 R334 M335	Y328-T331 PolarHBondContact O-N 3.41Å; Y328-T331 PolarHBondContact O-OG1 2.7Å; T331-R334 PolarHBondContact O-N 3.48Å; T331-M335 WeakPolarHBondContact O-CB 3.33Å; T331-M335 WeakPolarHBondContact O-CG 3.44Å; T331-M335 PolarHBondContact O-N 2.95Å; T331-M335 VanDerWaalsContact O-N 3.11Å
332	M	47.5	Very low	56.1	Low	29 Å²	29	92.4 Å²	92.4	14%	0.143	46%	0.456	C	S	.	.	H	α-helix	trans	-63.4	-43.6	178.8	-75.9	-72.2	-77.8	0	0	112.4	L226 I231 Y328 R334 M335 F336 M386	L226-M332 HydrophobicContact CD1-SD 3.87Å; I231-M332 HydrophobicContact CD1-CE 4.13Å; I231-M332 HydrophobicContact CD1-SD 4.47Å; Y328-M332 VanDerWaalsContact O-CB 3.25Å; Y328-M332 WeakPolarHBondContact O-CB 3.39Å; Y328-M332 PolarHBondContact O-N 2.91Å; M332-R334 PolarHBondContact O-N 3.44Å; M332-M335 PolarHBondContact O-N 3.37Å; M332-F336 HydrophobicContact CE-CD2 3.92Å; M332-F336 HydrophobicContact CE-CE2 4.44Å; M332-F336 PolarHBondContact O-N 3.39Å; M332-F336 VanDerWaalsContact O-O 3.1Å; M332-F336 HydrophobicContact SD-CD2 3.57Å; M332-F336 VanDerWaalsContact SD-CD2 3.57Å; M332-F336 HydrophobicContact SD-CE2 3.84Å; M332-M386 HydrophobicContact CE-SD 3.49Å; M332-M386 WeakPolarHBondContact CE-SD 3.43Å
333	N	56.8	Low	59.1	Low	114 Å²	114	86.6 Å²	86.6	61%	0.61	43%	0.425	S	S	*	.	H	α-helix	trans	-62.1	-29.8	179.3	-78.6	4.7	0	0	0	112.8	K329	K329-N333 VanDerWaalsContact O-CB 3.27Å; K329-N333 WeakPolarHBondContact O-CB 3.23Å; K329-N333 PolarHBondContact O-N 3.41Å
334	R	61.5	Low	62.1	Low	190 Å²	190	84.5 Å²	84.5	72%	0.717	41%	0.414	S	S	*	.	H	α-helix	trans	-77.4	-27.1	173.5	-72.1	-177.9	176.5	173.3	0.8	112.6	T272 L330 T331 M332	T272-R334 PolarHBondContact OG1-O 3.43Å; L330-R334 WeakPolarHBondContact O-CG 3.2Å; T331-R334 PolarHBondContact O-N 3.48Å; M332-R334 PolarHBondContact O-N 3.44Å
335	M	65	Low	64.9	Low	9 Å²	9	87.1 Å²	87.1	4%	0.044	43%	0.425	C	S	.	.	H	α-helix	trans	-96.7	-32.4	-171.3	-66.4	177.3	70.2	0	0	114.6	P222 V224 L226 P271 T272 L273 T331 M332	P222-M335 HydrophobicContact CB-CE 3.47Å; P222-M335 VanDerWaalsContact CB-CE 3.47Å; P222-M335 HydrophobicContact CG-CE 3.99Å; V224-M335 HydrophobicContact CB-CE 3.77Å; V224-M335 HydrophobicContact CB-SD 4.1Å; V224-M335 HydrophobicContact CG2-CE 4.07Å; V224-M335 HydrophobicContact CG2-SD 4.25Å; L226-M335 HydrophobicContact CD1-CE 4.38Å; P271-M335 CarbonylContact C-O 3.53Å; P271-M335 WeakPolarHBondContact CA-O 3.42Å; T272-M335 PolarHBondContact N-O 3.42Å; T272-M335 PolarHBondContact OG1-O 3.4Å; T272-M335 VanDerWaalsContact OG1-O 3.05Å; L273-M335 HydrophobicContact CD1-CB 4.13Å; L273-M335 HydrophobicContact CD1-CE 3.81Å; L273-M335 HydrophobicContact CD1-CG 3.61Å; L273-M335 HydrophobicContact CD1-SD 4.42Å; L273-M335 HydrophobicContact CG-CB 4.38Å; L273-M335 HydrophobicContact CG-CG 4.1Å; T331-M335 WeakPolarHBondContact O-CB 3.33Å; T331-M335 WeakPolarHBondContact O-CG 3.44Å; T331-M335 PolarHBondContact O-N 2.95Å; T331-M335 VanDerWaalsContact O-N 3.11Å; M332-M335 PolarHBondContact O-N 3.37Å
336	F	75.9	Confident	67.5	Low	9 Å²	9	80.6 Å²	80.6	4%	0.039	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	141.4	-176.5	-57	-83.9	0	0	0	110.7	Y220 P222 L226 I231 I269 Y270 P271 T272 M332	Y220-F336 AromaticContact CD1-CE1 3.96Å; Y220-F336 HydrophobicContact CD1-CE1 3.96Å; Y220-F336 AromaticContact CD1-CZ 3.83Å; Y220-F336 HydrophobicContact CD1-CZ 3.83Å; Y220-F336 AromaticContact CE1-CE1 3.66Å; Y220-F336 HydrophobicContact CE1-CE1 3.66Å; Y220-F336 AromaticContact CE1-CZ 3.57Å; Y220-F336 HydrophobicContact CE1-CZ 3.57Å; P222-F336 HydrophobicContact CB-CZ 4.17Å; P222-F336 HydrophobicContact CG-CZ 4.38Å; L226-F336 HydrophobicContact CD1-CE2 4.47Å; I231-F336 HydrophobicContact CD1-CD2 4.25Å; I231-F336 HydrophobicContact CD1-CE1 4.22Å; I231-F336 HydrophobicContact CD1-CE2 3.61Å; I231-F336 HydrophobicContact CD1-CZ 3.58Å; I269-F336 HydrophobicContact CB-CB 4.34Å; I269-F336 HydrophobicContact CD1-CB 4.26Å; I269-F336 HydrophobicContact CD1-CD1 3.47Å; I269-F336 VanDerWaalsContact CD1-CD1 3.47Å; I269-F336 HydrophobicContact CD1-CD2 4.47Å; I269-F336 HydrophobicContact CD1-CE1 3.82Å; I269-F336 HydrophobicContact CD1-CG 3.83Å; I269-F336 HydrophobicContact CD1-CZ 4.45Å; I269-F336 HydrophobicContact CG1-CD1 4.17Å; Y270-F336 CarbonylContact O-C 3.07Å; Y270-F336 VanDerWaalsContact O-CA 3.3Å; Y270-F336 WeakPolarHBondContact O-CA 3.44Å; P271-F336 HydrophobicContact CB-CD1 3.99Å; P271-F336 HydrophobicContact CB-CE1 3.97Å; T272-F336 PolarHBondContact OG1-N 2.88Å; M332-F336 HydrophobicContact CE-CD2 3.92Å; M332-F336 HydrophobicContact CE-CE2 4.44Å; M332-F336 PolarHBondContact O-N 3.39Å; M332-F336 VanDerWaalsContact O-O 3.1Å; M332-F336 HydrophobicContact SD-CD2 3.57Å; M332-F336 VanDerWaalsContact SD-CD2 3.57Å; M332-F336 HydrophobicContact SD-CE2 3.84Å
337	K	81.1	Confident	69.9	Low	141 Å²	141	81.8 Å²	81.8	61%	0.613	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.2	125.6	164.1	-80.4	171.4	-178.7	-171.4	0	109	I269 Y270 T272	I269-K337 CarbonylContact C-O 3.58Å; I269-K337 WeakPolarHBondContact CA-O 3.46Å; Y270-K337 PolarHBondContact N-O 2.86Å; Y270-K337 PolarHBondContact O-N 3.34Å; T272-K337 HydrophobicContact CG2-CB 4.17Å; T272-K337 HydrophobicContact CG2-CD 3.57Å; T272-K337 HydrophobicContact CG2-CG 3.51Å
338	L	82.5	Confident	72.2	Confident	63 Å²	63	77 Å²	77	33%	0.33	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	128.3	172	-170.3	73.7	0	0	0	109.5	W267 I269 M386	W267-L338 HydrophobicContact CB-CD1 3.68Å; W267-L338 HydrophobicContact CD2-CD1 3.86Å; W267-L338 HydrophobicContact CD2-CD2 4.3Å; W267-L338 HydrophobicContact CD2-CG 4.41Å; W267-L338 HydrophobicContact CE3-CD1 3.65Å; W267-L338 HydrophobicContact CE3-CD2 3.74Å; W267-L338 HydrophobicContact CE3-CG 3.76Å; W267-L338 HydrophobicContact CG-CD1 3.9Å; W267-L338 HydrophobicContact CH2-CD2 4.42Å; W267-L338 HydrophobicContact CZ3-CD2 3.81Å; W267-L338 HydrophobicContact CZ3-CG 4.22Å; I269-L338 HydrophobicContact CG2-CD1 3.83Å; L338-M386 HydrophobicContact CD1-CE 3.83Å
339	I	82.8	Confident	74.2	Confident	60 Å²	60	77.7 Å²	77.7	31%	0.308	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	120	176.8	-60.5	179.4	0	0	0	108.4	E268	E268-I339 HydrophobicContact CB-CB 4.14Å; E268-I339 HydrophobicContact CG-CB 4.32Å; E268-I339 HydrophobicContact CG-CD1 4Å; E268-I339 PolarHBondContact O-N 2.7Å
340	K	83	Confident	75.8	Confident	174 Å²	174	79.3 Å²	79.3	76%	0.757	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.2	153.5	175	-66.2	-176	178.5	-178.6	0	110.9	W267	W267-K340 HydrophobicContact CZ3-CG 4.44Å
341	P	89	Confident	77.4	Confident	94 Å²	94	79.4 Å²	79.4	61%	0.61	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	cis	-75.7	176.7	-7.6	33.6	-35.7	0	0	0	111.9	R364	P341-R364 PolarHBondContact O-NH2 2.81Å
342	E	89.4	Confident	78.6	Confident	61 Å²	61	84.4 Å²	84.4	29%	0.285	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.6	152.3	167.7	66.7	-175.5	174.8	0	0	111	W267 K345 R364	W267-E342 HydrophobicContact CD2-CB 4Å; W267-E342 HydrophobicContact CE3-CB 4Å; W267-E342 HydrophobicContact CH2-CB 3.8Å; W267-E342 HydrophobicContact CZ2-CB 3.78Å; W267-E342 HydrophobicContact CZ3-CB 3.91Å; E342-K345 WeakPolarHBondContact OE1-CD 3.19Å; E342-R364 PolarHBondContact O-NH2 3.18Å
343	I	90.5	Very high	79.8	Confident	22 Å²	22	88 Å²	88	11%	0.113	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	-53.1	179.7	-61.5	177.8	0	0	0	109.3	C266 E268 I361 R364 W368 I385	C266-I343 HydrophobicContact CB-CB 4.32Å; C266-I343 WeakPolarHBondContact O-CB 3.28Å; C266-I343 PolarHBondContact O-N 3.08Å; E268-I343 HydrophobicContact CB-CD1 4Å; E268-I343 HydrophobicContact CB-CG1 4.23Å; I343-I361 HydrophobicContact CG2-CB 4.15Å; I343-I361 HydrophobicContact CG2-CD1 4.12Å; I343-I361 HydrophobicContact CG2-CG1 3.78Å; I343-I361 HydrophobicContact CG2-CG2 3.72Å; I343-R364 HydrophobicContact CG1-CG 4.27Å; I343-R364 HydrophobicContact CG2-CB 4.06Å; I343-R364 HydrophobicContact CG2-CG 4.12Å; I343-W368 HydrophobicContact CD1-CH2 3.94Å; I343-W368 HydrophobicContact CD1-CZ2 4.13Å; I343-I385 HydrophobicContact CD1-CG1 4.42Å; I343-I385 HydrophobicContact CD1-CG2 4.46Å
344	D	94.5	Very high	80.9	Confident	43 Å²	43	84.6 Å²	84.6	23%	0.23	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	159.7	-179.5	-168.6	26.7	0	0	0	109.7	C266 F359 N360	C266-D344 PolarHBondContact N-O 3.38Å; D344-F359 HydrophobicContact CB-CB 4.22Å; D344-F359 HydrophobicContact CB-CD1 4.28Å; D344-F359 WeakPolarHBondContact OD2-CA 3.43Å; D344-N360 PolarHBondContact OD2-N 2.83Å
345	K	91.1	Very high	82	Confident	122 Å²	122	77.4 Å²	77.4	53%	0.53	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	142.1	175.4	67.5	178	177.4	-173.5	0	110.1	F264 T265 E342	F264-K345 WeakPolarHBondContact O-CA 3.37Å; T265-K345 HydrophobicContact CG2-CB 4.21Å; E342-K345 WeakPolarHBondContact OE1-CD 3.19Å
346	T	89.7	Confident	83.1	Confident	20 Å²	20	79 Å²	79	12%	0.123	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	134.2	-177	53.2	0	0	0	0	109.5	F264 V357 T358 F359	F264-T346 PolarHBondContact N-O 2.9Å; F264-T346 PolarHBondContact O-N 3.03Å; T346-V357 WeakPolarHBondContact OG1-CG1 3.49Å; T346-T358 WeakPolarHBondContact CG2-O 3.3Å; T346-F359 HydrophobicContact CG2-CD1 3.56Å; T346-F359 HydrophobicContact CG2-CE1 3.91Å; T346-F359 HydrophobicContact CG2-CG 4.23Å; T346-F359 WeakPolarHBondContact OG1-CE1 3.01Å
347	I	86.9	Confident	83.8	Confident	100 Å²	100	78.7 Å²	78.7	51%	0.513	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	124.4	179.8	-51.5	175.2	0	0	0	106.4	I263	I263-I347 HydrophobicContact CG1-CG1 4.32Å; I263-I347 HydrophobicContact CG1-CG2 4.44Å
348	L	84.5	Confident	84.3	Confident	15 Å²	15	75 Å²	75	8%	0.079	38%	0.383	C	S	.	.			trans	-77.7	141.4	-179.9	-66	-176.2	0	0	0	111.4	I258 N261 S262 F264 V357	I258-L348 HydrophobicContact CB-CD1 3.65Å; I258-L348 HydrophobicContact CD1-CD1 3.73Å; I258-L348 HydrophobicContact CG1-CD1 4.31Å; I258-L348 HydrophobicContact CG2-CD1 3.51Å; N261-L348 WeakPolarHBondContact CA-O 3.26Å; N261-L348 PolarHBondContact N-O 3.23Å; N261-L348 VanDerWaalsContact N-O 3.13Å; S262-L348 PolarHBondContact O-N 3.39Å; S262-L348 VanDerWaalsContact O-N 3.15Å; S262-L348 WeakPolarHBondContact OG-CD1 3.48Å; F264-L348 HydrophobicContact CE2-CD1 4.28Å; L348-V357 HydrophobicContact CD2-CG2 4.41Å
349	P	79.8	Confident	84.9	Confident	71 Å²	71	72.1 Å²	72.1	46%	0.461	37%	0.367	S	S	.	.			trans	-64.2	151.7	180	28.2	-35.2	0	0	0	112.1	N351	P349-N351 PolarHBondContact O-N 3.38Å
350	E	73.4	Confident	85.5	Confident	136 Å²	136	72.4 Å²	72.4	64%	0.636	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-29.3	-172.7	-65.6	179.9	171.3	0	0	114.4	P260 N261	P260-E350 WeakPolarHBondContact CB-O 3.24Å; P260-E350 WeakPolarHBondContact CG-O 3.46Å; N261-E350 HydrophobicContact CB-CG 4.47Å
351	N	73.3	Confident	86.1	Confident	135 Å²	135	64.2 Å²	64.2	72%	0.722	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-0.8	-166	-68.6	-10.2	0	0	0	115	P349	P349-N351 PolarHBondContact O-N 3.38Å
352	Y	72.1	Confident	86.4	Confident	165 Å²	165	60.6 Å²	60.6	65%	0.647	31%	0.31	S	S	*	.			trans	-135	127.8	-173.3	-58.2	-74.9	0	0	0	111.5	T354	Y352-T354 PolarHBondContact O-N 2.95Å
353	L	72.8	Confident	86.6	Confident	104 Å²	104	63.4 Å²	63.4	55%	0.545	33%	0.327	S	S	.	.			trans	-75.5	122	168	-62.8	169.2	0	0	0	108	E257 P260	E257-L353 HydrophobicContact CB-CB 4.49Å; E257-L353 WeakPolarHBondContact OE2-CD1 3.32Å; P260-L353 HydrophobicContact CG-CD2 4.15Å
354	T	80.1	Confident	86.8	Confident	42 Å²	42	64.3 Å²	64.3	26%	0.258	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	141.1	177.4	60.9	0	0	0	0	109.4	I258 Y352	I258-T354 WeakPolarHBondContact CB-O 3.05Å; I258-T354 WeakPolarHBondContact CD1-O 3.47Å; I258-T354 VanDerWaalsContact CG1-O 3.24Å; I258-T354 WeakPolarHBondContact CG1-O 3.47Å; I258-T354 PolarHBondContact N-O 3.46Å; Y352-T354 PolarHBondContact O-N 2.95Å
355	S	84.3	Confident	86.8	Confident	40 Å²	40	62.3 Å²	62.3	28%	0.28	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	11.9	172.3	53.6	0	0	0	0	112.9	I184 E253 T254	I184-S355 WeakPolarHBondContact CD1-OG 3.44Å; E253-S355 CarbonylContact C-O 3.5Å; E253-S355 WeakPolarHBondContact CA-O 3.49Å; E253-S355 WeakPolarHBondContact CG-O 3.49Å; T254-S355 PolarHBondContact N-O 2.96Å; T254-S355 VanDerWaalsContact OG1-CA 3.32Å; T254-S355 WeakPolarHBondContact OG1-CA 3.3Å; T254-S355 PolarHBondContact OG1-O 3.31Å; T254-S355 VanDerWaalsContact OG1-O 3.07Å
356	M	88.5	Confident	86.9	Confident	42 Å²	42	58 Å²	58	21%	0.207	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	131.5	-173.8	-179.7	172.4	163.8	0	0	111.4	I184 I185 H251 V252 T358	I184-M356 HydrophobicContact CB-SD 4.19Å; I184-M356 HydrophobicContact CD1-CB 4.39Å; I184-M356 HydrophobicContact CG2-SD 4.19Å; I185-M356 HydrophobicContact CB-CE 4.28Å; H251-M356 HydrophobicContact CB-CE 3.62Å; H251-M356 WeakPolarHBondContact ND1-CE 3.3Å; V252-M356 CarbonylContact O-C 3.55Å; V252-M356 WeakPolarHBondContact O-CA 3.2Å; M356-T358 HydrophobicContact CE-CG2 3.43Å; M356-T358 VanDerWaalsContact CE-CG2 3.43Å; M356-T358 HydrophobicContact CG-CG2 4.31Å
357	V	90.3	Very high	87	Confident	2 Å²	2	61.7 Å²	61.7	1%	0.012	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	137.3	176.5	-176.1	0	0	0	0	108.8	V252 I258 F264 T346 L348 F359	V252-V357 HydrophobicContact CB-CB 4.43Å; V252-V357 PolarHBondContact N-O 2.97Å; V252-V357 PolarHBondContact O-N 2.98Å; I258-V357 HydrophobicContact CD1-CG2 3.49Å; I258-V357 VanDerWaalsContact CD1-CG2 3.49Å; F264-V357 HydrophobicContact CB-CG1 4.1Å; F264-V357 HydrophobicContact CD1-CG2 4.46Å; F264-V357 HydrophobicContact CD2-CG1 4.21Å; F264-V357 HydrophobicContact CD2-CG2 3.83Å; F264-V357 HydrophobicContact CE1-CG2 4.39Å; F264-V357 HydrophobicContact CE2-CG2 3.8Å; F264-V357 HydrophobicContact CG-CG1 4.13Å; F264-V357 HydrophobicContact CG-CG2 4.19Å; F264-V357 HydrophobicContact CZ-CG2 4.08Å; T346-V357 WeakPolarHBondContact OG1-CG1 3.49Å; L348-V357 HydrophobicContact CD2-CG2 4.41Å; V357-F359 HydrophobicContact CG1-CD2 4.48Å; V357-F359 HydrophobicContact CG1-CE1 4.26Å; V357-F359 HydrophobicContact CG1-CE2 3.77Å; V357-F359 HydrophobicContact CG1-CZ 3.66Å
358	T	92.6	Very high	87.2	Confident	64 Å²	64	57.6 Å²	57.6	39%	0.393	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	121.4	-177.4	63.9	0	0	0	0	111.9	L250 H251 T346 M356	L250-T358 CarbonylContact O-C 3.58Å; L250-T358 VanDerWaalsContact O-CA 3.29Å; L250-T358 WeakPolarHBondContact O-CA 3.23Å; H251-T358 VanDerWaalsContact ND1-CG2 3.33Å; H251-T358 WeakPolarHBondContact ND1-CG2 3.28Å; T346-T358 WeakPolarHBondContact CG2-O 3.3Å; M356-T358 HydrophobicContact CE-CG2 3.43Å; M356-T358 VanDerWaalsContact CE-CG2 3.43Å; M356-T358 HydrophobicContact CG-CG2 4.31Å
359	F	95	Very high	87.5	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.009	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	142.8	175.9	-54.3	-85.8	0	0	0	111.5	T249 L250 V252 F264 C266 D344 T346 V357 I361 I387	T249-F359 CarbonylContact C-O 3.56Å; T249-F359 VanDerWaalsContact CA-O 3.3Å; T249-F359 WeakPolarHBondContact CA-O 3.18Å; L250-F359 HydrophobicContact CB-CB 4.21Å; L250-F359 HydrophobicContact CB-CD2 4.46Å; L250-F359 HydrophobicContact CD2-CD2 4.07Å; L250-F359 HydrophobicContact CG-CD2 4.29Å; L250-F359 PolarHBondContact N-O 3.3Å; L250-F359 PolarHBondContact O-N 2.94Å; V252-F359 HydrophobicContact CG2-CD2 3.99Å; V252-F359 HydrophobicContact CG2-CE2 3.76Å; F264-F359 HydrophobicContact CB-CE1 3.94Å; F264-F359 HydrophobicContact CB-CZ 3.57Å; C266-F359 HydrophobicContact CB-CD1 3.71Å; C266-F359 HydrophobicContact CB-CD2 4.41Å; C266-F359 HydrophobicContact CB-CE1 3.9Å; C266-F359 HydrophobicContact CB-CG 3.97Å; C266-F359 HydrophobicContact CB-CZ 4.32Å; D344-F359 HydrophobicContact CB-CB 4.22Å; D344-F359 HydrophobicContact CB-CD1 4.28Å; D344-F359 WeakPolarHBondContact OD2-CA 3.43Å; T346-F359 HydrophobicContact CG2-CD1 3.56Å; T346-F359 HydrophobicContact CG2-CE1 3.91Å; T346-F359 HydrophobicContact CG2-CG 4.23Å; T346-F359 WeakPolarHBondContact OG1-CE1 3.01Å; V357-F359 HydrophobicContact CG1-CD2 4.48Å; V357-F359 HydrophobicContact CG1-CE1 4.26Å; V357-F359 HydrophobicContact CG1-CE2 3.77Å; V357-F359 HydrophobicContact CG1-CZ 3.66Å; F359-I361 HydrophobicContact CB-CD1 4.44Å; F359-I361 HydrophobicContact CB-CG1 4.23Å; F359-I387 HydrophobicContact CE2-CG1 4.43Å; F359-I387 HydrophobicContact CE2-CG2 4.12Å; F359-I387 HydrophobicContact CZ-CG2 4.01Å
360	N	95.5	Very high	88	Confident	67 Å²	67	59.2 Å²	59.2	36%	0.358	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	106.7	173.8	-176.2	-1.6	0	0	0	110.6	V248 D344 T362	V248-N360 PolarHBondContact O-OD1 2.94Å; D344-N360 PolarHBondContact OD2-N 2.83Å; N360-T362 WeakPolarHBondContact OD1-CB 3.24Å; N360-T362 WeakPolarHBondContact OD1-CG2 3.31Å; N360-T362 PolarHBondContact OD1-N 2.71Å; N360-T362 PolarHBondContact OD1-OG1 3.43Å
361	I	95.3	Very high	88.7	Confident	1 Å²	1	58.3 Å²	58.3	1%	0.005	29%	0.289	C	S	.	.			trans	-107.1	12.6	-175.2	-50.8	-171.9	0	0	0	111	V248 L250 I343 F359 N363 R364 M365 W368 M407	V248-I361 HydrophobicContact CG1-CB 4.39Å; V248-I361 PolarHBondContact O-N 3.28Å; L250-I361 HydrophobicContact CB-CD1 3.56Å; L250-I361 HydrophobicContact CB-CG1 4.19Å; L250-I361 HydrophobicContact CD2-CD1 3.6Å; L250-I361 HydrophobicContact CG-CD1 4.19Å; I343-I361 HydrophobicContact CG2-CB 4.15Å; I343-I361 HydrophobicContact CG2-CD1 4.12Å; I343-I361 HydrophobicContact CG2-CG1 3.78Å; I343-I361 HydrophobicContact CG2-CG2 3.72Å; F359-I361 HydrophobicContact CB-CD1 4.44Å; F359-I361 HydrophobicContact CB-CG1 4.23Å; I361-N363 PolarHBondContact O-N 2.85Å; I361-R364 HydrophobicContact CG2-CB 3.93Å; I361-R364 HydrophobicContact CG2-CG 4.27Å; I361-R364 PolarHBondContact O-N 3.27Å; I361-M365 HydrophobicContact CG2-CB 4.47Å; I361-M365 VanDerWaalsContact O-CB 3.3Å; I361-M365 WeakPolarHBondContact O-CB 3.49Å; I361-M365 PolarHBondContact O-N 2.79Å; I361-W368 HydrophobicContact CG2-CH2 4.41Å; I361-W368 HydrophobicContact CG2-CZ3 4.19Å; I361-M407 HydrophobicContact CD1-CE 4.39Å
362	T	95.3	Very high	89.2	Confident	19 Å²	19	52.9 Å²	52.9	12%	0.117	26%	0.261	C	S	.	.	H	α-helix	trans	-45.6	-63.8	-176.5	42.4	0	0	0	0	114.7	R247 V248 N360 R364 M365 I366	R247-T362 VanDerWaalsContact CA-CG2 3.48Å; R247-T362 HydrophobicContact CB-CG2 4.31Å; R247-T362 HydrophobicContact CG-CG2 4.14Å; V248-T362 HydrophobicContact CB-CG2 4.17Å; V248-T362 HydrophobicContact CG2-CG2 4.48Å; N360-T362 WeakPolarHBondContact OD1-CB 3.24Å; N360-T362 WeakPolarHBondContact OD1-CG2 3.31Å; N360-T362 PolarHBondContact OD1-N 2.71Å; N360-T362 PolarHBondContact OD1-OG1 3.43Å; T362-R364 VanDerWaalsContact C-N 3.33Å; T362-R364 PolarHBondContact O-N 3.26Å; T362-M365 PolarHBondContact O-N 3.01Å; T362-I366 VanDerWaalsContact O-CG1 3.31Å; T362-I366 WeakPolarHBondContact O-CG1 3.31Å; T362-I366 PolarHBondContact O-N 3.01Å
363	N	94.1	Very high	89.8	Confident	120 Å²	120	52.4 Å²	52.4	64%	0.642	26%	0.258	S	S	*	.	H	α-helix	trans	-63.8	-41.1	-174.8	-68.7	-19.1	0	0	0	111.3	I361 N367	I361-N363 PolarHBondContact O-N 2.85Å; N363-N367 WeakPolarHBondContact O-CB 3.4Å; N363-N367 VanDerWaalsContact O-CG 3.25Å; N363-N367 PolarHBondContact O-N 3.2Å; N363-N367 VanDerWaalsContact O-N 3.08Å; N363-N367 PolarHBondContact O-ND2 3.14Å
364	R	93.8	Very high	90.3	Very high	41 Å²	41	53.3 Å²	53.3	16%	0.155	26%	0.263	C	S	.	.	H	α-helix	trans	-63.2	-45.9	178	-176.6	66.9	69.8	141	1.9	111.3	E268 P341 E342 I343 I361 T362 N367 W368	E268-R364 IonicContact OE2-CZ 3.69Å; E268-R364 IonicContact OE2-NH1 2.71Å; E268-R364 PolarHBondContact OE2-NH1 2.8Å; P341-R364 PolarHBondContact O-NH2 2.81Å; E342-R364 PolarHBondContact O-NH2 3.18Å; I343-R364 HydrophobicContact CG1-CG 4.27Å; I343-R364 HydrophobicContact CG2-CB 4.06Å; I343-R364 HydrophobicContact CG2-CG 4.12Å; I361-R364 HydrophobicContact CG2-CB 3.93Å; I361-R364 HydrophobicContact CG2-CG 4.27Å; I361-R364 PolarHBondContact O-N 3.27Å; T362-R364 VanDerWaalsContact C-N 3.33Å; T362-R364 PolarHBondContact O-N 3.26Å; R364-N367 PolarHBondContact O-N 2.78Å; R364-W368 HydrophobicContact CG-CD2 4.01Å; R364-W368 HydrophobicContact CG-CE3 4.36Å; R364-W368 HydrophobicContact CG-CH2 3.83Å; R364-W368 HydrophobicContact CG-CZ2 3.41Å; R364-W368 VanDerWaalsContact CG-CZ2 3.41Å; R364-W368 HydrophobicContact CG-CZ3 4.28Å; R364-W368 PolarHBondContact O-N 3.28Å
365	M	94	Very high	90.5	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-64.3	-44.2	179.4	-173.7	61.6	-178.9	0	0	112.1	L234 V236 V248 I361 T362 N367 W368 L369 F381 I409	L234-M365 HydrophobicContact CD2-CE 4.48Å; L234-M365 HydrophobicContact CD2-SD 4.06Å; V236-M365 HydrophobicContact CG2-CE 4.15Å; V248-M365 HydrophobicContact CB-CB 4.42Å; V248-M365 HydrophobicContact CG1-CB 4.21Å; V248-M365 HydrophobicContact CG1-CG 4.28Å; V248-M365 HydrophobicContact CG2-CB 4.12Å; V248-M365 HydrophobicContact CG2-CG 4.14Å; I361-M365 HydrophobicContact CG2-CB 4.47Å; I361-M365 VanDerWaalsContact O-CB 3.3Å; I361-M365 WeakPolarHBondContact O-CB 3.49Å; I361-M365 PolarHBondContact O-N 2.79Å; T362-M365 PolarHBondContact O-N 3.01Å; M365-N367 VanDerWaalsContact C-N 3.29Å; M365-N367 PolarHBondContact O-N 2.9Å; M365-W368 PolarHBondContact O-N 3.42Å; M365-W368 HydrophobicContact SD-CE3 3.77Å; M365-W368 HydrophobicContact SD-CZ3 4.32Å; M365-L369 HydrophobicContact CE-CD1 4.03Å; M365-L369 HydrophobicContact CE-CD2 4.02Å; M365-L369 HydrophobicContact CE-CG 3.99Å; M365-L369 HydrophobicContact CG-CD1 4.26Å; M365-L369 WeakPolarHBondContact O-CG 3.5Å; M365-L369 PolarHBondContact O-N 2.89Å; M365-F381 HydrophobicContact CE-CE1 3.9Å; M365-F381 HydrophobicContact CE-CZ 3.9Å; M365-F381 HydrophobicContact SD-CE1 4.19Å; M365-F381 HydrophobicContact SD-CZ 3.84Å; M365-I409 HydrophobicContact CE-CD1 4.3Å
366	I	93.2	Very high	90.2	Very high	31 Å²	31	56.9 Å²	56.9	16%	0.159	28%	0.275	C	S	.	.	H	α-helix	trans	-59.4	-42.7	176.4	-69.5	166.8	0	0	0	110.6	P242 I245 T362 L369 K370	P242-I366 HydrophobicContact CB-CG2 4.32Å; I245-I366 HydrophobicContact CB-CD1 4.5Å; I245-I366 HydrophobicContact CB-CG1 4.3Å; I245-I366 HydrophobicContact CD1-CG1 4.33Å; I245-I366 HydrophobicContact CG2-CD1 4.43Å; I245-I366 HydrophobicContact CG2-CG1 4.32Å; T362-I366 VanDerWaalsContact O-CG1 3.31Å; T362-I366 WeakPolarHBondContact O-CG1 3.31Å; T362-I366 PolarHBondContact O-N 3.01Å; I366-L369 PolarHBondContact O-N 3.04Å; I366-K370 HydrophobicContact CG2-CD 4.03Å; I366-K370 HydrophobicContact CG2-CG 4.48Å; I366-K370 WeakPolarHBondContact O-CB 3.3Å; I366-K370 VanDerWaalsContact O-CG 3.31Å; I366-K370 WeakPolarHBondContact O-CG 3.5Å; I366-K370 PolarHBondContact O-N 2.88Å
367	N	92.3	Very high	89.5	Confident	99 Å²	99	58.3 Å²	58.3	53%	0.529	29%	0.288	S	S	.	.	H	α-helix	trans	-65.5	-43.4	177.2	-71.3	-11.2	0	0	0	111.9	N363 R364 M365 L369 K370 Y371	N363-N367 WeakPolarHBondContact O-CB 3.4Å; N363-N367 VanDerWaalsContact O-CG 3.25Å; N363-N367 PolarHBondContact O-N 3.2Å; N363-N367 VanDerWaalsContact O-N 3.08Å; N363-N367 PolarHBondContact O-ND2 3.14Å; R364-N367 PolarHBondContact O-N 2.78Å; M365-N367 VanDerWaalsContact C-N 3.29Å; M365-N367 PolarHBondContact O-N 2.9Å; N367-L369 PolarHBondContact O-N 3.06Å; N367-K370 PolarHBondContact O-N 2.86Å; N367-Y371 VanDerWaalsContact O-CB 3.31Å; N367-Y371 WeakPolarHBondContact O-CB 3.13Å; N367-Y371 PolarHBondContact O-N 3.3Å
368	W	91.2	Very high	88.8	Confident	14 Å²	14	68.9 Å²	68.9	5%	0.053	33%	0.329	C	S	.	.	H	α-helix	trans	-60	-44.1	175.7	-69.1	-27.6	0	0	0	112.3	L234 E268 I343 I361 R364 M365 Y371 N372 F381 R383 I385	L234-W368 HydrophobicContact CD2-CE3 4.28Å; L234-W368 HydrophobicContact CD2-CZ3 3.84Å; E268-W368 HydrophobicContact CB-CZ2 4.2Å; E268-W368 VanDerWaalsContact CD-CZ2 3.41Å; E268-W368 HydrophobicContact CG-CZ2 3.79Å; E268-W368 PolarHBondContact OE1-NE1 3.37Å; E268-W368 WeakPolarHBondContact OE2-CZ2 3.45Å; E268-W368 PolarHBondContact OE2-NE1 3.28Å; I343-W368 HydrophobicContact CD1-CH2 3.94Å; I343-W368 HydrophobicContact CD1-CZ2 4.13Å; I361-W368 HydrophobicContact CG2-CH2 4.41Å; I361-W368 HydrophobicContact CG2-CZ3 4.19Å; R364-W368 HydrophobicContact CG-CD2 4.01Å; R364-W368 HydrophobicContact CG-CE3 4.36Å; R364-W368 HydrophobicContact CG-CH2 3.83Å; R364-W368 HydrophobicContact CG-CZ2 3.41Å; R364-W368 VanDerWaalsContact CG-CZ2 3.41Å; R364-W368 HydrophobicContact CG-CZ3 4.28Å; R364-W368 PolarHBondContact O-N 3.28Å; M365-W368 PolarHBondContact O-N 3.42Å; M365-W368 HydrophobicContact SD-CE3 3.77Å; M365-W368 HydrophobicContact SD-CZ3 4.32Å; W368-Y371 PolarHBondContact O-N 2.98Å; W368-N372 WeakPolarHBondContact O-CB 3.37Å; W368-N372 PolarHBondContact O-N 3.45Å; W368-F381 HydrophobicContact CB-CE2 3.61Å; W368-F381 HydrophobicContact CB-CZ 3.69Å; W368-F381 HydrophobicContact CD2-CZ 4.44Å; W368-F381 HydrophobicContact CE3-CZ 4.03Å; W368-F381 HydrophobicContact CG-CZ 4.39Å; W368-R383 HydrophobicContact CD2-CG 4.02Å; W368-R383 HydrophobicContact CE3-CG 4.13Å; W368-R383 HydrophobicContact CG-CG 4.44Å; W368-R383 HydrophobicContact CH2-CB 4.45Å; W368-R383 HydrophobicContact CZ3-CB 4.45Å; W368-R383 HydrophobicContact CZ3-CG 4.44Å; W368-I385 HydrophobicContact CH2-CD1 4.09Å; W368-I385 HydrophobicContact CH2-CG1 4.16Å; W368-I385 HydrophobicContact CZ3-CD1 4.35Å
369	L	90.7	Very high	88.1	Confident	15 Å²	15	71.7 Å²	71.7	8%	0.079	34%	0.336	C	S	.	.	H	α-helix	trans	-66.3	-44.4	179.1	-72	174.2	0	0	0	112	I240 P242 I245 M365 I366 N367 Y371 N372 R373 F381	I240-L369 HydrophobicContact CB-CD1 4.14Å; I240-L369 HydrophobicContact CB-CD2 4.32Å; I240-L369 HydrophobicContact CG2-CD1 3.92Å; P242-L369 HydrophobicContact CB-CB 3.99Å; P242-L369 HydrophobicContact CB-CD1 4.33Å; P242-L369 HydrophobicContact CG-CB 4.31Å; I245-L369 HydrophobicContact CD1-CD1 3.37Å; M365-L369 HydrophobicContact CE-CD1 4.03Å; M365-L369 HydrophobicContact CE-CD2 4.02Å; M365-L369 HydrophobicContact CE-CG 3.99Å; M365-L369 HydrophobicContact CG-CD1 4.26Å; M365-L369 WeakPolarHBondContact O-CG 3.5Å; M365-L369 PolarHBondContact O-N 2.89Å; I366-L369 PolarHBondContact O-N 3.04Å; N367-L369 PolarHBondContact O-N 3.06Å; L369-Y371 PolarHBondContact O-N 3.36Å; L369-N372 PolarHBondContact O-N 2.93Å; L369-R373 WeakPolarHBondContact O-CB 3.16Å; L369-R373 PolarHBondContact O-N 3.2Å; L369-F381 HydrophobicContact CD2-CD2 4.2Å; L369-F381 HydrophobicContact CD2-CE2 4Å; L369-F381 HydrophobicContact CD2-CZ 4.43Å; L369-F381 HydrophobicContact CG-CE2 4.46Å
370	K	90.1	Very high	87.3	Confident	105 Å²	105	75.7 Å²	75.7	46%	0.457	36%	0.362	S	S	.	.	H	α-helix	trans	-60.5	-44.7	174.8	-74.9	176.4	179.6	177.6	0	111.8	P242 I366 N367 R373 N374	P242-K370 HydrophobicContact CB-CG 4.18Å; P242-K370 HydrophobicContact CG-CG 3.98Å; I366-K370 HydrophobicContact CG2-CD 4.03Å; I366-K370 HydrophobicContact CG2-CG 4.48Å; I366-K370 WeakPolarHBondContact O-CB 3.3Å; I366-K370 VanDerWaalsContact O-CG 3.31Å; I366-K370 WeakPolarHBondContact O-CG 3.5Å; I366-K370 PolarHBondContact O-N 2.88Å; N367-K370 PolarHBondContact O-N 2.86Å; K370-R373 PolarHBondContact O-N 3.39Å; K370-N374 PolarHBondContact O-N 3.5Å; K370-N374 VanDerWaalsContact O-N 3.11Å
371	Y	87.6	Confident	86.8	Confident	116 Å²	116	73 Å²	73	46%	0.455	35%	0.347	S	S	.	.	H	α-helix	trans	-60.7	-45.9	176.9	-180	-86.6	0	0	0	111.5	N367 W368 L369 N374 N375	N367-Y371 VanDerWaalsContact O-CB 3.31Å; N367-Y371 WeakPolarHBondContact O-CB 3.13Å; N367-Y371 PolarHBondContact O-N 3.3Å; W368-Y371 PolarHBondContact O-N 2.98Å; L369-Y371 PolarHBondContact O-N 3.36Å; Y371-N374 PolarHBondContact O-N 2.96Å; Y371-N375 WeakPolarHBondContact CD2-ND2 3.11Å; Y371-N375 HydrophobicContact CE1-CB 4.28Å; Y371-N375 HydrophobicContact CE2-CB 4.47Å; Y371-N375 WeakPolarHBondContact CE2-ND2 3.38Å; Y371-N375 WeakPolarHBondContact O-CB 3.37Å; Y371-N375 PolarHBondContact O-N 2.96Å
372	N	85.6	Confident	86.4	Confident	22 Å²	22	75.6 Å²	75.6	12%	0.118	36%	0.36	C	S	.	.	H	α-helix	trans	-63.7	-44.1	-180	-159.9	57	0	0	0	111.7	W368 L369 N374 Q376 F381	W368-N372 WeakPolarHBondContact O-CB 3.37Å; W368-N372 PolarHBondContact O-N 3.45Å; L369-N372 PolarHBondContact O-N 2.93Å; N372-N374 VanDerWaalsContact C-N 3.31Å; N372-N374 PolarHBondContact O-N 3.39Å; N372-Q376 CarbonylContact O-C 3.55Å; N372-Q376 WeakPolarHBondContact O-CA 3.5Å; N372-Q376 PolarHBondContact O-N 3.14Å; N372-Q376 PolarHBondContact OD1-O 2.99Å; N372-F381 HydrophobicContact CB-CD2 4.15Å
373	R	84.2	Confident	86.2	Confident	155 Å²	155	76.7 Å²	76.7	59%	0.585	36%	0.362	S	S	*	.	H	α-helix	trans	-59.1	-40.5	178.1	-173.2	176.8	-179.3	170.9	2.5	112.5	D241 L369 K370	D241-R373 IonicContact OD1-NH1 2.71Å; D241-R373 PolarHBondContact OD1-NH1 3.4Å; L369-R373 WeakPolarHBondContact O-CB 3.16Å; L369-R373 PolarHBondContact O-N 3.2Å; K370-R373 PolarHBondContact O-N 3.39Å
374	N	84	Confident	86.1	Confident	123 Å²	123	73.1 Å²	73.1	66%	0.658	34%	0.34	S	S	*	.	H	α-helix	trans	-84.2	-39.8	-175.9	-67.2	-3.2	0	0	0	113.1	K370 Y371 N372	K370-N374 PolarHBondContact O-N 3.5Å; K370-N374 VanDerWaalsContact O-N 3.11Å; Y371-N374 PolarHBondContact O-N 2.96Å; N372-N374 VanDerWaalsContact C-N 3.31Å; N372-N374 PolarHBondContact O-N 3.39Å
375	N	83	Confident	86	Confident	95 Å²	95	71.2 Å²	71.2	51%	0.508	33%	0.333	S	S	.	.	H	α-helix	trans	-107.9	-25.9	-167.2	-62.7	-19.3	0	0	0	113.8	Y371	Y371-N375 WeakPolarHBondContact CD2-ND2 3.11Å; Y371-N375 HydrophobicContact CE1-CB 4.28Å; Y371-N375 HydrophobicContact CE2-CB 4.47Å; Y371-N375 WeakPolarHBondContact CE2-ND2 3.38Å; Y371-N375 WeakPolarHBondContact O-CB 3.37Å; Y371-N375 PolarHBondContact O-N 2.96Å
376	Q	79.1	Confident	85.8	Confident	61 Å²	61	71.9 Å²	71.9	29%	0.285	34%	0.336	S	S	.	.			trans	-144.9	53	-172.5	-62.8	-172.5	-16.7	0	0	113.4	N372 Y378 K379	N372-Q376 CarbonylContact O-C 3.55Å; N372-Q376 WeakPolarHBondContact O-CA 3.5Å; N372-Q376 PolarHBondContact O-N 3.14Å; N372-Q376 PolarHBondContact OD1-O 2.99Å; Q376-Y378 PolarHBondContact O-N 3.36Å; Q376-Y378 VanDerWaalsContact O-N 3.14Å; Q376-K379 HydrophobicContact CB-CB 4.19Å; Q376-K379 HydrophobicContact CB-CD 4.29Å; Q376-K379 HydrophobicContact CB-CG 4.36Å; Q376-K379 HydrophobicContact CG-CD 4.27Å; Q376-K379 PolarHBondContact O-N 3.28Å; Q376-K379 VanDerWaalsContact O-N 3.11Å
377	P	73.5	Confident	85.7	Confident	72 Å²	72	70.4 Å²	70.4	47%	0.468	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-29.1	-173	25.2	-35	0	0	0	113.7
378	Y	75	Confident	85.3	Confident	225 Å²	225	67.6 Å²	67.6	88%	0.882	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-6.4	-178.5	-52.8	-68.2	0	0	0	114.3	Q376	Q376-Y378 PolarHBondContact O-N 3.36Å; Q376-Y378 VanDerWaalsContact O-N 3.14Å
379	K	77.3	Confident	85	Confident	123 Å²	123	67.8 Å²	67.8	54%	0.535	32%	0.317	S	S	.	.	S	Bend	trans	-95	142.8	-179.2	-66.4	-171.9	-177.6	176.9	0	110.6	Q376 F381	Q376-K379 HydrophobicContact CB-CB 4.19Å; Q376-K379 HydrophobicContact CB-CD 4.29Å; Q376-K379 HydrophobicContact CB-CG 4.36Å; Q376-K379 HydrophobicContact CG-CD 4.27Å; Q376-K379 PolarHBondContact O-N 3.28Å; Q376-K379 VanDerWaalsContact O-N 3.11Å; K379-F381 PolarHBondContact O-N 2.85Å
380	P	77.8	Confident	84.5	Confident	85 Å²	85	70.2 Å²	70.2	55%	0.552	33%	0.33	S	S	*	.			trans	-63.9	137.5	177.1	27.6	-34.6	0	0	0	110.4	I382	P380-I382 HydrophobicContact CB-CD1 4.23Å; P380-I382 HydrophobicContact CB-CG1 4.26Å; P380-I382 HydrophobicContact CG-CD1 4.02Å; P380-I382 HydrophobicContact CG-CG1 4.46Å; P380-I382 PolarHBondContact O-N 3.38Å
381	F	85.5	Confident	83.8	Confident	12 Å²	12	69.6 Å²	69.6	5%	0.053	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	103.9	174.6	-175.6	-87.3	0	0	0	109.8	L234 K235 V236 M365 W368 L369 N372 K379 R383	L234-F381 HydrophobicContact CD2-CE1 3.78Å; L234-F381 HydrophobicContact CD2-CZ 4.48Å; L234-F381 HydrophobicContact CG-CE1 4.05Å; K235-F381 WeakPolarHBondContact CA-O 2.79Å; V236-F381 HydrophobicContact CB-CB 4.36Å; V236-F381 HydrophobicContact CB-CD1 3.94Å; V236-F381 HydrophobicContact CB-CG 4.45Å; V236-F381 HydrophobicContact CG2-CD1 3.51Å; V236-F381 HydrophobicContact CG2-CE1 3.87Å; V236-F381 HydrophobicContact CG2-CG 4.42Å; V236-F381 PolarHBondContact N-O 3.38Å; M365-F381 HydrophobicContact CE-CE1 3.9Å; M365-F381 HydrophobicContact CE-CZ 3.9Å; M365-F381 HydrophobicContact SD-CE1 4.19Å; M365-F381 HydrophobicContact SD-CZ 3.84Å; W368-F381 HydrophobicContact CB-CE2 3.61Å; W368-F381 HydrophobicContact CB-CZ 3.69Å; W368-F381 HydrophobicContact CD2-CZ 4.44Å; W368-F381 HydrophobicContact CE3-CZ 4.03Å; W368-F381 HydrophobicContact CG-CZ 4.39Å; L369-F381 HydrophobicContact CD2-CD2 4.2Å; L369-F381 HydrophobicContact CD2-CE2 4Å; L369-F381 HydrophobicContact CD2-CZ 4.43Å; L369-F381 HydrophobicContact CG-CE2 4.46Å; N372-F381 HydrophobicContact CB-CD2 4.15Å; K379-F381 PolarHBondContact O-N 2.85Å; F381-R383 HydrophobicContact CE1-CG 4.15Å; F381-R383 HydrophobicContact CZ-CG 4.03Å
382	I	87.8	Confident	83.1	Confident	54 Å²	54	65.2 Å²	65.2	28%	0.277	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	126.8	178	-58.2	175.2	0	0	0	109	I233 L234 K235 P380 Y384	I233-I382 HydrophobicContact CG2-CG2 3.78Å; L234-I382 CarbonylContact O-C 3.57Å; L234-I382 VanDerWaalsContact O-CA 3.31Å; L234-I382 WeakPolarHBondContact O-CA 3.43Å; K235-I382 HydrophobicContact CG-CG1 4.34Å; P380-I382 HydrophobicContact CB-CD1 4.23Å; P380-I382 HydrophobicContact CB-CG1 4.26Å; P380-I382 HydrophobicContact CG-CD1 4.02Å; P380-I382 HydrophobicContact CG-CG1 4.46Å; P380-I382 PolarHBondContact O-N 3.38Å; I382-Y384 HydrophobicContact CG2-CE2 4.09Å
383	R	91.2	Very high	82.3	Confident	42 Å²	42	67.5 Å²	67.5	16%	0.158	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	152.9	174.2	-65	-65.4	178.1	-101.7	3.1	110.6	L234 W368 F381	L234-R383 HydrophobicContact CB-CB 4.32Å; L234-R383 PolarHBondContact N-O 2.9Å; L234-R383 PolarHBondContact O-N 3.48Å; W368-R383 HydrophobicContact CD2-CG 4.02Å; W368-R383 HydrophobicContact CE3-CG 4.13Å; W368-R383 HydrophobicContact CG-CG 4.44Å; W368-R383 HydrophobicContact CH2-CB 4.45Å; W368-R383 HydrophobicContact CZ3-CB 4.45Å; W368-R383 HydrophobicContact CZ3-CG 4.44Å; F381-R383 HydrophobicContact CE1-CG 4.15Å; F381-R383 HydrophobicContact CZ-CG 4.03Å
384	Y	91.2	Very high	80.8	Confident	46 Å²	46	66 Å²	66	18%	0.18	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	125.2	178.6	-56.2	-95.5	0	0	0	108.9	Y220 F232 I233 I269 P271 I382	Y220-Y384 HydrophobicContact CD1-CD1 4.41Å; Y220-Y384 HydrophobicContact CD1-CE1 4.48Å; Y220-Y384 HydrophobicContact CD2-CE1 4.12Å; Y220-Y384 HydrophobicContact CE2-CE1 4.26Å; Y220-Y384 HydrophobicContact CG-CD1 4.3Å; Y220-Y384 HydrophobicContact CG-CE1 4.23Å; F232-Y384 WeakPolarHBondContact O-CA 3.47Å; I233-Y384 HydrophobicContact CD1-CE1 4.24Å; I233-Y384 HydrophobicContact CG1-CD1 4.04Å; I233-Y384 HydrophobicContact CG1-CE1 3.96Å; I233-Y384 HydrophobicContact CG2-CE1 4.35Å; I269-Y384 PolarHBondContact N-O 2.94Å; I269-Y384 WeakPolarHBondContact O-CB 3.31Å; P271-Y384 VanDerWaalsContact CD-CE2 3.46Å; P271-Y384 HydrophobicContact CG-CD2 4.04Å; P271-Y384 HydrophobicContact CG-CE1 4.41Å; P271-Y384 HydrophobicContact CG-CE2 3.6Å; I382-Y384 HydrophobicContact CG2-CE2 4.09Å
385	I	92.1	Very high	79.3	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	133.1	-176.5	-62.3	173.6	0	0	0	107.7	I231 F232 L234 L250 C266 W267 I343 W368 I387 M407	I231-I385 CarbonylContact C-O 3.49Å; I231-I385 VanDerWaalsContact CA-O 3.31Å; I231-I385 WeakPolarHBondContact CA-O 3.38Å; F232-I385 PolarHBondContact N-O 2.95Å; F232-I385 PolarHBondContact O-N 3.18Å; L234-I385 HydrophobicContact CB-CD1 4.39Å; L234-I385 HydrophobicContact CD2-CD1 4.41Å; L250-I385 HydrophobicContact CD2-CG2 4.4Å; C266-I385 WeakPolarHBondContact SG-CG2 3.43Å; W267-I385 CarbonylContact O-C 3.6Å; W267-I385 WeakPolarHBondContact O-CA 3.28Å; I343-I385 HydrophobicContact CD1-CG1 4.42Å; I343-I385 HydrophobicContact CD1-CG2 4.46Å; W368-I385 HydrophobicContact CH2-CD1 4.09Å; W368-I385 HydrophobicContact CH2-CG1 4.16Å; W368-I385 HydrophobicContact CZ3-CD1 4.35Å; I385-I387 HydrophobicContact CG2-CG1 4.49Å; I385-M407 HydrophobicContact CD1-CE 4.09Å
386	M	89.9	Confident	78	Confident	14 Å²	14	70 Å²	70	7%	0.069	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	129.1	175.8	-174.9	176.6	58.4	0	0	109.7	N230 I231 W267 I269 M332 L338 I388	N230-M386 CarbonylContact O-C 3.55Å; N230-M386 VanDerWaalsContact O-CA 3.3Å; N230-M386 WeakPolarHBondContact O-CA 3.46Å; I231-M386 HydrophobicContact CG1-CB 4.41Å; I231-M386 HydrophobicContact CG1-CG 4.15Å; W267-M386 HydrophobicContact CB-CB 4.44Å; W267-M386 HydrophobicContact CB-CE 4.24Å; W267-M386 PolarHBondContact N-O 3.36Å; W267-M386 PolarHBondContact O-N 3.45Å; I269-M386 HydrophobicContact CD1-CB 4.23Å; I269-M386 HydrophobicContact CG2-CB 3.94Å; I269-M386 HydrophobicContact CG2-CE 3.86Å; I269-M386 HydrophobicContact CG2-SD 4.4Å; M332-M386 HydrophobicContact CE-SD 3.49Å; M332-M386 WeakPolarHBondContact CE-SD 3.43Å; L338-M386 HydrophobicContact CD1-CE 3.83Å; M386-I388 HydrophobicContact CE-CD1 3.51Å; M386-I388 HydrophobicContact CE-CG1 4.22Å; M386-I388 HydrophobicContact CG-CD1 4.46Å; M386-I388 HydrophobicContact CG-CG1 4.14Å; M386-I388 HydrophobicContact SD-CD1 4.17Å; M386-I388 HydrophobicContact SD-CG1 4.38Å
387	I	90.1	Very high	76.8	Confident	1 Å²	1	71.8 Å²	71.8	1%	0.005	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127	177.4	-59.7	157.2	0	0	0	108.5	N230 F232 L250 V252 F264 F359 I385 I400	N230-I387 WeakPolarHBondContact CB-O 3.29Å; N230-I387 PolarHBondContact ND2-O 3.43Å; N230-I387 PolarHBondContact O-N 3.07Å; F232-I387 HydrophobicContact CD2-CD1 3.88Å; F232-I387 HydrophobicContact CE2-CD1 3.83Å; L250-I387 HydrophobicContact CD2-CD1 4.29Å; V252-I387 HydrophobicContact CG1-CD1 4.09Å; V252-I387 HydrophobicContact CG2-CD1 3.65Å; F264-I387 HydrophobicContact CD1-CG2 4.16Å; F359-I387 HydrophobicContact CE2-CG1 4.43Å; F359-I387 HydrophobicContact CE2-CG2 4.12Å; F359-I387 HydrophobicContact CZ-CG2 4.01Å; I385-I387 HydrophobicContact CG2-CG1 4.49Å; I387-I400 HydrophobicContact CB-CD1 3.92Å; I387-I400 HydrophobicContact CG2-CD1 3.56Å
388	I	85.5	Confident	76.3	Confident	39 Å²	39	71.3 Å²	71.3	20%	0.2	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	137.6	-179.7	-59.5	170.4	0	0	0	108.5	F264 T265 F324 M386	F264-I388 CarbonylContact C-O 3.57Å; F264-I388 VanDerWaalsContact CA-O 3.27Å; F264-I388 WeakPolarHBondContact CA-O 3.38Å; T265-I388 PolarHBondContact N-O 3.39Å; T265-I388 PolarHBondContact O-N 3.3Å; F324-I388 HydrophobicContact CE1-CD1 4.43Å; F324-I388 HydrophobicContact CZ-CD1 4.39Å; M386-I388 HydrophobicContact CE-CD1 3.51Å; M386-I388 HydrophobicContact CE-CG1 4.22Å; M386-I388 HydrophobicContact CG-CD1 4.46Å; M386-I388 HydrophobicContact CG-CG1 4.14Å; M386-I388 HydrophobicContact SD-CD1 4.17Å; M386-I388 HydrophobicContact SD-CG1 4.38Å
389	C	84.7	Confident	76.4	Confident	19 Å²	19	61.6 Å²	61.6	13%	0.128	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	123.2	163.6	-176.6	0	0	0	0	109.1	F264 C392	F264-C389 HydrophobicContact CD1-CB 3.84Å; F264-C389 HydrophobicContact CE1-CB 3.6Å; F264-C389 HydrophobicContact CG-CB 4.46Å; F264-C389 HydrophobicContact CZ-CB 3.98Å; C389-C392 HydrophobicContact CB-CB 3.7Å; C389-C392 WeakPolarHBondContact CB-SG 3.36Å; C389-C392 WeakPolarHBondContact SG-CB 3.1Å; C389-C392 PolarHBondContact SG-N 2.79Å; C389-C392 VanDerWaalsContact SG-N 3.37Å; C389-C392 CovalentContact SG-SG 2.02Å; C389-C392 PolarHBondContact SG-SG 2.83Å
390	N	78.9	Confident	76.8	Confident	66 Å²	66	56.1 Å²	56.1	35%	0.353	28%	0.282	S	S	.	.	S	Bend	trans	-85.3	-27.3	-175.9	-67.9	20.1	0	0	0	112.6	I263 T265	I263-N390 PolarHBondContact O-N 3.39Å; T265-N390 PolarHBondContact OG1-OD1 3Å
391	N	76.4	Confident	77.2	Confident	91 Å²	91	53.2 Å²	53.2	49%	0.487	26%	0.262	S	S	.	.	S	Bend	trans	-117.9	24.8	-173.2	-65.5	2.6	0	0	0	112.9
392	C	73.4	Confident	77.2	Confident	25 Å²	25	54.6 Å²	54.6	17%	0.169	27%	0.272	C	S	.	.	S	Bend	trans	-94.6	142.7	177.8	-70.1	0	0	0	0	110.5	C389 H394 I399	C389-C392 HydrophobicContact CB-CB 3.7Å; C389-C392 WeakPolarHBondContact CB-SG 3.36Å; C389-C392 WeakPolarHBondContact SG-CB 3.1Å; C389-C392 PolarHBondContact SG-N 2.79Å; C389-C392 VanDerWaalsContact SG-N 3.37Å; C389-C392 CovalentContact SG-SG 2.02Å; C389-C392 PolarHBondContact SG-SG 2.83Å; C392-H394 PolarHBondContact O-N 2.8Å; C392-I399 HydrophobicContact CB-CD1 3.43Å; C392-I399 VanDerWaalsContact CB-CD1 3.43Å; C392-I399 WeakPolarHBondContact SG-CD1 3.29Å
393	D	66.9	Low	77.1	Confident	69 Å²	69	57.3 Å²	57.3	37%	0.369	28%	0.282	S	S	.	.			trans	-61.6	136.5	178.5	-76.9	-3.1	0	0	0	111.6	R259 E395 Q396	R259-D393 IonicContact CZ-OD1 3.67Å; R259-D393 IonicContact CZ-OD2 3.06Å; R259-D393 IonicContact NH1-OD1 2.71Å; R259-D393 PolarHBondContact NH1-OD1 2.73Å; R259-D393 IonicContact NH1-OD2 2.89Å; R259-D393 PolarHBondContact NH1-OD2 2.84Å; R259-D393 IonicContact NH2-OD1 3.94Å; R259-D393 IonicContact NH2-OD2 2.61Å; R259-D393 PolarHBondContact NH2-OD2 2.82Å; D393-E395 PolarHBondContact O-N 2.87Å; D393-E395 VanDerWaalsContact O-N 3.12Å; D393-Q396 PolarHBondContact O-N 2.82Å
394	H	54.2	Low	77	Confident	125 Å²	125	56.9 Å²	56.9	58%	0.579	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-59.3	-24.5	-179.5	-67.6	-68.4	0	0	0	113.8	Y326 C392 Q396 Q397	Y326-H394 AromaticContact CE1-CE1 3.83Å; Y326-H394 AromaticContact CE1-ND1 3.54Å; Y326-H394 AromaticContact CZ-CE1 3.53Å; Y326-H394 AromaticContact CZ-ND1 3.58Å; Y326-H394 PolarHBondContact OH-CE1 2.89Å; Y326-H394 VanDerWaalsContact OH-CE1 3.3Å; Y326-H394 PolarHBondContact OH-ND1 2.8Å; C392-H394 PolarHBondContact O-N 2.8Å; H394-Q396 PolarHBondContact O-N 2.82Å; H394-Q397 WeakPolarHBondContact O-CG 3.3Å; H394-Q397 PolarHBondContact O-N 2.95Å
395	E	52.9	Low	77.1	Confident	192 Å²	192	54.7 Å²	54.7	90%	0.897	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-69.3	-23	178.1	-63.1	-172.6	174.1	0	0	111.9	D393	D393-E395 PolarHBondContact O-N 2.87Å; D393-E395 VanDerWaalsContact O-N 3.12Å
396	Q	53.9	Low	77.2	Confident	110 Å²	110	54.7 Å²	54.7	51%	0.514	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-104.1	54.2	175.7	-57.2	-179.6	-6.4	0	0	110.2	D393 H394 N398 I399	D393-Q396 PolarHBondContact O-N 2.82Å; H394-Q396 PolarHBondContact O-N 2.82Å; Q396-N398 PolarHBondContact O-N 2.81Å; Q396-I399 HydrophobicContact CB-CD1 3.92Å; Q396-I399 HydrophobicContact CB-CG1 3.69Å; Q396-I399 WeakPolarHBondContact O-CG1 3.2Å
397	Q	54.2	Low	77.4	Confident	98 Å²	98	54 Å²	54	46%	0.458	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.3	-22.6	175.9	-87.9	167.7	15.8	0	0	113.5	H394	H394-Q397 WeakPolarHBondContact O-CG 3.3Å; H394-Q397 PolarHBondContact O-N 2.95Å
398	N	64.2	Low	77.6	Confident	62 Å²	62	54.8 Å²	54.8	33%	0.332	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.8	57.1	-165.7	-54	-32.6	0	0	0	112.9	N228 Q396	N228-N398 WeakPolarHBondContact CB-OD1 3.15Å; N228-N398 PolarHBondContact ND2-ND2 3.17Å; N228-N398 PolarHBondContact ND2-OD1 3.46Å; Q396-N398 PolarHBondContact O-N 2.81Å
399	I	77.1	Confident	78	Confident	20 Å²	20	53 Å²	53	10%	0.103	26%	0.264	C	S	.	.			trans	-71.6	-32.9	179.5	-70.1	159.6	0	0	0	111.8	T254 N255 I258 C392 Q396	T254-I399 CarbonylContact C-O 3.42Å; T254-I399 WeakPolarHBondContact CA-O 3.44Å; T254-I399 WeakPolarHBondContact CB-O 3.33Å; T254-I399 HydrophobicContact CG2-CG2 3.51Å; N255-I399 PolarHBondContact N-O 3.46Å; I258-I399 HydrophobicContact CG1-CG2 4.47Å; C392-I399 HydrophobicContact CB-CD1 3.43Å; C392-I399 VanDerWaalsContact CB-CD1 3.43Å; C392-I399 WeakPolarHBondContact SG-CD1 3.29Å; Q396-I399 HydrophobicContact CB-CD1 3.92Å; Q396-I399 HydrophobicContact CB-CG1 3.69Å; Q396-I399 WeakPolarHBondContact O-CG1 3.2Å
400	I	85.1	Confident	78.3	Confident	9 Å²	9	55.3 Å²	55.3	5%	0.046	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	131.9	-173.7	-61.2	170.6	0	0	0	110.8	N230 F232 V252 T254 I387 P402 V405	N230-I400 HydrophobicContact CB-CD1 4.43Å; F232-I400 HydrophobicContact CE2-CG2 4.46Å; F232-I400 HydrophobicContact CZ-CG2 4.04Å; V252-I400 HydrophobicContact CG1-CB 4.46Å; V252-I400 HydrophobicContact CG1-CD1 4.15Å; V252-I400 HydrophobicContact CG1-CG1 4.1Å; V252-I400 HydrophobicContact CG1-CG2 3.56Å; T254-I400 HydrophobicContact CG2-CG1 4.44Å; I387-I400 HydrophobicContact CB-CD1 3.92Å; I387-I400 HydrophobicContact CG2-CD1 3.56Å; I400-P402 WeakPolarHBondContact O-CD 3.46Å; I400-V405 HydrophobicContact CG2-CG2 4.12Å
401	D	86.1	Confident	78.8	Confident	23 Å²	23	53.7 Å²	53.7	12%	0.123	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	113.7	170	-173.1	-16.8	0	0	0	109.3	E253 N255 K403 K404	E253-D401 PolarHBondContact O-N 2.94Å; N255-D401 VanDerWaalsContact OD1-CB 3.27Å; N255-D401 WeakPolarHBondContact OD1-CB 3.46Å; D401-K403 PolarHBondContact O-N 3.1Å; D401-K403 VanDerWaalsContact O-N 3.13Å; D401-K403 WeakPolarHBondContact OD1-CB 3.47Å; D401-K403 PolarHBondContact OD1-N 2.87Å; D401-K404 HydrophobicContact CB-CB 4.16Å; D401-K404 HydrophobicContact CB-CD 4.32Å; D401-K404 HydrophobicContact CB-CG 4.25Å; D401-K404 PolarHBondContact O-N 3.09Å; D401-K404 VanDerWaalsContact O-N 3.14Å; D401-K404 VanDerWaalsContact OD2-CD 3.29Å; D401-K404 WeakPolarHBondContact OD2-CD 3.5Å; D401-K404 WeakPolarHBondContact OD2-CE 3.3Å; D401-K404 WeakPolarHBondContact OD2-CG 3.38Å
402	P	85	Confident	79.2	Confident	42 Å²	42	55.6 Å²	55.6	27%	0.273	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	-18.5	-178.3	27.9	-35.9	0	0	0	113.7	Q219 F232 I400	Q219-P402 HydrophobicContact CB-CB 3.81Å; Q219-P402 HydrophobicContact CG-CB 4.14Å; F232-P402 HydrophobicContact CE1-CB 4.35Å; I400-P402 WeakPolarHBondContact O-CD 3.46Å
403	K	86.6	Confident	79.2	Confident	111 Å²	111	57.6 Å²	57.6	48%	0.483	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-9.5	179.4	-65.6	-176	179	-176.6	0	113.1	D401 E529	D401-K403 PolarHBondContact O-N 3.1Å; D401-K403 VanDerWaalsContact O-N 3.13Å; D401-K403 WeakPolarHBondContact OD1-CB 3.47Å; D401-K403 PolarHBondContact OD1-N 2.87Å; K403-E529 IonicContact NZ-OE1 2.96Å; K403-E529 PolarHBondContact NZ-OE1 3.35Å; K403-E529 IonicContact NZ-OE2 3.57Å; K403-E529 PolarHBondContact NZ-OE2 2.91Å
404	K	89.5	Confident	79.2	Confident	32 Å²	32	60.9 Å²	60.9	14%	0.139	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	43.6	-173.1	-59.1	-175.3	-178.3	-179.7	0	113.3	N180 P183 E253 D401	N180-K404 PolarHBondContact O-NZ 3Å; P183-K404 HydrophobicContact CB-CB 4.3Å; P183-K404 HydrophobicContact CG-CB 4.06Å; P183-K404 HydrophobicContact CG-CG 4.12Å; E253-K404 HydrophobicContact CB-CB 3.68Å; E253-K404 HydrophobicContact CB-CD 4.12Å; E253-K404 HydrophobicContact CG-CB 4.49Å; E253-K404 HydrophobicContact CG-CD 4.04Å; E253-K404 PolarHBondContact N-O 2.94Å; E253-K404 VanDerWaalsContact N-O 3.13Å; E253-K404 VanDerWaalsContact OE1-CD 3.23Å; E253-K404 WeakPolarHBondContact OE1-CD 3.31Å; E253-K404 IonicContact OE1-NZ 2.78Å; E253-K404 PolarHBondContact OE1-NZ 2.95Å; D401-K404 HydrophobicContact CB-CB 4.16Å; D401-K404 HydrophobicContact CB-CD 4.32Å; D401-K404 HydrophobicContact CB-CG 4.25Å; D401-K404 PolarHBondContact O-N 3.09Å; D401-K404 VanDerWaalsContact O-N 3.14Å; D401-K404 VanDerWaalsContact OD2-CD 3.29Å; D401-K404 WeakPolarHBondContact OD2-CD 3.5Å; D401-K404 WeakPolarHBondContact OD2-CE 3.3Å; D401-K404 WeakPolarHBondContact OD2-CG 3.38Å
405	V	92.7	Very high	79.3	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	106.5	175.6	-174.1	0	0	0	0	109.1	L217 F232 L250 H251 V252 I400	L217-V405 HydrophobicContact CB-CB 4.26Å; L217-V405 HydrophobicContact CB-CG1 4.02Å; L217-V405 HydrophobicContact CD1-CG1 3.6Å; L217-V405 HydrophobicContact CG-CG1 4.41Å; L217-V405 PolarHBondContact N-O 2.97Å; F232-V405 HydrophobicContact CD1-CB 4.24Å; F232-V405 HydrophobicContact CD1-CG1 4.33Å; F232-V405 HydrophobicContact CD1-CG2 4.2Å; F232-V405 HydrophobicContact CE1-CB 4.03Å; F232-V405 HydrophobicContact CE1-CG1 4.44Å; F232-V405 HydrophobicContact CE1-CG2 3.52Å; F232-V405 HydrophobicContact CE2-CG2 4.26Å; F232-V405 HydrophobicContact CG-CG1 4.47Å; F232-V405 HydrophobicContact CZ-CB 4.44Å; F232-V405 HydrophobicContact CZ-CG2 3.56Å; L250-V405 HydrophobicContact CD1-CG1 3.79Å; H251-V405 CarbonylContact O-C 3.5Å; H251-V405 WeakPolarHBondContact O-CA 3.47Å; V252-V405 HydrophobicContact CG1-CG2 4.17Å; V252-V405 HydrophobicContact CG2-CG1 4.24Å; I400-V405 HydrophobicContact CG2-CG2 4.12Å
406	V	94.2	Very high	79.3	Confident	1 Å²	1	62.9 Å²	62.9	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	127	-173.1	-176.9	0	0	0	0	110	P183 I185 L214 L216 H251	P183-V406 HydrophobicContact CB-CG2 4.1Å; P183-V406 HydrophobicContact CG-CG2 3.82Å; I185-V406 HydrophobicContact CG2-CB 4.33Å; L214-V406 HydrophobicContact CD2-CG1 4.37Å; L216-V406 HydrophobicContact CD1-CG2 3.94Å; H251-V406 WeakPolarHBondContact CB-O 3.47Å; H251-V406 PolarHBondContact N-O 3.48Å; H251-V406 PolarHBondContact O-N 2.78Å
407	M	94.8	Very high	79	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	127.2	169.4	-176.2	175	-64.5	0	0	109.8	L214 I215 L217 L234 V248 T249 L250 I361 I385 I409	L214-M407 WeakPolarHBondContact CA-O 3.3Å; I215-M407 HydrophobicContact CB-CB 4.31Å; I215-M407 PolarHBondContact N-O 2.73Å; I215-M407 PolarHBondContact O-N 3.1Å; L217-M407 HydrophobicContact CD1-CB 4.48Å; L217-M407 HydrophobicContact CD1-CE 4.39Å; L234-M407 HydrophobicContact CD1-CE 3.94Å; L234-M407 HydrophobicContact CD1-SD 3.73Å; L234-M407 HydrophobicContact CD2-CE 3.84Å; L234-M407 HydrophobicContact CD2-SD 4Å; L234-M407 HydrophobicContact CG-CE 4.45Å; V248-M407 HydrophobicContact CG1-CG 4Å; V248-M407 HydrophobicContact CG1-SD 3.98Å; T249-M407 CarbonylContact O-C 3.49Å; T249-M407 WeakPolarHBondContact O-CA 3.46Å; L250-M407 HydrophobicContact CD1-CB 4.29Å; L250-M407 HydrophobicContact CD1-CE 4.3Å; I361-M407 HydrophobicContact CD1-CE 4.39Å; I385-M407 HydrophobicContact CD1-CE 4.09Å; M407-I409 HydrophobicContact CG-CG1 4.44Å
408	E	94	Very high	78.5	Confident	17 Å²	17	71.7 Å²	71.7	8%	0.079	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.6	176.7	175.9	-171.6	-164.7	0	0	109	L214 V248 T249 H251 K410	L214-E408 HydrophobicContact CD2-CB 3.92Å; L214-E408 HydrophobicContact CD2-CG 3.96Å; V248-E408 CarbonylContact C-O 3.51Å; V248-E408 VanDerWaalsContact CA-O 3.3Å; V248-E408 WeakPolarHBondContact CA-O 3.37Å; T249-E408 PolarHBondContact N-O 3.31Å; T249-E408 PolarHBondContact O-N 2.94Å; T249-E408 PolarHBondContact OG1-OE2 3.47Å; H251-E408 IonicContact CD2-OE2 3.03Å; H251-E408 IonicContact CE1-OE2 2.83Å; H251-E408 IonicContact NE2-OE2 3.8Å; H251-E408 PolarHBondContact NE2-OE2 2.9Å; E408-K410 HydrophobicContact CG-CG 4.3Å; E408-K410 WeakPolarHBondContact OE1-CE 3.37Å; E408-K410 IonicContact OE1-NZ 3.37Å
409	I	93.3	Very high	77.6	Confident	0 Å²	0	78.8 Å²	78.8	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	116.8	175.4	-55.3	169.9	0	0	0	107.1	E212 T213 I215 I240 I245 R247 V248 M365 M407 Y411	E212-I409 CarbonylContact C-O 3.55Å; E212-I409 WeakPolarHBondContact CA-O 3.44Å; T213-I409 PolarHBondContact N-O 2.82Å; T213-I409 PolarHBondContact O-N 2.97Å; T213-I409 WeakPolarHBondContact OG1-CB 3.5Å; I215-I409 HydrophobicContact CD1-CD1 3.93Å; I240-I409 HydrophobicContact CD1-CD1 3.75Å; I245-I409 HydrophobicContact CG1-CG2 4.28Å; I245-I409 HydrophobicContact CG2-CG2 4.29Å; R247-I409 CarbonylContact O-C 3.51Å; R247-I409 WeakPolarHBondContact O-CA 3.3Å; V248-I409 HydrophobicContact CG1-CG1 4.07Å; V248-I409 HydrophobicContact CG2-CB 4.48Å; V248-I409 HydrophobicContact CG2-CG1 4.19Å; V248-I409 HydrophobicContact CG2-CG2 4.12Å; M365-I409 HydrophobicContact CE-CD1 4.3Å; M407-I409 HydrophobicContact CG-CG1 4.44Å; I409-Y411 HydrophobicContact CB-CE2 4.44Å; I409-Y411 HydrophobicContact CG2-CD1 4.48Å; I409-Y411 HydrophobicContact CG2-CE1 3.79Å; I409-Y411 HydrophobicContact CG2-CE2 3.92Å; I409-Y411 VanDerWaalsContact CG2-CZ 3.45Å; I409-Y411 WeakPolarHBondContact CG2-OH 3.45Å
410	K	91.8	Very high	75.9	Confident	68 Å²	68	89.6 Å²	89.6	30%	0.296	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	135.9	174.1	-64	-164.4	174.7	-162.1	0	110.3	S246 R247 E408	S246-K410 WeakPolarHBondContact CA-O 3.47Å; S246-K410 WeakPolarHBondContact CB-O 3.26Å; S246-K410 PolarHBondContact N-O 3.45Å; R247-K410 HydrophobicContact CB-CB 4.48Å; R247-K410 PolarHBondContact N-O 2.82Å; R247-K410 PolarHBondContact O-N 3.47Å; E408-K410 HydrophobicContact CG-CG 4.3Å; E408-K410 WeakPolarHBondContact OE1-CE 3.37Å; E408-K410 IonicContact OE1-NZ 3.37Å
411	Y	89	Confident	74	Confident	32 Å²	32	93.5 Å²	93.5	13%	0.125	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	147.2	178.6	-58.7	-81.3	0	0	0	111.3	K211 T213 I240 H244 I245 I409	K211-Y411 HydrophobicContact CB-CD2 4.08Å; K211-Y411 WeakPolarHBondContact O-CB 3.18Å; K211-Y411 WeakPolarHBondContact O-CD2 3.36Å; K211-Y411 PolarHBondContact O-N 3.18Å; T213-Y411 HydrophobicContact CG2-CE2 3.7Å; T213-Y411 WeakPolarHBondContact OG1-CE2 3.48Å; T213-Y411 PolarHBondContact OG1-OH 2.9Å; I240-Y411 HydrophobicContact CG2-CE1 3.67Å; I240-Y411 VanDerWaalsContact CG2-OH 3.3Å; I240-Y411 WeakPolarHBondContact CG2-OH 3.24Å; H244-Y411 HydrophobicContact CB-CD1 4.34Å; H244-Y411 CarbonylContact O-C 3.5Å; H244-Y411 VanDerWaalsContact O-CA 3.28Å; H244-Y411 WeakPolarHBondContact O-CA 3.44Å; I245-Y411 HydrophobicContact CG1-CD1 4.2Å; I245-Y411 HydrophobicContact CG1-CE1 3.91Å; I409-Y411 HydrophobicContact CB-CE2 4.44Å; I409-Y411 HydrophobicContact CG2-CD1 4.48Å; I409-Y411 HydrophobicContact CG2-CE1 3.79Å; I409-Y411 HydrophobicContact CG2-CE2 3.92Å; I409-Y411 VanDerWaalsContact CG2-CZ 3.45Å; I409-Y411 WeakPolarHBondContact CG2-OH 3.45Å
412	R	84.9	Confident	71.9	Confident	131 Å²	131	99.8 Å²	99.8	49%	0.494	45%	0.447	S	S	.	.			trans	-73	142.3	167.6	-62.1	-171	-178.3	85.6	9.6	108.9	H244 I245 R414	H244-R412 PolarHBondContact O-N 3.07Å; I245-R412 PolarHBondContact O-NH1 3.28Å; R412-R414 PolarHBondContact O-N 2.92Å
413	P	72.1	Confident	69.8	Low	67 Å²	67	104 Å²	104	44%	0.435	47%	0.472	S	S	.	.			trans	-58.6	136.1	171.9	24.9	-32.8	0	0	0	109.6	D208 L415	D208-P413 HydrophobicContact CB-CB 4.38Å; P413-L415 PolarHBondContact O-N 2.95Å
414	R	66.7	Low	67.5	Low	138 Å²	138	108 Å²	108	52%	0.521	49%	0.489	S	S	.	.			trans	-66	105.5	172.8	-72.7	-170.7	179.4	147.1	12.1	107.7	H244 R412 K416 D426	H244-R414 PolarHBondContact NE2-NE 3.02Å; R412-R414 PolarHBondContact O-N 2.92Å; R414-K416 VanDerWaalsContact C-N 3.27Å; R414-K416 PolarHBondContact O-N 3.44Å; R414-D426 IonicContact CZ-OD2 2.69Å; R414-D426 IonicContact NH1-OD2 3.75Å; R414-D426 PolarHBondContact NH1-OD2 2.89Å
415	L	58.2	Low	65.1	Low	166 Å²	166	109.9 Å²	109.9	87%	0.869	52%	0.518	S	S	*	.			trans	-63.4	95.8	163.4	-65.8	178.2	0	0	0	106.9	P413 R417	P413-L415 PolarHBondContact O-N 2.95Å; L415-R417 PolarHBondContact O-N 3.33Å
416	K	52.8	Low	62.9	Low	193 Å²	193	114.2 Å²	114.2	84%	0.839	54%	0.541	S	S	*	.			trans	-66	84.9	171.4	-75	-173.4	-179.4	178.4	0	107.7	R414 Q418	R414-K416 VanDerWaalsContact C-N 3.27Å; R414-K416 PolarHBondContact O-N 3.44Å; K416-Q418 PolarHBondContact O-N 2.96Å; K416-Q418 VanDerWaalsContact O-N 3.08Å
417	R	47.7	Very low	60.9	Low	216 Å²	216	120.2 Å²	120.2	82%	0.815	57%	0.569	S	S	*	*			trans	-66	110.2	163.2	-143.6	175.9	-174.3	172.2	1.5	105.4	L415 R419	L415-R417 PolarHBondContact O-N 3.33Å; R417-R419 PolarHBondContact O-N 2.96Å
418	Q	43.7	Very low	59.7	Low	178 Å²	178	123.7 Å²	123.7	83%	0.832	59%	0.59	S	S	*	*			trans	-60.2	85.3	173.2	-85.1	-175.8	-11.2	0	0	109	K416	K416-Q418 PolarHBondContact O-N 2.96Å; K416-Q418 VanDerWaalsContact O-N 3.08Å
419	R	45.4	Very low	58.9	Low	210 Å²	210	124.4 Å²	124.4	79%	0.792	59%	0.594	S	S	*	*			trans	-79.1	119.2	161.8	-78.9	-173.3	171.9	151.7	-3.2	106.7	R417 S421	R417-R419 PolarHBondContact O-N 2.96Å; R419-S421 PolarHBondContact O-N 3.36Å
420	R	40.8	Very low	58.3	Low	247 Å²	247	130.4 Å²	130.4	93%	0.932	62%	0.618	S	S	*	*	S	Bend	trans	-69.5	11.2	-177.3	-79.9	-176.8	174.9	164.5	-1.4	114.8
421	S	44.3	Very low	57.9	Low	92 Å²	92	130.4 Å²	130.4	64%	0.643	62%	0.621	S	S	*	*	S	Bend	trans	-163.2	149.4	-176.6	178.5	0	0	0	0	109.8	R419	R419-S421 PolarHBondContact O-N 3.36Å
422	L	43	Very low	57.6	Low	154 Å²	154	131.6 Å²	131.6	81%	0.806	63%	0.631	S	S	*	*			trans	91.5	81	179.8	-55.5	163.8	0	0	0	115.1
423	T	39.6	Very low	57.6	Low	130 Å²	130	126.5 Å²	126.5	80%	0.798	62%	0.616	S	S	*	*			trans	-40.6	139.3	138.6	49.7	0	0	0	0	111.3
424	K	40	Very low	57.6	Low	197 Å²	197	131.6 Å²	131.6	86%	0.857	63%	0.626	S	S	*	*			trans	93.2	97.3	-178	-63.2	174.2	168.7	177.9	0	113.6
425	G	38.9	Very low	57.6	Low	71 Å²	71	129.4 Å²	129.4	73%	0.732	63%	0.632	S	S	*	*			trans	-167	-35.6	171.8	0	0	0	0	0	115
426	D	45.7	Very low	57.6	Low	90 Å²	90	129.4 Å²	129.4	48%	0.481	63%	0.633	S	S	.	*	S	Bend	trans	-97.8	164.4	173	-74.5	-1.4	0	0	0	109.1	R414 T428	R414-D426 IonicContact CZ-OD2 2.69Å; R414-D426 IonicContact NH1-OD2 3.75Å; R414-D426 PolarHBondContact NH1-OD2 2.89Å; D426-T428 HydrophobicContact CB-CG2 4Å; D426-T428 VanDerWaalsContact O-CG2 3.3Å; D426-T428 WeakPolarHBondContact O-CG2 3.33Å; D426-T428 PolarHBondContact O-N 2.84Å
427	E	52.9	Low	57.6	Low	127 Å²	127	122.9 Å²	122.9	59%	0.593	62%	0.621	S	S	*	*			trans	-62.3	64.2	169.3	-69.6	163.9	-162.6	0	0	110	I429	E427-I429 PolarHBondContact O-N 2.88Å
428	T	68.3	Low	58.1	Low	73 Å²	73	114.5 Å²	114.5	45%	0.448	59%	0.591	S	S	.	*			trans	-78	121.8	-165.6	53.5	0	0	0	0	107.5	D426 Y430	D426-T428 HydrophobicContact CB-CG2 4Å; D426-T428 VanDerWaalsContact O-CG2 3.3Å; D426-T428 WeakPolarHBondContact O-CG2 3.33Å; D426-T428 PolarHBondContact O-N 2.84Å; T428-Y430 PolarHBondContact O-N 2.84Å
429	I	76.9	Confident	58.9	Low	33 Å²	33	110.7 Å²	110.7	17%	0.169	57%	0.573	C	S	.	*			trans	-34	123.9	162.8	-54.8	168.9	0	0	0	109	E427 V432 T444 P446 N469 L541	E427-I429 PolarHBondContact O-N 2.88Å; I429-V432 HydrophobicContact CB-CG2 3.9Å; I429-V432 HydrophobicContact CG2-CG2 3.88Å; I429-V432 WeakPolarHBondContact O-CG2 3.39Å; I429-T444 VanDerWaalsContact CG2-CB 3.5Å; I429-T444 HydrophobicContact CG2-CG2 3.91Å; I429-T444 WeakPolarHBondContact CG2-OG1 3.48Å; I429-P446 HydrophobicContact CD1-CB 4.37Å; I429-P446 HydrophobicContact CD1-CG 4.31Å; I429-N469 WeakPolarHBondContact CD1-ND2 3.3Å; I429-L541 CarbonylContact C-O 3.57Å; I429-L541 WeakPolarHBondContact CA-O 3.45Å
430	Y	82	Confident	60.1	Low	125 Å²	125	106.3 Å²	106.3	49%	0.49	56%	0.557	S	S	.	*	B	Isolated β-bridge	trans	-87.2	144.8	-178.1	-61.9	-83.9	0	0	0	110.7	T428 V432 T444 L541	T428-Y430 PolarHBondContact O-N 2.84Å; Y430-V432 PolarHBondContact O-N 2.81Å; Y430-T444 WeakPolarHBondContact O-CB 3.49Å; Y430-T444 WeakPolarHBondContact O-CG2 3.48Å; Y430-T444 PolarHBondContact O-OG1 3.02Å; Y430-L541 HydrophobicContact CD2-CB 4.44Å; Y430-L541 PolarHBondContact N-O 3.42Å
431	N	82	Confident	62	Low	68 Å²	68	94.7 Å²	94.7	36%	0.364	51%	0.513	S	S	.	.	S	Bend	trans	57	45.3	177.8	-169.4	24.4	0	0	0	113.3	C442 C443 T444 C543	N431-C442 PolarHBondContact ND2-O 2.91Å; N431-C443 CarbonylContact O-C 3.59Å; N431-C443 VanDerWaalsContact O-CA 3.27Å; N431-C443 WeakPolarHBondContact O-CA 3.37Å; N431-C443 VanDerWaalsContact O-CB 3.28Å; N431-C443 WeakPolarHBondContact O-CB 3.44Å; N431-T444 PolarHBondContact O-N 2.84Å; N431-T444 PolarHBondContact O-OG1 2.97Å; N431-C543 PolarHBondContact ND2-O 2.82Å; N431-C543 VanDerWaalsContact ND2-O 3.13Å
432	V	84.2	Confident	63.8	Low	57 Å²	57	90.3 Å²	90.3	35%	0.345	48%	0.483	S	S	.	.	B	Isolated β-bridge	trans	-62.3	134.3	-178.2	-171.4	0	0	0	0	111.7	I429 Y430 R434 T444 P446	I429-V432 HydrophobicContact CB-CG2 3.9Å; I429-V432 HydrophobicContact CG2-CG2 3.88Å; I429-V432 WeakPolarHBondContact O-CG2 3.39Å; Y430-V432 PolarHBondContact O-N 2.81Å; V432-R434 PolarHBondContact O-N 2.92Å; V432-T444 CarbonylContact C-O 3.55Å; V432-T444 WeakPolarHBondContact CA-O 3.47Å; V432-T444 VanDerWaalsContact CA-OG1 3.23Å; V432-T444 WeakPolarHBondContact CA-OG1 3.24Å; V432-T444 PolarHBondContact N-OG1 2.76Å; V432-P446 HydrophobicContact CG1-CG 3.78Å
433	C	83.5	Confident	65.9	Low	25 Å²	25	83.1 Å²	83.1	17%	0.169	45%	0.446	C	S	.	.			trans	-58	126.2	174.4	-61.8	0	0	0	0	110.9	C443 T444	C433-C443 WeakPolarHBondContact CA-SG 3.42Å; C433-C443 HydrophobicContact CB-CB 3.9Å; C433-C443 WeakPolarHBondContact CB-SG 3.33Å; C433-C443 VanDerWaalsContact SG-C 3.51Å; C433-C443 WeakPolarHBondContact SG-CB 3.38Å; C433-C443 CovalentContact SG-SG 2.03Å; C433-C443 PolarHBondContact SG-SG 3.38Å; C433-T444 PolarHBondContact N-O 2.78Å; C433-T444 PolarHBondContact SG-O 2.82Å
434	R	73.9	Confident	68.2	Low	173 Å²	173	77 Å²	77	65%	0.653	41%	0.408	S	S	*	.			trans	-105.5	147.1	175.5	-63.6	175.6	-175.1	142.1	-9.9	110.7	V432 N436 H438	V432-R434 PolarHBondContact O-N 2.92Å; R434-N436 VanDerWaalsContact C-N 3.32Å; R434-N436 PolarHBondContact O-N 2.92Å; R434-H438 PolarHBondContact NH1-NE2 3.13Å
435	S	66.4	Low	70.5	Confident	93 Å²	93	70.1 Å²	70.1	65%	0.65	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-37.1	179.3	-51.4	0	0	0	0	113.5	H439	S435-H439 PolarHBondContact O-CE1 3.03Å; S435-H439 PolarHBondContact O-ND1 3.13Å; S435-H439 VanDerWaalsContact O-ND1 3.16Å
436	N	57.4	Low	72.8	Confident	166 Å²	166	69.5 Å²	69.5	89%	0.888	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	16.2	-166.1	-62.7	7.6	0	0	0	115	R434	R434-N436 VanDerWaalsContact C-N 3.32Å; R434-N436 PolarHBondContact O-N 2.92Å
437	G	53.9	Low	74.8	Confident	56 Å²	56	66.2 Å²	66.2	58%	0.577	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-164.6	-15.6	-176.1	0	0	0	0	0	118.1
438	H	57.1	Low	76.3	Confident	40 Å²	40	63.6 Å²	63.6	19%	0.185	34%	0.34	C	S	.	.			trans	-111.8	10.8	-178.6	-61.1	-54	0	0	0	113.7	R434 Y440 S441 C443	R434-H438 PolarHBondContact NH1-NE2 3.13Å; H438-Y440 PolarHBondContact O-N 2.78Å; H438-S441 VanDerWaalsContact CA-OG 3.31Å; H438-S441 WeakPolarHBondContact CA-OG 3.29Å; H438-S441 WeakPolarHBondContact CB-OG 3.4Å; H438-S441 PolarHBondContact ND1-OG 2.82Å; H438-S441 VanDerWaalsContact ND1-OG 3.09Å; H438-S441 PolarHBondContact O-N 3.23Å; H438-S441 VanDerWaalsContact O-N 3.1Å; H438-S441 VanDerWaalsContact O-O 3.12Å; H438-C443 HydrophobicContact CB-CB 4.36Å
439	H	60.6	Low	77.2	Confident	98 Å²	98	60.5 Å²	60.5	45%	0.454	32%	0.321	S	S	.	.	S	Bend	trans	-53.8	-27.8	-175.3	-88.5	29.1	0	0	0	113.7	S435	S435-H439 PolarHBondContact O-CE1 3.03Å; S435-H439 PolarHBondContact O-ND1 3.13Å; S435-H439 VanDerWaalsContact O-ND1 3.16Å
440	Y	70.5	Confident	77.7	Confident	117 Å²	117	62.9 Å²	62.9	46%	0.459	33%	0.33	S	S	.	.	S	Bend	trans	-112.1	-12.9	179.2	-56.3	-73.2	0	0	0	114.5	Y123 H438 S474	Y123-Y440 WeakPolarHBondContact CE2-OH 3.23Å; H438-Y440 PolarHBondContact O-N 2.78Å; Y440-S474 WeakPolarHBondContact O-CA 3.37Å; Y440-S474 WeakPolarHBondContact O-CB 3.37Å; Y440-S474 PolarHBondContact O-N 2.88Å; Y440-S474 VanDerWaalsContact O-O 3.11Å
441	S	79.9	Confident	78	Confident	3 Å²	3	57 Å²	57	2%	0.021	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-95.8	145.8	-175.9	70.2	0	0	0	0	111.1	H438 C443 S474	H438-S441 VanDerWaalsContact CA-OG 3.31Å; H438-S441 WeakPolarHBondContact CA-OG 3.29Å; H438-S441 WeakPolarHBondContact CB-OG 3.4Å; H438-S441 PolarHBondContact ND1-OG 2.82Å; H438-S441 VanDerWaalsContact ND1-OG 3.09Å; H438-S441 PolarHBondContact O-N 3.23Å; H438-S441 VanDerWaalsContact O-N 3.1Å; H438-S441 VanDerWaalsContact O-O 3.12Å; S441-C443 PolarHBondContact O-N 3.27Å; S441-S474 WeakPolarHBondContact CA-O 2.94Å
442	C	83.9	Confident	78.2	Confident	1 Å²	1	56.4 Å²	56.4	1%	0.007	31%	0.308	C	S	.	.			trans	-53.9	124.1	177.3	-178.8	0	0	0	0	112.9	N431 R472 S474 T480 C511 A544 C545	N431-C442 PolarHBondContact ND2-O 2.91Å; C442-R472 CarbonylContact C-O 3.59Å; C442-R472 WeakPolarHBondContact CA-O 3.42Å; C442-S474 PolarHBondContact N-O 2.94Å; C442-T480 HydrophobicContact CB-CG2 4.48Å; C442-C511 WeakPolarHBondContact CA-SG 3.33Å; C442-C511 HydrophobicContact CB-CB 3.66Å; C442-C511 WeakPolarHBondContact CB-SG 3.03Å; C442-C511 VanDerWaalsContact SG-CA 3.54Å; C442-C511 WeakPolarHBondContact SG-CB 3.31Å; C442-C511 CovalentContact SG-SG 2.04Å; C442-C511 PolarHBondContact SG-SG 2.9Å; C442-A544 VanDerWaalsContact SG-C 3.53Å; C442-C545 WeakPolarHBondContact CB-SG 3.42Å
443	C	86.1	Confident	78.3	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.02	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	162.4	-178.4	59.9	0	0	0	0	111.8	N431 C433 H438 S441 R472	N431-C443 CarbonylContact O-C 3.59Å; N431-C443 VanDerWaalsContact O-CA 3.27Å; N431-C443 WeakPolarHBondContact O-CA 3.37Å; N431-C443 VanDerWaalsContact O-CB 3.28Å; N431-C443 WeakPolarHBondContact O-CB 3.44Å; C433-C443 WeakPolarHBondContact CA-SG 3.42Å; C433-C443 HydrophobicContact CB-CB 3.9Å; C433-C443 WeakPolarHBondContact CB-SG 3.33Å; C433-C443 VanDerWaalsContact SG-C 3.51Å; C433-C443 WeakPolarHBondContact SG-CB 3.38Å; C433-C443 CovalentContact SG-SG 2.03Å; C433-C443 PolarHBondContact SG-SG 3.38Å; H438-C443 HydrophobicContact CB-CB 4.36Å; S441-C443 PolarHBondContact O-N 3.27Å; C443-R472 PolarHBondContact N-O 3.15Å; C443-R472 PolarHBondContact O-N 3.35Å
444	T	87.8	Confident	78.4	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	121.3	170.1	45	0	0	0	0	109.9	I429 Y430 N431 V432 C433 P446 V540 G542 C543	I429-T444 VanDerWaalsContact CG2-CB 3.5Å; I429-T444 HydrophobicContact CG2-CG2 3.91Å; I429-T444 WeakPolarHBondContact CG2-OG1 3.48Å; Y430-T444 WeakPolarHBondContact O-CB 3.49Å; Y430-T444 WeakPolarHBondContact O-CG2 3.48Å; Y430-T444 PolarHBondContact O-OG1 3.02Å; N431-T444 PolarHBondContact O-N 2.84Å; N431-T444 PolarHBondContact O-OG1 2.97Å; V432-T444 CarbonylContact C-O 3.55Å; V432-T444 WeakPolarHBondContact CA-O 3.47Å; V432-T444 VanDerWaalsContact CA-OG1 3.23Å; V432-T444 WeakPolarHBondContact CA-OG1 3.24Å; V432-T444 PolarHBondContact N-OG1 2.76Å; C433-T444 PolarHBondContact N-O 2.78Å; C433-T444 PolarHBondContact SG-O 2.82Å; T444-P446 WeakPolarHBondContact O-CD 3.1Å; T444-V540 HydrophobicContact CG2-CG1 4.26Å; T444-G542 VanDerWaalsContact CG2-CA 3.49Å; T444-C543 HydrophobicContact CG2-CB 3.75Å; T444-C543 VanDerWaalsContact CG2-N 3.26Å; T444-C543 WeakPolarHBondContact CG2-SG 3.4Å
445	Q	88	Confident	78.9	Confident	54 Å²	54	53.3 Å²	53.3	25%	0.252	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	117.8	174	-175.9	59.3	53.1	0	0	109.1	L447 N469 Y470 R472	Q445-L447 PolarHBondContact O-N 3.43Å; Q445-N469 WeakPolarHBondContact O-CA 3.48Å; Q445-Y470 HydrophobicContact CB-CD1 4.14Å; Q445-Y470 HydrophobicContact CB-CD2 4.11Å; Q445-Y470 HydrophobicContact CB-CE1 3.86Å; Q445-Y470 HydrophobicContact CB-CE2 3.82Å; Q445-Y470 HydrophobicContact CB-CG 4.28Å; Q445-Y470 HydrophobicContact CG-CD1 4.28Å; Q445-Y470 HydrophobicContact CG-CE1 3.54Å; Q445-Y470 HydrophobicContact CG-CE2 3.99Å; Q445-Y470 WeakPolarHBondContact CG-OH 3.33Å; Q445-Y470 PolarHBondContact N-O 2.73Å; Q445-Y470 PolarHBondContact O-N 3.43Å; Q445-R472 HydrophobicContact CB-CB 4.41Å
446	P	88	Confident	80	Confident	57 Å²	57	49.7 Å²	49.7	37%	0.37	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-62.5	135.8	172.4	-22.9	34.7	0	0	0	110.6	I429 V432 T444 N469	I429-P446 HydrophobicContact CD1-CB 4.37Å; I429-P446 HydrophobicContact CD1-CG 4.31Å; V432-P446 HydrophobicContact CG1-CG 3.78Å; T444-P446 WeakPolarHBondContact O-CD 3.1Å; P446-N469 VanDerWaalsContact CA-OD1 3.29Å; P446-N469 WeakPolarHBondContact CA-OD1 3.48Å
447	L	87.3	Confident	81.4	Confident	21 Å²	21	45.4 Å²	45.4	11%	0.11	26%	0.26	C	S	.	.			trans	-141.7	121.1	176.3	177.5	64.7	0	0	0	108	T148 I151 I152 F155 Q445 V449 E467 P468 N469 Y470	T148-L447 HydrophobicContact CG2-CD1 3.79Å; I151-L447 HydrophobicContact CG2-CD2 4.11Å; I152-L447 HydrophobicContact CG1-CD2 4.49Å; F155-L447 HydrophobicContact CE2-CD2 4.43Å; Q445-L447 PolarHBondContact O-N 3.43Å; L447-V449 HydrophobicContact CD1-CG2 4.47Å; L447-V449 HydrophobicContact CD2-CG2 4.13Å; L447-V449 HydrophobicContact CG-CG2 3.96Å; L447-E467 CarbonylContact O-C 3.55Å; L447-E467 VanDerWaalsContact O-CA 3.24Å; L447-E467 WeakPolarHBondContact O-CA 3.44Å; L447-P468 HydrophobicContact CD2-CG 4.25Å; L447-P468 HydrophobicContact CG-CG 4.47Å; L447-P468 VanDerWaalsContact O-CD 3.24Å; L447-P468 WeakPolarHBondContact O-CD 3.4Å; L447-N469 PolarHBondContact N-OD1 3.05Å; L447-N469 VanDerWaalsContact N-OD1 3.09Å; L447-Y470 HydrophobicContact CB-CD1 3.91Å; L447-Y470 HydrophobicContact CB-CE1 4.08Å; L447-Y470 HydrophobicContact CD2-CD1 3.93Å; L447-Y470 HydrophobicContact CD2-CE1 4.2Å; L447-Y470 HydrophobicContact CG-CD1 4.49Å
448	S	85.1	Confident	82.8	Confident	72 Å²	72	44.7 Å²	44.7	50%	0.503	24%	0.243	S	C	.	.			trans	-104.1	128.9	172.2	174.1	0	0	0	0	108.8
449	V	86.5	Confident	84.3	Confident	8 Å²	8	42.8 Å²	42.8	5%	0.048	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.9	178.2	-178.8	0	0	0	0	108.3	I152 L447 I454 S465 F466 P468	I152-V449 HydrophobicContact CG1-CG2 4.36Å; L447-V449 HydrophobicContact CD1-CG2 4.47Å; L447-V449 HydrophobicContact CD2-CG2 4.13Å; L447-V449 HydrophobicContact CG-CG2 3.96Å; V449-I454 HydrophobicContact CG1-CD1 4.31Å; V449-I454 HydrophobicContact CG1-CG2 3.97Å; V449-S465 CarbonylContact O-C 3.48Å; V449-S465 VanDerWaalsContact O-CA 3.26Å; V449-S465 WeakPolarHBondContact O-CA 3.5Å; V449-S465 WeakPolarHBondContact O-CB 3.35Å; V449-F466 HydrophobicContact CB-CD1 4.1Å; V449-F466 HydrophobicContact CB-CE1 3.61Å; V449-F466 HydrophobicContact CB-CZ 4.1Å; V449-F466 HydrophobicContact CG1-CE1 3.73Å; V449-F466 HydrophobicContact CG1-CZ 4.31Å; V449-F466 PolarHBondContact N-O 2.85Å; V449-F466 WeakPolarHBondContact O-CD1 3.26Å; V449-F466 PolarHBondContact O-N 3.26Å; V449-P468 HydrophobicContact CG2-CG 4.08Å
450	K	87.3	Confident	85.8	Confident	84 Å²	84	38.2 Å²	38.2	37%	0.365	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	139.1	167.7	-55	-172.8	168.6	-164.3	0	109.1	S452 D453 I454	K450-S452 WeakPolarHBondContact CB-OG 3.48Å; K450-S452 PolarHBondContact O-N 3.31Å; K450-D453 HydrophobicContact CB-CB 4.26Å; K450-D453 WeakPolarHBondContact CB-OD2 3.3Å; K450-D453 PolarHBondContact O-N 3.12Å; K450-D453 VanDerWaalsContact O-N 3.17Å; K450-I454 PolarHBondContact O-N 3.49Å
451	F	89.3	Confident	86.6	Confident	2 Å²	2	32.9 Å²	32.9	1%	0.009	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-28.4	176.4	-72.3	-73	0	0	0	112	L159 I454 G455 W456 D457 I460 P463 K464 F466	L159-F451 HydrophobicContact CD1-CE1 3.99Å; L159-F451 HydrophobicContact CD1-CZ 4.28Å; F451-I454 HydrophobicContact CD1-CD1 3.89Å; F451-I454 HydrophobicContact CD1-CG1 4.38Å; F451-I454 HydrophobicContact CE1-CD1 4.37Å; F451-I454 VanDerWaalsContact O-CG1 3.3Å; F451-I454 WeakPolarHBondContact O-CG1 3.38Å; F451-I454 PolarHBondContact O-N 3.19Å; F451-G455 PolarHBondContact O-N 3.41Å; F451-G455 VanDerWaalsContact O-N 3.1Å; F451-W456 HydrophobicContact CB-CB 4.38Å; F451-W456 HydrophobicContact CD1-CB 4.1Å; F451-W456 HydrophobicContact CD1-CE3 4.33Å; F451-W456 HydrophobicContact CE1-CE3 4.36Å; F451-W456 PolarHBondContact O-N 3.09Å; F451-D457 PolarHBondContact O-N 3.28Å; F451-I460 HydrophobicContact CD1-CB 4.38Å; F451-I460 HydrophobicContact CD1-CD1 3.47Å; F451-I460 VanDerWaalsContact CD1-CD1 3.47Å; F451-I460 HydrophobicContact CD1-CG1 4.49Å; F451-I460 HydrophobicContact CD1-CG2 4.3Å; F451-I460 HydrophobicContact CD2-CG2 3.93Å; F451-I460 HydrophobicContact CE1-CD1 3.35Å; F451-I460 HydrophobicContact CE1-CG2 4.4Å; F451-I460 HydrophobicContact CE2-CG2 4.01Å; F451-I460 HydrophobicContact CG-CB 4.34Å; F451-I460 HydrophobicContact CG-CD1 4.26Å; F451-I460 HydrophobicContact CG-CG2 4.07Å; F451-I460 HydrophobicContact CZ-CD1 4.04Å; F451-I460 HydrophobicContact CZ-CG2 4.25Å; F451-P463 WeakPolarHBondContact CD2-O 3.38Å; F451-P463 HydrophobicContact CE2-CG 4.26Å; F451-P463 WeakPolarHBondContact CE2-O 3.3Å; F451-K464 PolarHBondContact N-O 2.87Å; F451-F466 HydrophobicContact CD1-CE1 4.45Å; F451-F466 HydrophobicContact CD2-CD1 4.32Å; F451-F466 HydrophobicContact CE1-CD1 4.09Å; F451-F466 AromaticContact CE1-CE1 3.74Å; F451-F466 HydrophobicContact CE1-CE1 3.74Å; F451-F466 AromaticContact CE2-CD1 3.58Å; F451-F466 HydrophobicContact CE2-CD1 3.58Å; F451-F466 HydrophobicContact CE2-CE1 4.11Å; F451-F466 HydrophobicContact CE2-CG 4.35Å; F451-F466 AromaticContact CZ-CD1 3.44Å; F451-F466 HydrophobicContact CZ-CD1 3.44Å; F451-F466 VanDerWaalsContact CZ-CD1 3.44Å; F451-F466 AromaticContact CZ-CE1 3.56Å; F451-F466 HydrophobicContact CZ-CE1 3.56Å; F451-F466 HydrophobicContact CZ-CG 4.22Å; F451-F466 HydrophobicContact CZ-CZ 4.41Å
452	S	85.6	Confident	87.2	Confident	55 Å²	55	33.5 Å²	33.5	39%	0.385	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-44.4	170.7	57.8	0	0	0	0	112.6	K450 I454 G455 D457	K450-S452 WeakPolarHBondContact CB-OG 3.48Å; K450-S452 PolarHBondContact O-N 3.31Å; S452-I454 PolarHBondContact O-N 3.22Å; S452-I454 VanDerWaalsContact O-N 3.17Å; S452-G455 PolarHBondContact O-N 3.02Å; S452-D457 WeakPolarHBondContact CB-OD2 3.48Å
453	D	85.4	Confident	87.5	Confident	122 Å²	122	34.3 Å²	34.3	65%	0.652	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-21.8	-176.2	-60.1	-8	0	0	0	111.7	K450	K450-D453 HydrophobicContact CB-CB 4.26Å; K450-D453 WeakPolarHBondContact CB-OD2 3.3Å; K450-D453 PolarHBondContact O-N 3.12Å; K450-D453 VanDerWaalsContact O-N 3.17Å
454	I	86	Confident	87.6	Confident	24 Å²	24	37.4 Å²	37.4	12%	0.123	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	2.9	176.5	63.1	163.4	0	0	0	114.3	I152 K156 V449 K450 F451 S452 W456	I152-I454 HydrophobicContact CG2-CG2 3.74Å; K156-I454 VanDerWaalsContact CE-CB 3.42Å; K156-I454 HydrophobicContact CG-CD1 4.39Å; K156-I454 PolarHBondContact NZ-O 3.26Å; K156-I454 VanDerWaalsContact NZ-O 3.11Å; V449-I454 HydrophobicContact CG1-CD1 4.31Å; V449-I454 HydrophobicContact CG1-CG2 3.97Å; K450-I454 PolarHBondContact O-N 3.49Å; F451-I454 HydrophobicContact CD1-CD1 3.89Å; F451-I454 HydrophobicContact CD1-CG1 4.38Å; F451-I454 HydrophobicContact CE1-CD1 4.37Å; F451-I454 VanDerWaalsContact O-CG1 3.3Å; F451-I454 WeakPolarHBondContact O-CG1 3.38Å; F451-I454 PolarHBondContact O-N 3.19Å; S452-I454 PolarHBondContact O-N 3.22Å; S452-I454 VanDerWaalsContact O-N 3.17Å; I454-W456 HydrophobicContact CD1-CB 4.24Å; I454-W456 HydrophobicContact CD1-CD2 3.85Å; I454-W456 HydrophobicContact CD1-CE3 3.82Å; I454-W456 HydrophobicContact CD1-CG 4.03Å; I454-W456 HydrophobicContact CG1-CB 4.13Å; I454-W456 HydrophobicContact CG1-CD2 4.49Å; I454-W456 HydrophobicContact CG1-CG 4.16Å
455	G	85.4	Confident	87.6	Confident	44 Å²	44	39.5 Å²	39.5	45%	0.454	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.1	30.3	177.7	0	0	0	0	0	114.8	F451 S452 N458	F451-G455 PolarHBondContact O-N 3.41Å; F451-G455 VanDerWaalsContact O-N 3.1Å; S452-G455 PolarHBondContact O-N 3.02Å; G455-N458 PolarHBondContact O-OD1 2.82Å
456	W	89.7	Confident	87.6	Confident	17 Å²	17	37.7 Å²	37.7	6%	0.064	22%	0.22	C	C	.	.			trans	-114.2	3.7	-176.6	-74.5	10.6	0	0	0	113.5	K156 L159 L160 V168 F451 I454 N458 W459 I460	K156-W456 HydrophobicContact CB-CH2 3.59Å; K156-W456 HydrophobicContact CB-CZ2 3.78Å; K156-W456 HydrophobicContact CB-CZ3 4.41Å; K156-W456 HydrophobicContact CD-CZ2 4Å; K156-W456 HydrophobicContact CG-CH2 3.74Å; K156-W456 HydrophobicContact CG-CZ2 3.71Å; K156-W456 HydrophobicContact CG-CZ3 4.25Å; K156-W456 WeakPolarHBondContact O-CH2 3.41Å; L159-W456 HydrophobicContact CB-CZ3 4.16Å; L159-W456 HydrophobicContact CD1-CZ3 4.1Å; L159-W456 HydrophobicContact CD2-CZ3 3.95Å; L159-W456 HydrophobicContact CG-CZ3 4.29Å; L160-W456 HydrophobicContact CD1-CH2 4.17Å; L160-W456 HydrophobicContact CD1-CZ2 4.21Å; L160-W456 HydrophobicContact CD2-CH2 4.27Å; L160-W456 HydrophobicContact CG-CH2 3.86Å; L160-W456 HydrophobicContact CG-CZ2 4.32Å; V168-W456 HydrophobicContact CG2-CZ2 3.87Å; F451-W456 HydrophobicContact CB-CB 4.38Å; F451-W456 HydrophobicContact CD1-CB 4.1Å; F451-W456 HydrophobicContact CD1-CE3 4.33Å; F451-W456 HydrophobicContact CE1-CE3 4.36Å; F451-W456 PolarHBondContact O-N 3.09Å; I454-W456 HydrophobicContact CD1-CB 4.24Å; I454-W456 HydrophobicContact CD1-CD2 3.85Å; I454-W456 HydrophobicContact CD1-CE3 3.82Å; I454-W456 HydrophobicContact CD1-CG 4.03Å; I454-W456 HydrophobicContact CG1-CB 4.13Å; I454-W456 HydrophobicContact CG1-CD2 4.49Å; I454-W456 HydrophobicContact CG1-CG 4.16Å; W456-N458 PolarHBondContact O-N 3.38Å; W456-W459 HydrophobicContact CB-CZ2 4.4Å; W456-W459 AromaticContact CD1-NE1 3.73Å; W456-W459 AromaticContact CD2-CZ2 3.62Å; W456-W459 HydrophobicContact CD2-CZ2 3.62Å; W456-W459 AromaticContact CD2-NE1 3.97Å; W456-W459 HydrophobicContact CE3-CH2 4.28Å; W456-W459 AromaticContact CE3-CZ2 3.52Å; W456-W459 HydrophobicContact CE3-CZ2 3.52Å; W456-W459 HydrophobicContact CG-CZ2 4.05Å; W456-W459 AromaticContact CG-NE1 3.46Å; W456-W459 HydrophobicContact CH2-CZ2 4.35Å; W456-W459 HydrophobicContact CZ2-CZ2 4.46Å; W456-W459 HydrophobicContact CZ3-CH2 4.38Å; W456-W459 AromaticContact CZ3-CZ2 3.91Å; W456-W459 HydrophobicContact CZ3-CZ2 3.91Å; W456-W459 PolarHBondContact O-N 3.48Å; W456-I460 HydrophobicContact CB-CD1 4.25Å; W456-I460 HydrophobicContact CE3-CD1 3.76Å; W456-I460 WeakPolarHBondContact O-CB 3.34Å; W456-I460 PolarHBondContact O-N 2.86Å
457	D	85.1	Confident	87.6	Confident	75 Å²	75	40 Å²	40	40%	0.401	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-12.5	176.9	57.8	-26.6	0	0	0	114.3	F451 S452	F451-D457 PolarHBondContact O-N 3.28Å; S452-D457 WeakPolarHBondContact CB-OD2 3.48Å
458	N	84.2	Confident	87.6	Confident	42 Å²	42	39 Å²	39	23%	0.225	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-23.6	174	62.2	-33.4	0	0	0	114.1	I173 G455 W456	I173-N458 HydrophobicContact CD1-CB 4.11Å; G455-N458 PolarHBondContact O-OD1 2.82Å; W456-N458 PolarHBondContact O-N 3.38Å
459	W	89	Confident	87.8	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.9	-24.8	-179.8	68.8	-86.6	0	0	0	113.7	L159 L160 L163 L165 V168 P169 I171 W456 Y523 L524	L159-W459 HydrophobicContact CD2-CH2 4.13Å; L160-W459 HydrophobicContact CD2-CH2 4.3Å; L160-W459 HydrophobicContact CD2-CZ2 4.49Å; L163-W459 HydrophobicContact CD1-CH2 4.05Å; L163-W459 HydrophobicContact CD1-CZ3 3.9Å; L165-W459 HydrophobicContact CD1-CE3 4.44Å; L165-W459 HydrophobicContact CD1-CH2 4.03Å; L165-W459 HydrophobicContact CD1-CZ3 3.64Å; V168-W459 HydrophobicContact CG1-CG 4.44Å; V168-W459 HydrophobicContact CG1-CZ2 4.38Å; V168-W459 VanDerWaalsContact CG1-NE1 3.29Å; P169-W459 HydrophobicContact CB-CB 4.27Å; P169-W459 HydrophobicContact CG-CD2 4.21Å; P169-W459 HydrophobicContact CG-CE3 3.95Å; P169-W459 HydrophobicContact CG-CG 4.46Å; I171-W459 HydrophobicContact CD1-CB 3.49Å; I171-W459 VanDerWaalsContact CD1-CB 3.49Å; I171-W459 HydrophobicContact CG1-CB 4.08Å; W456-W459 HydrophobicContact CB-CZ2 4.4Å; W456-W459 AromaticContact CD1-NE1 3.73Å; W456-W459 AromaticContact CD2-CZ2 3.62Å; W456-W459 HydrophobicContact CD2-CZ2 3.62Å; W456-W459 AromaticContact CD2-NE1 3.97Å; W456-W459 HydrophobicContact CE3-CH2 4.28Å; W456-W459 AromaticContact CE3-CZ2 3.52Å; W456-W459 HydrophobicContact CE3-CZ2 3.52Å; W456-W459 HydrophobicContact CG-CZ2 4.05Å; W456-W459 AromaticContact CG-NE1 3.46Å; W456-W459 HydrophobicContact CH2-CZ2 4.35Å; W456-W459 HydrophobicContact CZ2-CZ2 4.46Å; W456-W459 HydrophobicContact CZ3-CH2 4.38Å; W456-W459 AromaticContact CZ3-CZ2 3.91Å; W456-W459 HydrophobicContact CZ3-CZ2 3.91Å; W456-W459 PolarHBondContact O-N 3.48Å; W459-Y523 HydrophobicContact CE3-CD2 4.02Å; W459-Y523 HydrophobicContact CE3-CG 4.28Å; W459-Y523 AromaticContact CZ3-CD2 3.9Å; W459-Y523 HydrophobicContact CZ3-CD2 3.9Å; W459-Y523 HydrophobicContact CZ3-CG 4.1Å; W459-Y523 CarbonylContact O-C 3.55Å; W459-Y523 WeakPolarHBondContact O-CA 3.27Å; W459-Y523 WeakPolarHBondContact O-CB 3.31Å; W459-L524 PolarHBondContact O-N 2.88Å
460	I	90.9	Very high	88	Confident	1 Å²	1	36.5 Å²	36.5	1%	0.005	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	114	167.7	-62.9	176.6	0	0	0	108.5	L159 F451 W456 V521	L159-I460 HydrophobicContact CD2-CD1 4.42Å; F451-I460 HydrophobicContact CD1-CB 4.38Å; F451-I460 HydrophobicContact CD1-CD1 3.47Å; F451-I460 VanDerWaalsContact CD1-CD1 3.47Å; F451-I460 HydrophobicContact CD1-CG1 4.49Å; F451-I460 HydrophobicContact CD1-CG2 4.3Å; F451-I460 HydrophobicContact CD2-CG2 3.93Å; F451-I460 HydrophobicContact CE1-CD1 3.35Å; F451-I460 HydrophobicContact CE1-CG2 4.4Å; F451-I460 HydrophobicContact CE2-CG2 4.01Å; F451-I460 HydrophobicContact CG-CB 4.34Å; F451-I460 HydrophobicContact CG-CD1 4.26Å; F451-I460 HydrophobicContact CG-CG2 4.07Å; F451-I460 HydrophobicContact CZ-CD1 4.04Å; F451-I460 HydrophobicContact CZ-CG2 4.25Å; W456-I460 HydrophobicContact CB-CD1 4.25Å; W456-I460 HydrophobicContact CE3-CD1 3.76Å; W456-I460 WeakPolarHBondContact O-CB 3.34Å; W456-I460 PolarHBondContact O-N 2.86Å; I460-V521 HydrophobicContact CD1-CG1 4.5Å; I460-V521 HydrophobicContact CG1-CG1 4.38Å; I460-V521 HydrophobicContact CG2-CG1 3.83Å
461	I	89	Confident	88	Confident	6 Å²	6	33.9 Å²	33.9	3%	0.031	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-42.4	-176.2	-65.1	162.3	0	0	0	110.7	L182 L186 L522 L524 L530	L182-I461 HydrophobicContact CD2-CD1 3.64Å; L186-I461 HydrophobicContact CD1-CG2 4.43Å; L186-I461 HydrophobicContact CD2-CG2 4.49Å; I461-L522 HydrophobicContact CB-CD2 4.37Å; I461-L522 HydrophobicContact CB-CG 4.42Å; I461-L522 HydrophobicContact CG2-CD2 4.17Å; I461-L522 PolarHBondContact N-O 3.41Å; I461-L524 HydrophobicContact CD1-CD1 4.11Å; I461-L524 HydrophobicContact CD1-CD2 4.39Å; I461-L524 HydrophobicContact CD1-CG 3.79Å; I461-L530 HydrophobicContact CD1-CD1 3.38Å
462	H	91.4	Very high	87.8	Confident	15 Å²	15	36.6 Å²	36.6	7%	0.069	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	142	-178.9	-173.9	-79.5	0	0	0	111.6	E212 L214 L522	E212-H462 PolarHBondContact O-NE2 3.35Å; L214-H462 HydrophobicContact CB-CB 4.26Å; L214-H462 HydrophobicContact CD1-CB 4.06Å; H462-L522 HydrophobicContact CB-CB 4.04Å; H462-L522 HydrophobicContact CB-CD2 4.29Å; H462-L522 PolarHBondContact N-O 3Å; H462-L522 PolarHBondContact O-N 3.33Å
463	P	91.1	Very high	87.6	Confident	19 Å²	19	35.7 Å²	35.7	12%	0.123	20%	0.201	C	C	.	.			cis	-74.8	165.8	-4.5	32.4	-35	0	0	0	112	F451 S465 M519	F451-P463 WeakPolarHBondContact CD2-O 3.38Å; F451-P463 HydrophobicContact CE2-CG 4.26Å; F451-P463 WeakPolarHBondContact CE2-O 3.3Å; P463-S465 WeakPolarHBondContact CB-O 3.16Å; P463-M519 HydrophobicContact CG-CE 3.44Å; P463-M519 VanDerWaalsContact CG-CE 3.44Å
464	K	87.8	Confident	87.3	Confident	67 Å²	67	31.5 Å²	31.5	29%	0.291	18%	0.181	S	C	.	.	S	Bend	trans	-76.7	-30.7	177	-65.6	-63.6	-169.4	171.4	0	112.9	E193 F451	E193-K464 VanDerWaalsContact OE1-CE 3.29Å; E193-K464 WeakPolarHBondContact OE1-CE 3.35Å; E193-K464 IonicContact OE1-NZ 3.77Å; E193-K464 PolarHBondContact OE1-NZ 3.11Å; E193-K464 WeakPolarHBondContact OE2-CE 3.37Å; E193-K464 IonicContact OE2-NZ 3.72Å; E193-K464 PolarHBondContact OE2-NZ 3.14Å; F451-K464 PolarHBondContact N-O 2.87Å
465	S	87	Confident	86.8	Confident	45 Å²	45	30.6 Å²	30.6	32%	0.315	18%	0.177	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	156.7	174.8	67.4	0	0	0	0	109.9	V449 P463	V449-S465 CarbonylContact O-C 3.48Å; V449-S465 VanDerWaalsContact O-CA 3.26Å; V449-S465 WeakPolarHBondContact O-CA 3.5Å; V449-S465 WeakPolarHBondContact O-CB 3.35Å; P463-S465 WeakPolarHBondContact CB-O 3.16Å
466	F	87.5	Confident	86	Confident	15 Å²	15	33.5 Å²	33.5	7%	0.066	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	158.2	176.4	73.9	-67.8	0	0	0	109.8	V449 F451 P468 M519	V449-F466 HydrophobicContact CB-CD1 4.1Å; V449-F466 HydrophobicContact CB-CE1 3.61Å; V449-F466 HydrophobicContact CB-CZ 4.1Å; V449-F466 HydrophobicContact CG1-CE1 3.73Å; V449-F466 HydrophobicContact CG1-CZ 4.31Å; V449-F466 PolarHBondContact N-O 2.85Å; V449-F466 WeakPolarHBondContact O-CD1 3.26Å; V449-F466 PolarHBondContact O-N 3.26Å; F451-F466 HydrophobicContact CD1-CE1 4.45Å; F451-F466 HydrophobicContact CD2-CD1 4.32Å; F451-F466 HydrophobicContact CE1-CD1 4.09Å; F451-F466 AromaticContact CE1-CE1 3.74Å; F451-F466 HydrophobicContact CE1-CE1 3.74Å; F451-F466 AromaticContact CE2-CD1 3.58Å; F451-F466 HydrophobicContact CE2-CD1 3.58Å; F451-F466 HydrophobicContact CE2-CE1 4.11Å; F451-F466 HydrophobicContact CE2-CG 4.35Å; F451-F466 AromaticContact CZ-CD1 3.44Å; F451-F466 HydrophobicContact CZ-CD1 3.44Å; F451-F466 VanDerWaalsContact CZ-CD1 3.44Å; F451-F466 AromaticContact CZ-CE1 3.56Å; F451-F466 HydrophobicContact CZ-CE1 3.56Å; F451-F466 HydrophobicContact CZ-CG 4.22Å; F451-F466 HydrophobicContact CZ-CZ 4.41Å; F466-P468 VanDerWaalsContact C-CD 3.49Å; F466-P468 HydrophobicContact CD2-CB 4.03Å; F466-P468 VanDerWaalsContact CD2-CD 3.48Å; F466-P468 HydrophobicContact CD2-CG 3.99Å; F466-P468 HydrophobicContact CE2-CB 3.62Å; F466-P468 HydrophobicContact CE2-CG 3.53Å; F466-P468 HydrophobicContact CZ-CG 4.05Å; F466-P468 WeakPolarHBondContact O-CD 3.09Å; F466-M519 HydrophobicContact CB-CE 3.96Å; F466-M519 HydrophobicContact CB-SD 4Å; F466-M519 HydrophobicContact CD2-SD 3.95Å; F466-M519 HydrophobicContact CG-SD 4.28Å
467	E	88.6	Confident	84.3	Confident	106 Å²	106	35.1 Å²	35.1	50%	0.495	19%	0.189	S	C	.	.			trans	-116.5	77.1	-175.6	-65.6	179.2	174.7	0	0	109.5	L447 N469 I539	L447-E467 CarbonylContact O-C 3.55Å; L447-E467 VanDerWaalsContact O-CA 3.24Å; L447-E467 WeakPolarHBondContact O-CA 3.44Å; E467-N469 PolarHBondContact O-N 2.77Å; E467-N469 PolarHBondContact O-ND2 3.38Å; E467-I539 WeakPolarHBondContact O-CG2 3.37Å
468	P	87.1	Confident	82.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.199	C	C	.	.			trans	-65	-31.4	-175.4	22.1	-31.1	0	0	0	112.9	F155 L447 V449 F466 V540	F155-P468 HydrophobicContact CD1-CB 4.11Å; F155-P468 HydrophobicContact CD2-CB 4.47Å; F155-P468 HydrophobicContact CD2-CG 4.42Å; F155-P468 HydrophobicContact CE1-CB 3.61Å; F155-P468 HydrophobicContact CE2-CB 4Å; F155-P468 HydrophobicContact CE2-CG 4.19Å; F155-P468 HydrophobicContact CZ-CB 3.57Å; F155-P468 HydrophobicContact CZ-CG 4.26Å; L447-P468 HydrophobicContact CD2-CG 4.25Å; L447-P468 HydrophobicContact CG-CG 4.47Å; L447-P468 VanDerWaalsContact O-CD 3.24Å; L447-P468 WeakPolarHBondContact O-CD 3.4Å; V449-P468 HydrophobicContact CG2-CG 4.08Å; F466-P468 VanDerWaalsContact C-CD 3.49Å; F466-P468 HydrophobicContact CD2-CB 4.03Å; F466-P468 VanDerWaalsContact CD2-CD 3.48Å; F466-P468 HydrophobicContact CD2-CG 3.99Å; F466-P468 HydrophobicContact CE2-CB 3.62Å; F466-P468 HydrophobicContact CE2-CG 3.53Å; F466-P468 HydrophobicContact CZ-CG 4.05Å; F466-P468 WeakPolarHBondContact O-CD 3.09Å; P468-V540 PolarHBondContact O-N 3.36Å
469	N	90.6	Very high	81.4	Confident	4 Å²	4	38.4 Å²	38.4	2%	0.021	22%	0.217	C	C	.	.			trans	53.9	165.8	-170.9	-48.6	-43.2	0	0	0	112.9	F155 I429 Q445 P446 L447 E467 V540	F155-N469 WeakPolarHBondContact CZ-O 3.4Å; I429-N469 WeakPolarHBondContact CD1-ND2 3.3Å; Q445-N469 WeakPolarHBondContact O-CA 3.48Å; P446-N469 VanDerWaalsContact CA-OD1 3.29Å; P446-N469 WeakPolarHBondContact CA-OD1 3.48Å; L447-N469 PolarHBondContact N-OD1 3.05Å; L447-N469 VanDerWaalsContact N-OD1 3.09Å; E467-N469 PolarHBondContact O-N 2.77Å; E467-N469 PolarHBondContact O-ND2 3.38Å; N469-V540 HydrophobicContact CB-CB 4.14Å; N469-V540 WeakPolarHBondContact CB-O 3.34Å; N469-V540 PolarHBondContact ND2-O 2.61Å
470	Y	89.3	Confident	79.7	Confident	23 Å²	23	39.6 Å²	39.6	9%	0.09	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	161.3	176.4	65.9	-88.2	0	0	0	112.2	I151 Q445 L447 R472	I151-Y470 HydrophobicContact CD1-CD1 4.14Å; I151-Y470 HydrophobicContact CD1-CD2 3.49Å; I151-Y470 VanDerWaalsContact CD1-CD2 3.49Å; I151-Y470 HydrophobicContact CD1-CE1 4.04Å; I151-Y470 HydrophobicContact CD1-CE2 3.38Å; I151-Y470 HydrophobicContact CD1-CG 3.86Å; I151-Y470 HydrophobicContact CG2-CD1 4.21Å; I151-Y470 HydrophobicContact CG2-CG 4.26Å; Q445-Y470 HydrophobicContact CB-CD1 4.14Å; Q445-Y470 HydrophobicContact CB-CD2 4.11Å; Q445-Y470 HydrophobicContact CB-CE1 3.86Å; Q445-Y470 HydrophobicContact CB-CE2 3.82Å; Q445-Y470 HydrophobicContact CB-CG 4.28Å; Q445-Y470 HydrophobicContact CG-CD1 4.28Å; Q445-Y470 HydrophobicContact CG-CE1 3.54Å; Q445-Y470 HydrophobicContact CG-CE2 3.99Å; Q445-Y470 WeakPolarHBondContact CG-OH 3.33Å; Q445-Y470 PolarHBondContact N-O 2.73Å; Q445-Y470 PolarHBondContact O-N 3.43Å; L447-Y470 HydrophobicContact CB-CD1 3.91Å; L447-Y470 HydrophobicContact CB-CE1 4.08Å; L447-Y470 HydrophobicContact CD2-CD1 3.93Å; L447-Y470 HydrophobicContact CD2-CE1 4.2Å; L447-Y470 HydrophobicContact CG-CD1 4.49Å; Y470-R472 HydrophobicContact CD2-CB 4.33Å; Y470-R472 HydrophobicContact CE2-CB 3.99Å
471	C	88.6	Confident	78	Confident	30 Å²	30	46.5 Å²	46.5	20%	0.203	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	134.8	176.7	-58.2	0	0	0	0	111.3	P513 C543	C471-P513 VanDerWaalsContact SG-CA 3.5Å; C471-P513 WeakPolarHBondContact SG-CD 3.33Å; C471-C543 WeakPolarHBondContact CA-SG 3.45Å; C471-C543 HydrophobicContact CB-CB 3.74Å; C471-C543 WeakPolarHBondContact CB-SG 3.48Å; C471-C543 WeakPolarHBondContact SG-CB 3.43Å; C471-C543 CovalentContact SG-SG 2.01Å; C471-C543 PolarHBondContact SG-SG 3.43Å
472	R	84.9	Confident	76.8	Confident	59 Å²	59	47.2 Å²	47.2	22%	0.223	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	151.3	178.5	-178.9	175.4	169.7	170.4	-2.9	110.2	C442 C443 Q445 Y470	C442-R472 CarbonylContact C-O 3.59Å; C442-R472 WeakPolarHBondContact CA-O 3.42Å; C443-R472 PolarHBondContact N-O 3.15Å; C443-R472 PolarHBondContact O-N 3.35Å; Q445-R472 HydrophobicContact CB-CB 4.41Å; Y470-R472 HydrophobicContact CD2-CB 4.33Å; Y470-R472 HydrophobicContact CE2-CB 3.99Å
473	G	81.8	Confident	75.7	Confident	35 Å²	35	49.4 Å²	49.4	36%	0.361	27%	0.271	S	S	.	.	S	Bend	trans	114	174.9	174.1	0	0	0	0	0	112.8
474	S	77.5	Confident	74.6	Confident	35 Å²	35	50.1 Å²	50.1	25%	0.245	27%	0.273	C	S	.	.	B	Isolated β-bridge	trans	-108.6	149.3	178.9	-179.6	0	0	0	0	110.5	Y440 S441 C442 K476	Y440-S474 WeakPolarHBondContact O-CA 3.37Å; Y440-S474 WeakPolarHBondContact O-CB 3.37Å; Y440-S474 PolarHBondContact O-N 2.88Å; Y440-S474 VanDerWaalsContact O-O 3.11Å; S441-S474 WeakPolarHBondContact CA-O 2.94Å; C442-S474 PolarHBondContact N-O 2.94Å; S474-K476 PolarHBondContact OG-N 3.11Å
475	C	76.2	Confident	73.6	Confident	4 Å²	4	50 Å²	50	3%	0.027	27%	0.271	C	S	.	.	S	Bend	trans	-97.6	0.5	175.3	-64.1	0	0	0	0	113.1	V477 S509 C545	C475-V477 PolarHBondContact O-N 2.71Å; C475-S509 WeakPolarHBondContact CB-O 3.42Å; C475-S509 WeakPolarHBondContact CB-OG 3.32Å; C475-C545 WeakPolarHBondContact CA-SG 3.49Å; C475-C545 HydrophobicContact CB-CB 3.62Å; C475-C545 WeakPolarHBondContact CB-SG 3.34Å; C475-C545 WeakPolarHBondContact SG-CA 3.32Å; C475-C545 WeakPolarHBondContact SG-CB 3.4Å; C475-C545 CovalentContact SG-SG 2.02Å; C475-C545 PolarHBondContact SG-SG 3.46Å
476	K	68.4	Low	72.8	Confident	106 Å²	106	49.2 Å²	49.2	46%	0.461	26%	0.264	S	S	.	.			trans	-71.9	-18.2	174.8	-63.8	-175.9	177.5	-176.2	0	112.6	S474 T478 Q508	S474-K476 PolarHBondContact OG-N 3.11Å; K476-T478 PolarHBondContact O-N 3.22Å; K476-Q508 VanDerWaalsContact CE-CD 3.49Å
477	V	54.7	Low	71.9	Confident	51 Å²	51	48.7 Å²	48.7	31%	0.309	26%	0.262	S	S	.	.	S	Bend	trans	-78.4	120.3	-178.5	-168.2	0	0	0	0	108.9	C475 S479 T480	C475-V477 PolarHBondContact O-N 2.71Å; V477-S479 VanDerWaalsContact CG1-OG 3.31Å; V477-S479 WeakPolarHBondContact CG1-OG 3.35Å; V477-S479 PolarHBondContact O-N 3.26Å; V477-T480 PolarHBondContact O-N 2.99Å; V477-T480 VanDerWaalsContact O-N 3.14Å; V477-T480 PolarHBondContact O-OG1 2.93Å
478	T	53.7	Low	70.9	Confident	100 Å²	100	44.5 Å²	44.5	61%	0.613	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-12.3	-176.1	46	0	0	0	0	115.4	K476 K481	K476-T478 PolarHBondContact O-N 3.22Å; T478-K481 WeakPolarHBondContact O-CE 3.21Å; T478-K481 VanDerWaalsContact O-CG 3.29Å; T478-K481 WeakPolarHBondContact O-CG 3.49Å
479	S	54.5	Low	70.1	Confident	86 Å²	86	47.2 Å²	47.2	60%	0.601	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-20.9	179.6	49.7	0	0	0	0	114.2	V477 K481	V477-S479 VanDerWaalsContact CG1-OG 3.31Å; V477-S479 WeakPolarHBondContact CG1-OG 3.35Å; V477-S479 PolarHBondContact O-N 3.26Å; S479-K481 PolarHBondContact O-N 3.5Å
480	T	54.1	Low	69.1	Low	25 Å²	25	50.2 Å²	50.2	15%	0.153	27%	0.272	C	S	.	.			trans	-98.8	65.6	172.7	46	0	0	0	0	110.9	C442 V477 S482	C442-T480 HydrophobicContact CB-CG2 4.48Å; V477-T480 PolarHBondContact O-N 2.99Å; V477-T480 VanDerWaalsContact O-N 3.14Å; V477-T480 PolarHBondContact O-OG1 2.93Å; T480-S482 VanDerWaalsContact C-N 3.31Å; T480-S482 PolarHBondContact O-N 2.91Å
481	K	55.2	Low	68	Low	145 Å²	145	50.1 Å²	50.1	63%	0.63	27%	0.273	S	S	*	.			trans	-70	90.1	172.6	-61.4	-175.1	-178.2	177.2	0	109.1	T478 S479	T478-K481 WeakPolarHBondContact O-CE 3.21Å; T478-K481 VanDerWaalsContact O-CG 3.29Å; T478-K481 WeakPolarHBondContact O-CG 3.49Å; S479-K481 PolarHBondContact O-N 3.5Å
482	S	63.9	Low	67	Low	21 Å²	21	50.9 Å²	50.9	15%	0.147	28%	0.275	C	S	.	.			trans	-75.2	153.2	160.2	71.2	0	0	0	0	109.1	T480 H484 Y485 D486 C545	T480-S482 VanDerWaalsContact C-N 3.31Å; T480-S482 PolarHBondContact O-N 2.91Å; S482-H484 PolarHBondContact O-N 2.96Å; S482-Y485 PolarHBondContact O-N 2.85Å; S482-Y485 VanDerWaalsContact O-N 3.07Å; S482-Y485 PolarHBondContact OG-N 2.93Å; S482-Y485 VanDerWaalsContact OG-N 3.15Å; S482-D486 PolarHBondContact O-N 3.28Å; S482-C545 WeakPolarHBondContact CB-O 3.49Å; S482-C545 PolarHBondContact OG-O 3.47Å
483	L	67	Low	66.1	Low	62 Å²	62	57.9 Å²	57.9	33%	0.325	30%	0.301	S	S	.	.	H	α-helix	trans	-53.4	-37.6	172.6	178.6	70.6	0	0	0	111.3	K86 L89 D486 V487	K86-L483 HydrophobicContact CG-CD1 4.42Å; L89-L483 HydrophobicContact CB-CD2 4.06Å; L89-L483 HydrophobicContact CD1-CD2 3.79Å; L89-L483 HydrophobicContact CD2-CD2 4.05Å; L89-L483 HydrophobicContact CG-CD2 4.18Å; L483-D486 PolarHBondContact O-N 2.75Å; L483-V487 HydrophobicContact CD1-CG2 4.27Å; L483-V487 HydrophobicContact CG-CG2 4.24Å; L483-V487 WeakPolarHBondContact O-CB 3.44Å; L483-V487 WeakPolarHBondContact O-CG2 3.38Å; L483-V487 PolarHBondContact O-N 3.27Å
484	H	69	Low	65.5	Low	33 Å²	33	63.2 Å²	63.2	15%	0.153	32%	0.315	C	S	.	.	H	α-helix	trans	-61.1	-47.6	176.8	-179.6	-86.7	0	0	0	112	S482 D486 V487 M488 S546	S482-H484 PolarHBondContact O-N 2.96Å; H484-D486 VanDerWaalsContact C-N 3.34Å; H484-D486 PolarHBondContact O-N 3.07Å; H484-V487 PolarHBondContact O-N 2.7Å; H484-M488 WeakPolarHBondContact CE1-CG 3.11Å; H484-M488 WeakPolarHBondContact NE2-CE 3.23Å; H484-M488 WeakPolarHBondContact O-CB 3.41Å; H484-M488 WeakPolarHBondContact O-CG 3.19Å; H484-M488 PolarHBondContact O-N 3.06Å; H484-S546 PolarHBondContact CD2-OXT 2.82Å; H484-S546 VanDerWaalsContact CD2-OXT 3.3Å; H484-S546 VanDerWaalsContact CE1-C 3.5Å; H484-S546 PolarHBondContact CE1-OXT 3.15Å; H484-S546 VanDerWaalsContact ND1-C 3.34Å; H484-S546 PolarHBondContact ND1-OXT 3.13Å; H484-S546 PolarHBondContact NE2-OXT 3.02Å; H484-S546 VanDerWaalsContact NE2-OXT 3.11Å
485	Y	67.2	Low	64.6	Low	64 Å²	64	67.9 Å²	67.9	25%	0.251	34%	0.337	S	S	.	.	H	α-helix	trans	-59.4	-47.2	176.4	179.7	-90.7	0	0	0	111	S482 V487 M488 D489	S482-Y485 PolarHBondContact O-N 2.85Å; S482-Y485 VanDerWaalsContact O-N 3.07Å; S482-Y485 PolarHBondContact OG-N 2.93Å; S482-Y485 VanDerWaalsContact OG-N 3.15Å; Y485-V487 VanDerWaalsContact C-N 3.33Å; Y485-V487 PolarHBondContact O-N 3.49Å; Y485-M488 PolarHBondContact O-N 3.14Å; Y485-D489 VanDerWaalsContact O-CB 3.32Å; Y485-D489 WeakPolarHBondContact O-CB 3.37Å; Y485-D489 PolarHBondContact O-N 3.43Å
486	D	68.5	Low	63.8	Low	30 Å²	30	70.7 Å²	70.7	16%	0.16	35%	0.351	C	S	.	.	H	α-helix	trans	-58.6	-43.9	176.9	-80.2	2.2	0	0	0	111.7	K86 S482 L483 H484 L490	K86-D486 IonicContact NZ-OD2 3.26Å; K86-D486 PolarHBondContact NZ-OD2 2.7Å; S482-D486 PolarHBondContact O-N 3.28Å; L483-D486 PolarHBondContact O-N 2.75Å; H484-D486 VanDerWaalsContact C-N 3.34Å; H484-D486 PolarHBondContact O-N 3.07Å; D486-L490 VanDerWaalsContact O-CB 3.3Å; D486-L490 WeakPolarHBondContact O-CB 3.47Å; D486-L490 WeakPolarHBondContact O-CD1 3.39Å; D486-L490 WeakPolarHBondContact O-CG 3.43Å; D486-L490 PolarHBondContact O-N 2.85Å
487	V	69.3	Low	63.1	Low	4 Å²	4	71 Å²	71	2%	0.024	37%	0.367	C	S	.	.	H	α-helix	trans	-65.3	-47.4	178.5	169.7	0	0	0	0	110.5	I90 Y93 L483 H484 Y485 L490 L491	I90-V487 HydrophobicContact CG1-CG2 4.09Å; Y93-V487 HydrophobicContact CD1-CG1 4.32Å; Y93-V487 HydrophobicContact CG-CG1 4.34Å; L483-V487 HydrophobicContact CD1-CG2 4.27Å; L483-V487 HydrophobicContact CG-CG2 4.24Å; L483-V487 WeakPolarHBondContact O-CB 3.44Å; L483-V487 WeakPolarHBondContact O-CG2 3.38Å; L483-V487 PolarHBondContact O-N 3.27Å; H484-V487 PolarHBondContact O-N 2.7Å; Y485-V487 VanDerWaalsContact C-N 3.33Å; Y485-V487 PolarHBondContact O-N 3.49Å; V487-L490 WeakPolarHBondContact O-CB 3.49Å; V487-L490 PolarHBondContact O-N 3.13Å; V487-L491 HydrophobicContact CG1-CD1 3.8Å; V487-L491 HydrophobicContact CG1-CG 4.24Å; V487-L491 WeakPolarHBondContact O-CB 3.36Å; V487-L491 VanDerWaalsContact O-CG 3.24Å; V487-L491 WeakPolarHBondContact O-CG 3.27Å; V487-L491 PolarHBondContact O-N 3.42Å
488	M	68.4	Low	63.2	Low	17 Å²	17	75.8 Å²	75.8	8%	0.084	39%	0.386	C	S	.	.	H	α-helix	trans	-65.8	-42.5	-179.3	-69	-55.1	169	0	0	112	H484 Y485 L490 L491 L492 V507	H484-M488 WeakPolarHBondContact CE1-CG 3.11Å; H484-M488 WeakPolarHBondContact NE2-CE 3.23Å; H484-M488 WeakPolarHBondContact O-CB 3.41Å; H484-M488 WeakPolarHBondContact O-CG 3.19Å; H484-M488 PolarHBondContact O-N 3.06Å; Y485-M488 PolarHBondContact O-N 3.14Å; M488-L490 VanDerWaalsContact C-N 3.32Å; M488-L490 PolarHBondContact O-N 3.42Å; M488-L491 PolarHBondContact O-N 3.37Å; M488-L491 HydrophobicContact SD-CD1 3.95Å; M488-L492 WeakPolarHBondContact O-CB 3.43Å; M488-L492 WeakPolarHBondContact O-CD1 3.44Å; M488-L492 PolarHBondContact O-N 2.78Å; M488-V507 HydrophobicContact CB-CG1 4.05Å; M488-V507 HydrophobicContact CG-CG1 3.86Å; M488-V507 HydrophobicContact SD-CG1 3.76Å
489	D	69	Low	63.3	Low	57 Å²	57	73.6 Å²	73.6	31%	0.305	37%	0.368	S	S	.	.	H	α-helix	trans	-59.8	-43.3	173.8	-175	66.1	0	0	0	111.2	Y485 R493	Y485-D489 VanDerWaalsContact O-CB 3.32Å; Y485-D489 WeakPolarHBondContact O-CB 3.37Å; Y485-D489 PolarHBondContact O-N 3.43Å; D489-R493 WeakPolarHBondContact O-CB 3.03Å; D489-R493 PolarHBondContact O-N 3.22Å
490	L	69.4	Low	63.4	Low	68 Å²	68	71.8 Å²	71.8	36%	0.356	36%	0.363	S	S	.	.	H	α-helix	trans	-63	-42.6	174.6	-74.4	170.6	0	0	0	112.6	I90 D486 V487 M488 R493 K494	I90-L490 HydrophobicContact CD1-CD1 4.01Å; D486-L490 VanDerWaalsContact O-CB 3.3Å; D486-L490 WeakPolarHBondContact O-CB 3.47Å; D486-L490 WeakPolarHBondContact O-CD1 3.39Å; D486-L490 WeakPolarHBondContact O-CG 3.43Å; D486-L490 PolarHBondContact O-N 2.85Å; V487-L490 WeakPolarHBondContact O-CB 3.49Å; V487-L490 PolarHBondContact O-N 3.13Å; M488-L490 VanDerWaalsContact C-N 3.32Å; M488-L490 PolarHBondContact O-N 3.42Å; L490-R493 PolarHBondContact O-N 3.11Å; L490-K494 WeakPolarHBondContact O-CB 3Å; L490-K494 WeakPolarHBondContact O-CG 3.4Å; L490-K494 PolarHBondContact O-N 2.93Å
491	L	67.3	Low	63.6	Low	21 Å²	21	78.1 Å²	78.1	11%	0.11	40%	0.396	C	S	.	.	H	α-helix	trans	-65.7	-44.5	179.4	-71.4	171.7	0	0	0	111.5	L94 V487 M488 K494 L496 F499	L94-L491 HydrophobicContact CD2-CD2 3.8Å; V487-L491 HydrophobicContact CG1-CD1 3.8Å; V487-L491 HydrophobicContact CG1-CG 4.24Å; V487-L491 WeakPolarHBondContact O-CB 3.36Å; V487-L491 VanDerWaalsContact O-CG 3.24Å; V487-L491 WeakPolarHBondContact O-CG 3.27Å; V487-L491 PolarHBondContact O-N 3.42Å; M488-L491 PolarHBondContact O-N 3.37Å; M488-L491 HydrophobicContact SD-CD1 3.95Å; L491-K494 PolarHBondContact O-N 3.05Å; L491-L496 HydrophobicContact CB-CD1 4.48Å; L491-L496 HydrophobicContact CD2-CD1 3.42Å; L491-L496 VanDerWaalsContact CD2-CD1 3.42Å; L491-F499 HydrophobicContact CB-CE2 4.2Å; L491-F499 HydrophobicContact CD1-CE2 4.32Å; L491-F499 HydrophobicContact CD1-CZ 4.24Å; L491-F499 HydrophobicContact CD2-CE2 4.28Å
492	L	66.4	Low	63.7	Low	45 Å²	45	73.6 Å²	73.6	24%	0.236	38%	0.381	C	S	.	.	H	α-helix	trans	-62.7	-45.6	175	-84.3	152.2	0	0	0	111.3	M488 K494 N495 R504 V507	M488-L492 WeakPolarHBondContact O-CB 3.43Å; M488-L492 WeakPolarHBondContact O-CD1 3.44Å; M488-L492 PolarHBondContact O-N 2.78Å; L492-K494 VanDerWaalsContact C-N 3.35Å; L492-K494 PolarHBondContact O-N 3.22Å; L492-N495 PolarHBondContact O-N 2.79Å; L492-N495 VanDerWaalsContact O-N 3.13Å; L492-R504 HydrophobicContact CD1-CG 4.27Å; L492-R504 HydrophobicContact CD2-CG 3.9Å; L492-V507 HydrophobicContact CD1-CB 4.22Å; L492-V507 HydrophobicContact CD1-CG1 4.48Å; L492-V507 HydrophobicContact CD1-CG2 4.34Å
493	R	67.5	Low	63.4	Low	206 Å²	206	78.4 Å²	78.4	78%	0.777	40%	0.401	S	S	*	.	H	α-helix	trans	-67.9	-33.1	-179.7	-171.4	175.6	-174.6	161.3	1.9	113	D489 L490 N495	D489-R493 WeakPolarHBondContact O-CB 3.03Å; D489-R493 PolarHBondContact O-N 3.22Å; L490-R493 PolarHBondContact O-N 3.11Å; R493-N495 PolarHBondContact O-N 3.41Å; R493-N495 VanDerWaalsContact O-N 3.14Å
494	K	68	Low	63	Low	147 Å²	147	84.3 Å²	84.3	64%	0.639	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-1.9	175	-79.1	-172	175.6	-173.9	0	113.2	L490 L491 L492 L496	L490-K494 WeakPolarHBondContact O-CB 3Å; L490-K494 WeakPolarHBondContact O-CG 3.4Å; L490-K494 PolarHBondContact O-N 2.93Å; L491-K494 PolarHBondContact O-N 3.05Å; L492-K494 VanDerWaalsContact C-N 3.35Å; L492-K494 PolarHBondContact O-N 3.22Å; K494-L496 HydrophobicContact CB-CG 4.16Å; K494-L496 PolarHBondContact O-N 3.15Å
495	N	60.2	Low	62.6	Low	133 Å²	133	87.7 Å²	87.7	71%	0.711	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	39	177	-146.4	12.3	0	0	0	111	L492 R493 S497	L492-N495 PolarHBondContact O-N 2.79Å; L492-N495 VanDerWaalsContact O-N 3.13Å; R493-N495 PolarHBondContact O-N 3.41Å; R493-N495 VanDerWaalsContact O-N 3.14Å; N495-S497 PolarHBondContact O-N 2.91Å
496	L	57.6	Low	62.3	Low	63 Å²	63	90.7 Å²	90.7	33%	0.33	45%	0.454	S	S	.	.			trans	-57.7	115.5	178.3	-77.6	166.9	0	0	0	105.1	L491 K494 Q498 F499	L491-L496 HydrophobicContact CB-CD1 4.48Å; L491-L496 HydrophobicContact CD2-CD1 3.42Å; L491-L496 VanDerWaalsContact CD2-CD1 3.42Å; K494-L496 HydrophobicContact CB-CG 4.16Å; K494-L496 PolarHBondContact O-N 3.15Å; L496-Q498 PolarHBondContact O-N 2.89Å; L496-F499 HydrophobicContact CB-CD2 3.89Å; L496-F499 HydrophobicContact CB-CE2 4.47Å; L496-F499 HydrophobicContact CD1-CD2 4.3Å; L496-F499 HydrophobicContact CD1-CE2 4.15Å; L496-F499 PolarHBondContact O-N 3.31Å
497	S	54.7	Low	62	Low	114 Å²	114	90.9 Å²	90.9	80%	0.797	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-51.1	-22.4	-177.4	42.4	0	0	0	0	113.1	N495 F499 G500	N495-S497 PolarHBondContact O-N 2.91Å; S497-F499 VanDerWaalsContact C-N 3.25Å; S497-F499 PolarHBondContact O-N 2.74Å; S497-G500 PolarHBondContact O-N 3.39Å
498	Q	56.9	Low	61.9	Low	150 Å²	150	94.8 Å²	94.8	70%	0.701	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-63.2	-23.2	171.4	-67	-175.6	16.7	0	0	114.8	L496	L496-Q498 PolarHBondContact O-N 2.89Å
499	F	56.2	Low	62.3	Low	54 Å²	54	95 Å²	95	24%	0.237	48%	0.477	C	S	.	.	G	3₁₀ helix	trans	-109.2	5.8	176.6	-62.2	-77	0	0	0	113.1	L491 L496 S497 N501 V502	L491-F499 HydrophobicContact CB-CE2 4.2Å; L491-F499 HydrophobicContact CD1-CE2 4.32Å; L491-F499 HydrophobicContact CD1-CZ 4.24Å; L491-F499 HydrophobicContact CD2-CE2 4.28Å; L496-F499 HydrophobicContact CB-CD2 3.89Å; L496-F499 HydrophobicContact CB-CE2 4.47Å; L496-F499 HydrophobicContact CD1-CD2 4.3Å; L496-F499 HydrophobicContact CD1-CE2 4.15Å; L496-F499 PolarHBondContact O-N 3.31Å; S497-F499 VanDerWaalsContact C-N 3.25Å; S497-F499 PolarHBondContact O-N 2.74Å; F499-N501 PolarHBondContact O-N 3.21Å; F499-V502 HydrophobicContact CD1-CG2 4.3Å; F499-V502 PolarHBondContact O-N 2.82Å
500	G	55.1	Low	62.8	Low	49 Å²	49	94.2 Å²	94.2	51%	0.505	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-23.1	-169.9	0	0	0	0	0	115.4	S497	S497-G500 PolarHBondContact O-N 3.39Å
501	N	58.6	Low	63.6	Low	157 Å²	157	92.2 Å²	92.2	84%	0.84	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-5.5	178.4	-63.9	-5	0	0	0	113.9	F499 Q503	F499-N501 PolarHBondContact O-N 3.21Å; N501-Q503 PolarHBondContact O-N 3.29Å
502	V	57.9	Low	64.6	Low	51 Å²	51	93.8 Å²	93.8	31%	0.309	47%	0.474	S	S	.	.			trans	-83	111.1	-178.9	-172	0	0	0	0	107.6	F499 E506 V507	F499-V502 HydrophobicContact CD1-CG2 4.3Å; F499-V502 PolarHBondContact O-N 2.82Å; V502-E506 HydrophobicContact CG1-CB 3.99Å; V502-V507 HydrophobicContact CB-CG2 4.41Å; V502-V507 HydrophobicContact CG1-CG2 3.37Å
503	Q	58	Low	65.7	Low	122 Å²	122	93 Å²	93	57%	0.57	47%	0.472	S	S	*	.			trans	-64.1	145.3	179	-64.1	-170.2	58.4	0	0	109.6	N501 D505 E506 V507	N501-Q503 PolarHBondContact O-N 3.29Å; Q503-D505 PolarHBondContact O-N 3.39Å; Q503-E506 HydrophobicContact CB-CG 4.17Å; Q503-E506 PolarHBondContact N-OE2 3.03Å; Q503-E506 WeakPolarHBondContact O-CA 3.32Å; Q503-E506 WeakPolarHBondContact O-CB 3.35Å; Q503-E506 PolarHBondContact O-N 3.26Å; Q503-V507 PolarHBondContact O-N 3.37Å
504	R	57.8	Low	66.6	Low	185 Å²	185	87.1 Å²	87.1	70%	0.698	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-31.5	174.3	-73	-166.4	-153.3	-158.6	10.4	112.1	L492 E506 V507	L492-R504 HydrophobicContact CD1-CG 4.27Å; L492-R504 HydrophobicContact CD2-CG 3.9Å; R504-E506 VanDerWaalsContact C-N 3.27Å; R504-E506 PolarHBondContact O-N 2.81Å; R504-V507 PolarHBondContact O-N 2.02Å
505	D	59.8	Low	67.6	Low	105 Å²	105	84.3 Å²	84.3	56%	0.561	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-21.8	177.7	-73	-35.2	0	0	0	114	Q503 Q508	Q503-D505 PolarHBondContact O-N 3.39Å; D505-Q508 VanDerWaalsContact O-CG 3.24Å; D505-Q508 WeakPolarHBondContact O-CG 3.4Å; D505-Q508 PolarHBondContact OD1-NE2 3.22Å
506	E	62.5	Low	69	Low	126 Å²	126	80.8 Å²	80.8	59%	0.589	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-25.5	173.8	-65.7	171.4	179.5	0	0	112	V502 Q503 R504 Q508	V502-E506 HydrophobicContact CG1-CB 3.99Å; Q503-E506 HydrophobicContact CB-CG 4.17Å; Q503-E506 PolarHBondContact N-OE2 3.03Å; Q503-E506 WeakPolarHBondContact O-CA 3.32Å; Q503-E506 WeakPolarHBondContact O-CB 3.35Å; Q503-E506 PolarHBondContact O-N 3.26Å; R504-E506 VanDerWaalsContact C-N 3.27Å; R504-E506 PolarHBondContact O-N 2.81Å; E506-Q508 VanDerWaalsContact C-N 3.28Å; E506-Q508 PolarHBondContact O-N 3.42Å
507	V	62.4	Low	70.4	Confident	35 Å²	35	80 Å²	80	21%	0.212	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	25	177.2	-156.6	0	0	0	0	111.8	M488 L492 V502 Q503 R504 S509	M488-V507 HydrophobicContact CB-CG1 4.05Å; M488-V507 HydrophobicContact CG-CG1 3.86Å; M488-V507 HydrophobicContact SD-CG1 3.76Å; L492-V507 HydrophobicContact CD1-CB 4.22Å; L492-V507 HydrophobicContact CD1-CG1 4.48Å; L492-V507 HydrophobicContact CD1-CG2 4.34Å; V502-V507 HydrophobicContact CB-CG2 4.41Å; V502-V507 HydrophobicContact CG1-CG2 3.37Å; Q503-V507 PolarHBondContact O-N 3.37Å; R504-V507 PolarHBondContact O-N 2.02Å; V507-S509 PolarHBondContact O-N 3.14Å
508	Q	67	Low	72.1	Confident	86 Å²	86	75.9 Å²	75.9	40%	0.402	40%	0.398	S	S	.	.			trans	-65.4	121.9	-179.8	-77.4	178	21.4	0	0	110.9	K476 D505 E506	K476-Q508 VanDerWaalsContact CE-CD 3.49Å; D505-Q508 VanDerWaalsContact O-CG 3.24Å; D505-Q508 WeakPolarHBondContact O-CG 3.4Å; D505-Q508 PolarHBondContact OD1-NE2 3.22Å; E506-Q508 VanDerWaalsContact C-N 3.28Å; E506-Q508 PolarHBondContact O-N 3.42Å
509	S	75.4	Confident	73.6	Confident	20 Å²	20	69 Å²	69	14%	0.14	37%	0.366	C	S	.	.			trans	-67.6	138.1	172.1	53.3	0	0	0	0	111.1	C475 V507 S546	C475-S509 WeakPolarHBondContact CB-O 3.42Å; C475-S509 WeakPolarHBondContact CB-OG 3.32Å; V507-S509 PolarHBondContact O-N 3.14Å; S509-S546 CarbonylContact C-O 3.51Å; S509-S546 WeakPolarHBondContact CA-O 3.24Å; S509-S546 WeakPolarHBondContact CB-O 3.39Å
510	C	81	Confident	75.3	Confident	42 Å²	42	67 Å²	67	28%	0.284	36%	0.358	S	S	.	.			trans	-105.6	146.3	179.9	-68.5	0	0	0	0	111.1	H512 C545 S546	C510-H512 PolarHBondContact O-N 3.35Å; C510-C545 WeakPolarHBondContact O-CA 3.04Å; C510-S546 PolarHBondContact N-O 3.29Å; C510-S546 PolarHBondContact O-N 3.28Å; C510-S546 VanDerWaalsContact O-N 3.11Å
511	C	85.2	Confident	77.1	Confident	26 Å²	26	64.6 Å²	64.6	18%	0.176	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	112.9	172	-174.8	0	0	0	0	109.4	C442	C442-C511 WeakPolarHBondContact CA-SG 3.33Å; C442-C511 HydrophobicContact CB-CB 3.66Å; C442-C511 WeakPolarHBondContact CB-SG 3.03Å; C442-C511 VanDerWaalsContact SG-CA 3.54Å; C442-C511 WeakPolarHBondContact SG-CB 3.31Å; C442-C511 CovalentContact SG-SG 2.04Å; C442-C511 PolarHBondContact SG-SG 2.9Å
512	H	87.8	Confident	78.7	Confident	54 Å²	54	57.2 Å²	57.2	25%	0.25	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	155.2	-173.5	-169.4	-84.5	0	0	0	111	C510 T514 C543 A544	C510-H512 PolarHBondContact O-N 3.35Å; H512-T514 PolarHBondContact O-N 2.76Å; H512-C543 WeakPolarHBondContact O-CA 3.34Å; H512-A544 PolarHBondContact N-O 3.45Å; H512-A544 VanDerWaalsContact N-O 3.08Å; H512-A544 PolarHBondContact O-N 3.49Å; H512-A544 VanDerWaalsContact O-N 3.14Å
513	P	90.9	Very high	80.3	Confident	29 Å²	29	55.5 Å²	55.5	19%	0.188	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	132.4	172.2	23	-34.6	0	0	0	110.9	C471 L516 V540 G542	C471-P513 VanDerWaalsContact SG-CA 3.5Å; C471-P513 WeakPolarHBondContact SG-CD 3.33Å; P513-L516 HydrophobicContact CB-CD2 3.58Å; P513-L516 HydrophobicContact CB-CG 4.16Å; P513-L516 HydrophobicContact CG-CD2 4.1Å; P513-V540 HydrophobicContact CB-CB 4.47Å; P513-V540 HydrophobicContact CB-CG1 3.81Å; P513-V540 HydrophobicContact CB-CG2 3.97Å; P513-V540 HydrophobicContact CG-CG2 4.39Å; P513-G542 CarbonylContact C-O 3.44Å; P513-G542 WeakPolarHBondContact CA-O 3.09Å
514	T	86.6	Confident	81.8	Confident	82 Å²	82	50.1 Å²	50.1	50%	0.503	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	-22.3	175	50.9	0	0	0	0	112.3	H512 G542 A544	H512-T514 PolarHBondContact O-N 2.76Å; T514-G542 PolarHBondContact N-O 2.71Å; T514-G542 PolarHBondContact OG1-O 3Å; T514-A544 HydrophobicContact CG2-CB 3.72Å
515	Q	88.1	Confident	83.2	Confident	87 Å²	87	43 Å²	43	41%	0.407	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	125.8	175.8	-62.8	-177.9	10.9	0	0	109.2	L541 G542	Q515-L541 HydrophobicContact CB-CB 4.07Å; Q515-L541 PolarHBondContact O-N 2.8Å; Q515-G542 PolarHBondContact N-O 3.4Å; Q515-G542 PolarHBondContact O-N 2.89Å
516	L	89.8	Confident	84.4	Confident	59 Å²	59	41.8 Å²	41.8	31%	0.309	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	146.4	-176.6	-64.1	172.2	0	0	0	109.4	P513 N537 I539 V540	P513-L516 HydrophobicContact CB-CD2 3.58Å; P513-L516 HydrophobicContact CB-CG 4.16Å; P513-L516 HydrophobicContact CG-CD2 4.1Å; L516-N537 HydrophobicContact CB-CB 3.97Å; L516-N537 HydrophobicContact CD1-CB 3.81Å; L516-I539 CarbonylContact C-O 3.56Å; L516-I539 WeakPolarHBondContact CA-O 3.22Å; L516-V540 HydrophobicContact CD2-CB 4.28Å; L516-V540 HydrophobicContact CD2-CG2 3.74Å
517	T	87.8	Confident	85.4	Confident	47 Å²	47	41.5 Å²	41.5	29%	0.288	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	163.1	171.7	50.6	0	0	0	0	111.8	L538 I539 L541	T517-L538 PolarHBondContact O-N 3Å; T517-I539 PolarHBondContact N-O 2.83Å; T517-I539 PolarHBondContact O-N 2.98Å; T517-I539 VanDerWaalsContact O-N 3.12Å; T517-I539 WeakPolarHBondContact OG1-CB 3.14Å; T517-L541 HydrophobicContact CG2-CD1 3.3Å; T517-L541 HydrophobicContact CG2-CD2 4.43Å; T517-L541 HydrophobicContact CG2-CG 3.75Å
518	S	88.8	Confident	86.2	Confident	27 Å²	27	44.9 Å²	44.9	19%	0.189	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	153.9	179.4	-53.6	0	0	0	0	109.9	L535 H536 N537	S518-L535 VanDerWaalsContact CA-O 3.23Å; S518-L535 WeakPolarHBondContact CA-O 3.32Å; S518-L535 WeakPolarHBondContact CB-O 3.29Å; S518-H536 WeakPolarHBondContact OG-CA 3.27Å; S518-H536 PolarHBondContact OG-ND1 3.33Å; S518-N537 PolarHBondContact OG-N 3Å
519	M	89.7	Confident	87	Confident	5 Å²	5	44.1 Å²	44.1	3%	0.025	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	164.5	170.6	63.6	173	-69.4	0	0	110.2	E238 P463 F466 V521 T534 L535 L538 I539	E238-M519 HydrophobicContact CG-CB 4.23Å; E238-M519 VanDerWaalsContact OE1-CA 3.24Å; E238-M519 WeakPolarHBondContact OE1-CA 3.39Å; E238-M519 VanDerWaalsContact OE1-CB 3.26Å; E238-M519 WeakPolarHBondContact OE1-CB 3.36Å; P463-M519 HydrophobicContact CG-CE 3.44Å; P463-M519 VanDerWaalsContact CG-CE 3.44Å; F466-M519 HydrophobicContact CB-CE 3.96Å; F466-M519 HydrophobicContact CB-SD 4Å; F466-M519 HydrophobicContact CD2-SD 3.95Å; F466-M519 HydrophobicContact CG-SD 4.28Å; M519-V521 HydrophobicContact CE-CG2 3.85Å; M519-T534 CarbonylContact O-C 3.6Å; M519-L535 HydrophobicContact CG-CB 4.31Å; M519-L535 PolarHBondContact N-O 3.16Å; M519-L535 PolarHBondContact O-N 3.26Å; M519-L538 HydrophobicContact CG-CD2 4.03Å; M519-L538 HydrophobicContact SD-CD2 3.86Å; M519-I539 HydrophobicContact CB-CD1 3.94Å; M519-I539 HydrophobicContact CG-CD1 4.19Å; M519-I539 HydrophobicContact SD-CD1 4.02Å; M519-I539 HydrophobicContact SD-CG1 4.29Å
520	S	90.8	Very high	87.7	Confident	12 Å²	12	43.9 Å²	43.9	8%	0.084	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	144.9	172.7	56.6	0	0	0	0	111.9	E238 M532 H533	E238-S520 PolarHBondContact OE1-N 3.21Å; S520-M532 WeakPolarHBondContact OG-CE 3.32Å; S520-H533 WeakPolarHBondContact CA-O 3.48Å
521	V	92.7	Very high	88.1	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	129.4	177.8	179.2	0	0	0	0	109	I460 M519 Y523 M532 H533 L535	I460-V521 HydrophobicContact CD1-CG1 4.5Å; I460-V521 HydrophobicContact CG1-CG1 4.38Å; I460-V521 HydrophobicContact CG2-CG1 3.83Å; M519-V521 HydrophobicContact CE-CG2 3.85Å; V521-Y523 HydrophobicContact CG1-CD1 4.3Å; V521-M532 WeakPolarHBondContact O-CA 3.35Å; V521-H533 PolarHBondContact N-O 3.49Å; V521-H533 PolarHBondContact O-N 3.47Å; V521-L535 HydrophobicContact CB-CD1 4.31Å; V521-L535 HydrophobicContact CG2-CD1 3.42Å; V521-L535 VanDerWaalsContact CG2-CD1 3.42Å; V521-L535 HydrophobicContact CG2-CG 4.05Å
522	L	92.3	Very high	88.5	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	118	172.5	-176.7	68.7	0	0	0	108.5	L186 L214 L216 I461 H462 L530 Q531 M532	L186-L522 HydrophobicContact CD1-CD2 3.94Å; L214-L522 HydrophobicContact CB-CD2 4.32Å; L216-L522 HydrophobicContact CB-CD1 3.78Å; L216-L522 HydrophobicContact CD2-CD1 4.12Å; I461-L522 HydrophobicContact CB-CD2 4.37Å; I461-L522 HydrophobicContact CB-CG 4.42Å; I461-L522 HydrophobicContact CG2-CD2 4.17Å; I461-L522 PolarHBondContact N-O 3.41Å; H462-L522 HydrophobicContact CB-CB 4.04Å; H462-L522 HydrophobicContact CB-CD2 4.29Å; H462-L522 PolarHBondContact N-O 3Å; H462-L522 PolarHBondContact O-N 3.33Å; L522-L530 HydrophobicContact CD1-CD1 3.65Å; L522-L530 HydrophobicContact CD1-CD2 4.09Å; L522-L530 HydrophobicContact CD1-CG 3.72Å; L522-L530 HydrophobicContact CD2-CD1 4.29Å; L522-L530 HydrophobicContact CG-CD1 3.78Å; L522-L530 HydrophobicContact CG-CG 4.39Å; L522-Q531 WeakPolarHBondContact CA-O 3.07Å; L522-M532 HydrophobicContact CD1-CB 4.02Å
523	Y	91.7	Very high	88.7	Confident	15 Å²	15	45 Å²	45	6%	0.059	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	161.4	-175.1	69.5	-80.2	0	0	0	111.5	L163 L165 W459 V521 D525 Q531 H533	L163-Y523 HydrophobicContact CD1-CD1 4.06Å; L163-Y523 HydrophobicContact CD1-CD2 4.45Å; L163-Y523 HydrophobicContact CD1-CE1 3.99Å; L163-Y523 HydrophobicContact CD1-CE2 4.38Å; L163-Y523 HydrophobicContact CD1-CG 4.29Å; L163-Y523 HydrophobicContact CD2-CD1 4.22Å; L163-Y523 HydrophobicContact CD2-CE1 3.59Å; L163-Y523 HydrophobicContact CG-CE1 4.33Å; L165-Y523 HydrophobicContact CD1-CD2 4.29Å; L165-Y523 HydrophobicContact CD1-CE2 3.95Å; L165-Y523 HydrophobicContact CD2-CE2 4.39Å; W459-Y523 HydrophobicContact CE3-CD2 4.02Å; W459-Y523 HydrophobicContact CE3-CG 4.28Å; W459-Y523 AromaticContact CZ3-CD2 3.9Å; W459-Y523 HydrophobicContact CZ3-CD2 3.9Å; W459-Y523 HydrophobicContact CZ3-CG 4.1Å; W459-Y523 CarbonylContact O-C 3.55Å; W459-Y523 WeakPolarHBondContact O-CA 3.27Å; W459-Y523 WeakPolarHBondContact O-CB 3.31Å; V521-Y523 HydrophobicContact CG1-CD1 4.3Å; Y523-D525 HydrophobicContact CE2-CB 4.42Å; Y523-Q531 HydrophobicContact CE1-CB 4.03Å; Y523-Q531 HydrophobicContact CE2-CB 4.3Å; Y523-Q531 PolarHBondContact N-O 3.12Å; Y523-Q531 PolarHBondContact O-N 3.3Å; Y523-Q531 VanDerWaalsContact O-O 3.12Å; Y523-H533 HydrophobicContact CE1-CB 4.06Å
524	L	89.4	Confident	88.7	Confident	9 Å²	9	44.9 Å²	44.9	5%	0.047	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	128.2	170.6	-72.7	167.8	0	0	0	109.3	I171 L182 W459 I461 E529 L530	I171-L524 HydrophobicContact CD1-CB 3.19Å; I171-L524 HydrophobicContact CD1-CD1 3.78Å; I171-L524 HydrophobicContact CD1-CG 4.13Å; I171-L524 HydrophobicContact CG2-CD1 4.23Å; L182-L524 HydrophobicContact CD2-CD1 4.14Å; L182-L524 HydrophobicContact CD2-CD2 3.66Å; L182-L524 HydrophobicContact CD2-CG 4.18Å; L182-L524 HydrophobicContact CG-CD2 4.45Å; W459-L524 PolarHBondContact O-N 2.88Å; I461-L524 HydrophobicContact CD1-CD1 4.11Å; I461-L524 HydrophobicContact CD1-CD2 4.39Å; I461-L524 HydrophobicContact CD1-CG 3.79Å; L524-E529 WeakPolarHBondContact CA-O 3.25Å; L524-L530 HydrophobicContact CD2-CB 4.24Å; L524-L530 HydrophobicContact CD2-CD1 4.19Å
525	D	87.7	Confident	88.9	Confident	35 Å²	35	41 Å²	41	19%	0.187	21%	0.212	C	C	.	.			trans	-77.5	168.3	173	-166.8	5.6	0	0	0	111.1	L165 Y523 N527 R528 E529 Q531	L165-D525 WeakPolarHBondContact CD2-OD1 3.03Å; Y523-D525 HydrophobicContact CE2-CB 4.42Å; D525-N527 PolarHBondContact O-N 3.08Å; D525-N527 VanDerWaalsContact O-N 3.15Å; D525-R528 WeakPolarHBondContact O-CA 3.05Å; D525-R528 PolarHBondContact O-N 3.35Å; D525-E529 PolarHBondContact N-O 3.47Å; D525-Q531 HydrophobicContact CB-CG 4.36Å
526	S	84.1	Confident	88.9	Confident	81 Å²	81	41.3 Å²	41.3	57%	0.566	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-46.5	-33.9	168.6	53.2	0	0	0	0	114.3	R528	S526-R528 PolarHBondContact O-N 3.48Å
527	N	83.4	Confident	88.8	Confident	120 Å²	120	42.8 Å²	42.8	64%	0.642	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	5.1	175	-62.2	-26.1	0	0	0	113.5	D525 E529	D525-N527 PolarHBondContact O-N 3.08Å; D525-N527 VanDerWaalsContact O-N 3.15Å; N527-E529 HydrophobicContact CB-CG 4.22Å; N527-E529 PolarHBondContact O-N 3.24Å
528	R	79.5	Confident	88.8	Confident	106 Å²	106	40.7 Å²	40.7	40%	0.4	21%	0.208	S	C	.	.	S	Bend	trans	61.7	24.4	-177.3	-52.4	168.2	178.1	-165.1	-2.8	113.6	S177 E178 S181 D525 S526	S177-R528 PolarHBondContact OG-NH1 3.25Å; E178-R528 IonicContact OE1-CZ 3.57Å; E178-R528 IonicContact OE1-NE 2.7Å; E178-R528 IonicContact OE1-NH1 3.97Å; E178-R528 IonicContact OE1-NH2 3.85Å; S181-R528 WeakPolarHBondContact CB-O 3.17Å; S181-R528 PolarHBondContact OG-O 2.98Å; D525-R528 WeakPolarHBondContact O-CA 3.05Å; D525-R528 PolarHBondContact O-N 3.35Å; S526-R528 PolarHBondContact O-N 3.48Å
529	E	84.6	Confident	88.9	Confident	70 Å²	70	40.8 Å²	40.8	33%	0.327	21%	0.207	S	C	.	.			trans	-95.6	138.3	175.4	-59.5	-160.8	159.2	0	0	110.6	K403 L524 D525 N527 Q531	K403-E529 IonicContact NZ-OE1 2.96Å; K403-E529 PolarHBondContact NZ-OE1 3.35Å; K403-E529 IonicContact NZ-OE2 3.57Å; K403-E529 PolarHBondContact NZ-OE2 2.91Å; L524-E529 WeakPolarHBondContact CA-O 3.25Å; D525-E529 PolarHBondContact N-O 3.47Å; N527-E529 HydrophobicContact CB-CG 4.22Å; N527-E529 PolarHBondContact O-N 3.24Å; E529-Q531 PolarHBondContact O-N 3.26Å
530	L	89	Confident	88.9	Confident	14 Å²	14	41 Å²	41	7%	0.073	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	123.4	176.2	-171.9	67.3	0	0	0	110.1	L182 P183 L186 L216 I461 L522 L524	L182-L530 HydrophobicContact CD2-CD1 4.09Å; P183-L530 HydrophobicContact CG-CD2 3.8Å; L186-L530 HydrophobicContact CD1-CD1 4.33Å; L186-L530 HydrophobicContact CD1-CD2 3.64Å; L216-L530 HydrophobicContact CD1-CD2 3.85Å; L216-L530 HydrophobicContact CD2-CD2 4.28Å; L216-L530 HydrophobicContact CD2-CG 4.06Å; I461-L530 HydrophobicContact CD1-CD1 3.38Å; L522-L530 HydrophobicContact CD1-CD1 3.65Å; L522-L530 HydrophobicContact CD1-CD2 4.09Å; L522-L530 HydrophobicContact CD1-CG 3.72Å; L522-L530 HydrophobicContact CD2-CD1 4.29Å; L522-L530 HydrophobicContact CG-CD1 3.78Å; L522-L530 HydrophobicContact CG-CG 4.39Å; L524-L530 HydrophobicContact CD2-CB 4.24Å; L524-L530 HydrophobicContact CD2-CD1 4.19Å
531	Q	91	Very high	88.9	Confident	61 Å²	61	42 Å²	42	29%	0.285	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	143	-178.4	-65.6	-62.5	-24.4	0	0	110.7	L522 Y523 D525 E529	L522-Q531 WeakPolarHBondContact CA-O 3.07Å; Y523-Q531 HydrophobicContact CE1-CB 4.03Å; Y523-Q531 HydrophobicContact CE2-CB 4.3Å; Y523-Q531 PolarHBondContact N-O 3.12Å; Y523-Q531 PolarHBondContact O-N 3.3Å; Y523-Q531 VanDerWaalsContact O-O 3.12Å; D525-Q531 HydrophobicContact CB-CG 4.36Å; E529-Q531 PolarHBondContact O-N 3.26Å
532	M	92.1	Very high	88.7	Confident	18 Å²	18	42.1 Å²	42.1	9%	0.089	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126.4	171.5	-171.1	178.8	-172.3	0	0	110.2	I215 L216 K218 S520 V521 L522	I215-M532 HydrophobicContact CB-CE 4.23Å; I215-M532 HydrophobicContact CB-SD 4.43Å; I215-M532 HydrophobicContact CG1-CE 4.25Å; I215-M532 HydrophobicContact CG2-CE 4Å; I215-M532 HydrophobicContact CG2-SD 3.97Å; L216-M532 HydrophobicContact CB-CB 3.81Å; L216-M532 HydrophobicContact CB-SD 3.99Å; L216-M532 HydrophobicContact CD2-CB 4.2Å; L216-M532 PolarHBondContact N-SD 3.36Å; K218-M532 WeakPolarHBondContact CE-O 3.32Å; K218-M532 PolarHBondContact NZ-O 3Å; S520-M532 WeakPolarHBondContact OG-CE 3.32Å; V521-M532 WeakPolarHBondContact O-CA 3.35Å; L522-M532 HydrophobicContact CD1-CB 4.02Å
533	H	92	Very high	88.5	Confident	68 Å²	68	42.3 Å²	42.3	32%	0.315	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	145.8	-179.2	-161.7	-91	0	0	0	111.3	L163 S520 V521 Y523	L163-H533 HydrophobicContact CD2-CB 3.66Å; S520-H533 WeakPolarHBondContact CA-O 3.48Å; V521-H533 PolarHBondContact N-O 3.49Å; V521-H533 PolarHBondContact O-N 3.47Å; Y523-H533 HydrophobicContact CE1-CB 4.06Å
534	T	90.8	Very high	88.1	Confident	25 Å²	25	43.1 Å²	43.1	15%	0.153	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	113.1	177.7	56.2	0	0	0	0	109.3	A237 M519 H536	A237-T534 HydrophobicContact CB-CG2 3.57Å; M519-T534 CarbonylContact O-C 3.6Å; T534-H536 PolarHBondContact O-N 2.81Å; T534-H536 PolarHBondContact OG1-CE1 3Å; T534-H536 PolarHBondContact OG1-NE2 3.36Å; T534-H536 VanDerWaalsContact OG1-NE2 3.17Å
535	L	90.6	Very high	87.8	Confident	1 Å²	1	43 Å²	43	1%	0.005	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	102.6	177.4	-60.2	-175.9	0	0	0	109.6	L159 Q162 L163 S518 M519 V521 L538	L159-L535 HydrophobicContact CD1-CD1 4.24Å; L159-L535 HydrophobicContact CG-CD1 3.95Å; Q162-L535 HydrophobicContact CB-CD2 3.72Å; L163-L535 HydrophobicContact CD2-CD2 3.66Å; L163-L535 HydrophobicContact CG-CD2 4.16Å; S518-L535 VanDerWaalsContact CA-O 3.23Å; S518-L535 WeakPolarHBondContact CA-O 3.32Å; S518-L535 WeakPolarHBondContact CB-O 3.29Å; M519-L535 HydrophobicContact CG-CB 4.31Å; M519-L535 PolarHBondContact N-O 3.16Å; M519-L535 PolarHBondContact O-N 3.26Å; V521-L535 HydrophobicContact CB-CD1 4.31Å; V521-L535 HydrophobicContact CG2-CD1 3.42Å; V521-L535 VanDerWaalsContact CG2-CD1 3.42Å; V521-L535 HydrophobicContact CG2-CG 4.05Å; L535-L538 HydrophobicContact CB-CB 4.32Å; L535-L538 HydrophobicContact CB-CD2 3.91Å; L535-L538 HydrophobicContact CD1-CD2 3.58Å; L535-L538 HydrophobicContact CG-CD2 4.4Å
536	H	90	Very high	87.2	Confident	94 Å²	94	45 Å²	45	44%	0.435	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	140.9	-177.3	-63.7	-60.7	0	0	0	112.5	Q162 S518 T534 L538	Q162-H536 PolarHBondContact NE2-O 3.45Å; Q162-H536 VanDerWaalsContact NE2-O 3.13Å; S518-H536 WeakPolarHBondContact OG-CA 3.27Å; S518-H536 PolarHBondContact OG-ND1 3.33Å; T534-H536 PolarHBondContact O-N 2.81Å; T534-H536 PolarHBondContact OG1-CE1 3Å; T534-H536 PolarHBondContact OG1-NE2 3.36Å; T534-H536 VanDerWaalsContact OG1-NE2 3.17Å; H536-L538 VanDerWaalsContact C-N 3.3Å; H536-L538 PolarHBondContact O-N 3.48Å
537	N	87.8	Confident	87.3	Confident	90 Å²	90	43.2 Å²	43.2	48%	0.481	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	51.8	47.5	174.1	-62.4	-26.6	0	0	0	112.6	K158 L516 S518	K158-N537 PolarHBondContact NZ-O 3.1Å; L516-N537 HydrophobicContact CB-CB 3.97Å; L516-N537 HydrophobicContact CD1-CB 3.81Å; S518-N537 PolarHBondContact OG-N 3Å
538	L	88	Confident	87.5	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.01	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-46.4	-176.4	-174	66.7	0	0	0	112	F155 K158 T517 M519 L535 H536	F155-L538 HydrophobicContact CD1-CD1 4.41Å; K158-L538 HydrophobicContact CD-CD1 3.93Å; K158-L538 HydrophobicContact CG-CD1 4.39Å; T517-L538 PolarHBondContact O-N 3Å; M519-L538 HydrophobicContact CG-CD2 4.03Å; M519-L538 HydrophobicContact SD-CD2 3.86Å; L535-L538 HydrophobicContact CB-CB 4.32Å; L535-L538 HydrophobicContact CB-CD2 3.91Å; L535-L538 HydrophobicContact CD1-CD2 3.58Å; L535-L538 HydrophobicContact CG-CD2 4.4Å; H536-L538 VanDerWaalsContact C-N 3.3Å; H536-L538 PolarHBondContact O-N 3.48Å
539	I	89.4	Confident	88	Confident	30 Å²	30	35.4 Å²	35.4	15%	0.154	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	130.7	-176.1	-65.6	169.1	0	0	0	109.3	E467 L516 T517 M519 L541	E467-I539 WeakPolarHBondContact O-CG2 3.37Å; L516-I539 CarbonylContact C-O 3.56Å; L516-I539 WeakPolarHBondContact CA-O 3.22Å; T517-I539 PolarHBondContact N-O 2.83Å; T517-I539 PolarHBondContact O-N 2.98Å; T517-I539 VanDerWaalsContact O-N 3.12Å; T517-I539 WeakPolarHBondContact OG1-CB 3.14Å; M519-I539 HydrophobicContact CB-CD1 3.94Å; M519-I539 HydrophobicContact CG-CD1 4.19Å; M519-I539 HydrophobicContact SD-CD1 4.02Å; M519-I539 HydrophobicContact SD-CG1 4.29Å; I539-L541 HydrophobicContact CG2-CD2 4.29Å
540	V	90.6	Very high	88.2	Confident	10 Å²	10	33.4 Å²	33.4	6%	0.061	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	116.7	176.7	-179.6	0	0	0	0	110	T444 P468 N469 P513 L516	T444-V540 HydrophobicContact CG2-CG1 4.26Å; P468-V540 PolarHBondContact O-N 3.36Å; N469-V540 HydrophobicContact CB-CB 4.14Å; N469-V540 WeakPolarHBondContact CB-O 3.34Å; N469-V540 PolarHBondContact ND2-O 2.61Å; P513-V540 HydrophobicContact CB-CB 4.47Å; P513-V540 HydrophobicContact CB-CG1 3.81Å; P513-V540 HydrophobicContact CB-CG2 3.97Å; P513-V540 HydrophobicContact CG-CG2 4.39Å; L516-V540 HydrophobicContact CD2-CB 4.28Å; L516-V540 HydrophobicContact CD2-CG2 3.74Å
541	L	89.7	Confident	88.1	Confident	33 Å²	33	34.6 Å²	34.6	17%	0.173	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	-30.5	171.7	-67.4	-167.6	0	0	0	112.8	I429 Y430 Q515 T517 I539	I429-L541 CarbonylContact C-O 3.57Å; I429-L541 WeakPolarHBondContact CA-O 3.45Å; Y430-L541 HydrophobicContact CD2-CB 4.44Å; Y430-L541 PolarHBondContact N-O 3.42Å; Q515-L541 HydrophobicContact CB-CB 4.07Å; Q515-L541 PolarHBondContact O-N 2.8Å; T517-L541 HydrophobicContact CG2-CD1 3.3Å; T517-L541 HydrophobicContact CG2-CD2 4.43Å; T517-L541 HydrophobicContact CG2-CG 3.75Å; I539-L541 HydrophobicContact CG2-CD2 4.29Å
542	G	88.4	Confident	87.9	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	139.3	-171.7	0	0	0	0	0	112.6	T444 P513 T514 Q515	T444-G542 VanDerWaalsContact CG2-CA 3.49Å; P513-G542 CarbonylContact C-O 3.44Å; P513-G542 WeakPolarHBondContact CA-O 3.09Å; T514-G542 PolarHBondContact N-O 2.71Å; T514-G542 PolarHBondContact OG1-O 3Å; Q515-G542 PolarHBondContact N-O 3.4Å; Q515-G542 PolarHBondContact O-N 2.89Å
543	C	88.5	Confident	87.6	Confident	5 Å²	5	33.9 Å²	33.9	3%	0.034	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	139.5	178.3	-60.5	0	0	0	0	109.9	N431 T444 C471 H512	N431-C543 PolarHBondContact ND2-O 2.82Å; N431-C543 VanDerWaalsContact ND2-O 3.13Å; T444-C543 HydrophobicContact CG2-CB 3.75Å; T444-C543 VanDerWaalsContact CG2-N 3.26Å; T444-C543 WeakPolarHBondContact CG2-SG 3.4Å; C471-C543 WeakPolarHBondContact CA-SG 3.45Å; C471-C543 HydrophobicContact CB-CB 3.74Å; C471-C543 WeakPolarHBondContact CB-SG 3.48Å; C471-C543 WeakPolarHBondContact SG-CB 3.43Å; C471-C543 CovalentContact SG-SG 2.01Å; C471-C543 PolarHBondContact SG-SG 3.43Å; H512-C543 WeakPolarHBondContact O-CA 3.34Å
544	A	83.8	Confident	87.3	Confident	33 Å²	33	31.3 Å²	31.3	27%	0.273	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	169.9	172.7	0	0	0	0	0	110.9	C442 H512 T514	C442-A544 VanDerWaalsContact SG-C 3.53Å; H512-A544 PolarHBondContact N-O 3.45Å; H512-A544 VanDerWaalsContact N-O 3.08Å; H512-A544 PolarHBondContact O-N 3.49Å; H512-A544 VanDerWaalsContact O-N 3.14Å; T514-A544 HydrophobicContact CG2-CB 3.72Å
545	C	82.3	Confident	87	Confident	6 Å²	6	31.8 Å²	31.8	4%	0.041	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	130.9	176	-64.8	0	0	0	0	110.9	C442 C475 S482 C510	C442-C545 WeakPolarHBondContact CB-SG 3.42Å; C475-C545 WeakPolarHBondContact CA-SG 3.49Å; C475-C545 HydrophobicContact CB-CB 3.62Å; C475-C545 WeakPolarHBondContact CB-SG 3.34Å; C475-C545 WeakPolarHBondContact SG-CA 3.32Å; C475-C545 WeakPolarHBondContact SG-CB 3.4Å; C475-C545 CovalentContact SG-SG 2.02Å; C475-C545 PolarHBondContact SG-SG 3.46Å; S482-C545 WeakPolarHBondContact CB-O 3.49Å; S482-C545 PolarHBondContact OG-O 3.47Å; C510-C545 WeakPolarHBondContact O-CA 3.04Å
546	S	75	Confident	86.7	Confident	77 Å²	77	34.6 Å²	34.6	54%	0.538	20%	0.201	S	C	.	.			trans	-151	0	171.7	73.7	0	0	0	0	113	H484 S509 C510	H484-S546 PolarHBondContact CD2-OXT 2.82Å; H484-S546 VanDerWaalsContact CD2-OXT 3.3Å; H484-S546 VanDerWaalsContact CE1-C 3.5Å; H484-S546 PolarHBondContact CE1-OXT 3.15Å; H484-S546 VanDerWaalsContact ND1-C 3.34Å; H484-S546 PolarHBondContact ND1-OXT 3.13Å; H484-S546 PolarHBondContact NE2-OXT 3.02Å; H484-S546 VanDerWaalsContact NE2-OXT 3.11Å; S509-S546 CarbonylContact C-O 3.51Å; S509-S546 WeakPolarHBondContact CA-O 3.24Å; S509-S546 WeakPolarHBondContact CB-O 3.39Å; C510-S546 PolarHBondContact N-O 3.29Å; C510-S546 PolarHBondContact O-N 3.28Å; C510-S546 VanDerWaalsContact O-N 3.11Å

Retrieved 546 of 546 residues in 929.8 ms (Link to these results)

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