A0A2K5MGH9_CERAT Loading...

Prolyl 4-hydroxylase subunit alpha-3

Catalyzes the post-translational formation of 4-hydroxyproline in -Xaa-Pro-Gly- sequences in collagens and other proteins.

AlphaFold DB , UniProt , Accession A0A2K5MGH9, Species CERAT (Cercocebus atys, Sooty mangabey), Gene P4HA3, Length 544 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	44.5	Very low	35	Very low	236 Å²	236	113.2 Å²	113.2	100%	1.163	68%	0.679	S	S	*	*				0	123.6	0	-74.8	177.3	172.3	0	0	108.4
2	G	34.1	Very low	34.9	Very low	49 Å²	49	110.3 Å²	110.3	51%	0.505	68%	0.677	S	S	.	*			trans	-73.9	168.7	-166.8	0	0	0	0	0	115	G4 A5	G2-G4 PolarHBondContact O-N 3.03Å; G2-A5 PolarHBondContact O-N 3.32Å
3	P	32.8	Very low	34.8	Very low	125 Å²	125	110.5 Å²	110.5	81%	0.812	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-15.1	-171.1	-12.8	24.2	0	0	0	114.6
4	G	35.2	Very low	34.5	Very low	63 Å²	63	111.3 Å²	111.3	65%	0.649	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-21.5	177.5	0	0	0	0	0	115.2	G2 R6	G2-G4 PolarHBondContact O-N 3.03Å; G4-R6 VanDerWaalsContact C-N 3.35Å
5	A	34.9	Very low	34.2	Very low	64 Å²	64	109.4 Å²	109.4	53%	0.529	68%	0.675	S	S	.	*	H	α-helix	trans	-79.7	-16.8	-179.9	0	0	0	0	0	113.4	G2	G2-A5 PolarHBondContact O-N 3.32Å
6	R	35.3	Very low	34.6	Very low	211 Å²	211	112.4 Å²	112.4	80%	0.796	68%	0.684	S	S	*	*	H	α-helix	trans	-82.8	-19.3	177.9	-74.5	-174.6	173.8	-175.7	-2.2	113.4	G4	G4-R6 VanDerWaalsContact C-N 3.35Å
7	L	34.9	Very low	34.5	Very low	124 Å²	124	108.8 Å²	108.8	65%	0.649	68%	0.676	S	S	*	*	H	α-helix	trans	-81.5	-31.7	179.2	-145.8	75.6	0	0	0	112.3	L11	L7-L11 PolarHBondContact O-N 2.75Å
8	A	34.6	Very low	34.8	Very low	73 Å²	73	111.3 Å²	111.3	60%	0.603	69%	0.691	S	S	*	*	H	α-helix	trans	-71.8	-32.4	175.6	0	0	0	0	0	112.9
9	A	34	Very low	34.4	Very low	65 Å²	65	109.3 Å²	109.3	54%	0.537	69%	0.694	S	S	.	*	H	α-helix	trans	-76.6	-25	177.6	0	0	0	0	0	113.2
10	L	32.8	Very low	34.1	Very low	111 Å²	111	111 Å²	111	58%	0.581	70%	0.697	S	S	*	*	H	α-helix	trans	-79.1	-29.8	176.7	-132.8	85.9	0	0	0	112.4	V13 L14	L10-V13 PolarHBondContact O-N 3.37Å; L10-L14 HydrophobicContact CD2-CD1 4.27Å; L10-L14 HydrophobicContact CG-CD1 4.46Å; L10-L14 PolarHBondContact O-N 3.44Å
11	L	32.2	Very low	34.1	Very low	124 Å²	124	111.7 Å²	111.7	65%	0.649	70%	0.703	S	S	*	*	H	α-helix	trans	-75.3	-23.7	179.1	-79.7	161.5	0	0	0	113.5	L7	L7-L11 PolarHBondContact O-N 2.75Å
12	A	32.9	Very low	33.4	Very low	78 Å²	78	108.7 Å²	108.7	65%	0.645	69%	0.686	S	S	*	*	H	α-helix	trans	-78.6	-23.1	174.2	0	0	0	0	0	113.5
13	V	34.5	Very low	33.2	Very low	113 Å²	113	117.8 Å²	117.8	69%	0.685	71%	0.705	S	S	*	*	H	α-helix	trans	-93.3	-20.3	179.3	179.4	0	0	0	0	112	L10	L10-V13 PolarHBondContact O-N 3.37Å
14	L	30	Very low	33.1	Very low	122 Å²	122	116.6 Å²	116.6	64%	0.639	71%	0.706	S	S	*	*	S	Bend	trans	-92.4	-1.5	176.1	-76.2	164.3	0	0	0	114.7	L10 L16	L10-L14 HydrophobicContact CD2-CD1 4.27Å; L10-L14 HydrophobicContact CG-CD1 4.46Å; L10-L14 PolarHBondContact O-N 3.44Å; L14-L16 PolarHBondContact O-N 2.92Å
15	A	29.8	Very low	33	Very low	83 Å²	83	118.5 Å²	118.5	69%	0.686	72%	0.716	S	S	*	*	S	Bend	trans	-78.1	12.3	170.1	0	0	0	0	0	113.7
16	L	40.6	Very low	33.2	Very low	157 Å²	157	119.9 Å²	119.9	82%	0.822	73%	0.727	S	S	*	*	S	Bend	trans	-117.6	69.3	168.1	-72.3	168.7	0	0	0	108.5	L14	L14-L16 PolarHBondContact O-N 2.92Å
17	G	34.1	Very low	34	Very low	52 Å²	52	117.7 Å²	117.7	54%	0.536	72%	0.719	S	S	.	*	S	Bend	trans	-172.3	107.1	178.7	0	0	0	0	0	112.7
18	T	39.7	Very low	35.2	Very low	154 Å²	154	114.1 Å²	114.1	95%	0.945	71%	0.712	S	S	*	*			trans	56.3	65.6	161.9	64.4	0	0	0	0	116.4
19	G	27	Very low	36.7	Very low	73 Å²	73	111.7 Å²	111.7	75%	0.753	69%	0.689	S	S	*	*			trans	-96.6	119.4	160.9	0	0	0	0	0	110.3
20	N	28.5	Very low	38.7	Very low	143 Å²	143	109.8 Å²	109.8	77%	0.765	67%	0.671	S	S	*	*			trans	-51.6	132.5	168.9	-150.8	10.5	0	0	0	109.4	E22	N20-E22 PolarHBondContact O-N 2.97Å
21	P	33	Very low	40.7	Very low	126 Å²	126	105.4 Å²	105.4	82%	0.818	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.4	7.9	-166.2	27	-34.4	0	0	0	116
22	E	31	Very low	42.5	Very low	172 Å²	172	99.6 Å²	99.6	80%	0.804	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111	10.9	-169.2	-78.7	-165.8	155.1	0	0	116.3	N20	N20-E22 PolarHBondContact O-N 2.97Å
23	R	29.2	Very low	44.5	Very low	240 Å²	240	95.9 Å²	95.9	91%	0.906	59%	0.586	S	S	*	*	S	Bend	trans	-131.2	109.8	177.9	-79.8	-174.4	168.2	178	-4.5	114.4
24	A	30	Very low	46.6	Very low	101 Å²	101	92.6 Å²	92.6	84%	0.835	57%	0.565	S	S	*	*			trans	70.3	70.9	165.7	0	0	0	0	0	116.2	A26	A24-A26 PolarHBondContact O-N 3.34Å; A24-A26 VanDerWaalsContact O-N 3.15Å
25	A	33.2	Very low	48.7	Very low	103 Å²	103	87.6 Å²	87.6	85%	0.851	54%	0.539	S	S	*	.			trans	-64.3	107.7	150.2	0	0	0	0	0	107.5	R27	A25-R27 PolarHBondContact O-N 3.07Å
26	A	39.3	Very low	51	Low	92 Å²	92	84.1 Å²	84.1	76%	0.76	51%	0.51	S	S	*	.			trans	-52.7	133	167.3	0	0	0	0	0	108.5	A24 G28	A24-A26 PolarHBondContact O-N 3.34Å; A24-A26 VanDerWaalsContact O-N 3.15Å; A26-G28 PolarHBondContact O-N 2.74Å
27	R	53.6	Low	52.9	Low	165 Å²	165	79 Å²	79	62%	0.623	49%	0.485	S	S	*	.			trans	-56.3	104.2	-179.4	-146.1	175.6	-174.1	-173.9	-3.7	107.8	A25 E124 Q125 L127	A25-R27 PolarHBondContact O-N 3.07Å; R27-E124 PolarHBondContact NH2-O 2.81Å; R27-Q125 PolarHBondContact NE-O 3.46Å; R27-Q125 VanDerWaalsContact NE-O 3.12Å; R27-Q125 PolarHBondContact NH2-O 3.19Å; R27-Q125 VanDerWaalsContact NH2-O 3.1Å; R27-L127 PolarHBondContact NH2-O 3.42Å
28	G	60	Low	55.1	Low	50 Å²	50	79.3 Å²	79.3	52%	0.515	48%	0.482	S	S	.	.			trans	-82.5	143.4	178.8	0	0	0	0	0	110	A26	A26-G28 PolarHBondContact O-N 2.74Å
29	D	66.1	Low	57.2	Low	21 Å²	21	77.6 Å²	77.6	11%	0.112	46%	0.458	C	S	.	.			trans	-58.5	138.6	177.5	57.6	-10.2	0	0	0	112.1	F31 S32 D132 R373 K391	D29-F31 HydrophobicContact CB-CD1 3.99Å; D29-F31 HydrophobicContact CB-CE1 3.7Å; D29-S32 PolarHBondContact OD1-OG 3.1Å; D29-S32 VanDerWaalsContact OD2-CB 3.25Å; D29-S32 WeakPolarHBondContact OD2-CB 3.35Å; D29-S32 PolarHBondContact OD2-OG 2.84Å; D29-D132 WeakPolarHBondContact CA-OD1 3.13Å; D29-R373 WeakPolarHBondContact OD2-CD 3.42Å; D29-R373 IonicContact OD2-CZ 2.98Å; D29-R373 VanDerWaalsContact OD2-CZ 3.29Å; D29-R373 IonicContact OD2-NE 3.76Å; D29-R373 PolarHBondContact OD2-NE 3.38Å; D29-R373 VanDerWaalsContact OD2-NE 3.12Å; D29-R373 IonicContact OD2-NH1 3.44Å; D29-R373 IonicContact OD2-NH2 3.82Å; D29-K391 WeakPolarHBondContact O-CE 3.23Å; D29-K391 PolarHBondContact O-NZ 2.72Å; D29-K391 WeakPolarHBondContact OD1-CE 3.26Å; D29-K391 IonicContact OD1-NZ 3.05Å
30	T	75	Confident	59.9	Low	26 Å²	26	75.5 Å²	75.5	16%	0.16	43%	0.434	C	S	.	.	S	Bend	trans	-81.4	-38.5	-174.8	-52.3	0	0	0	0	111.5	S32 S36 V37 A40 P128 D132	T30-S32 VanDerWaalsContact C-N 3.35Å; T30-S32 PolarHBondContact O-N 3.14Å; T30-S36 WeakPolarHBondContact O-CB 3.44Å; T30-V37 HydrophobicContact CG2-CG2 4.33Å; T30-V37 WeakPolarHBondContact O-CG2 3.31Å; T30-A40 HydrophobicContact CG2-CB 4.28Å; T30-P128 HydrophobicContact CG2-CG 4.41Å; T30-D132 PolarHBondContact N-OD1 2.9Å; T30-D132 PolarHBondContact OG1-OD2 3.42Å
31	F	74	Confident	62.7	Low	19 Å²	19	72.5 Å²	72.5	8%	0.083	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-21.9	-171.2	71.8	-84.9	0	0	0	114.4	D29 A33 D132 I389 G432 I433	D29-F31 HydrophobicContact CB-CD1 3.99Å; D29-F31 HydrophobicContact CB-CE1 3.7Å; F31-A33 VanDerWaalsContact C-N 3.27Å; F31-A33 PolarHBondContact O-N 2.96Å; F31-D132 HydrophobicContact CD1-CB 4.44Å; F31-D132 WeakPolarHBondContact CD1-OD1 3.36Å; F31-I389 HydrophobicContact CD2-CG2 4.26Å; F31-I389 HydrophobicContact CE2-CG2 4.16Å; F31-G432 VanDerWaalsContact O-CA 3.26Å; F31-G432 WeakPolarHBondContact O-CA 3.42Å; F31-I433 PolarHBondContact O-N 3.46Å
32	S	70.3	Confident	65.4	Low	2 Å²	2	68 Å²	68	1%	0.014	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-6.5	-170.9	68.3	0	0	0	0	114.8	D29 T30 S390 K391 G432	D29-S32 PolarHBondContact OD1-OG 3.1Å; D29-S32 VanDerWaalsContact OD2-CB 3.25Å; D29-S32 WeakPolarHBondContact OD2-CB 3.35Å; D29-S32 PolarHBondContact OD2-OG 2.84Å; T30-S32 VanDerWaalsContact C-N 3.35Å; T30-S32 PolarHBondContact O-N 3.14Å; S32-S390 CarbonylContact O-C 3.56Å; S32-S390 WeakPolarHBondContact O-CA 3.5Å; S32-K391 WeakPolarHBondContact OG-CE 3.28Å; S32-G432 VanDerWaalsContact O-CA 3.31Å; S32-G432 WeakPolarHBondContact O-CA 3.46Å; S32-G432 PolarHBondContact O-N 2.86Å
33	A	74.9	Confident	68.3	Low	0 Å²	0	60.3 Å²	60.3	0%	0	36%	0.359	C	S	.	.			trans	-150	127.1	177	0	0	0	0	0	110.2	F31 T35 S36 V37 K391 N430	F31-A33 VanDerWaalsContact C-N 3.27Å; F31-A33 PolarHBondContact O-N 2.96Å; A33-T35 PolarHBondContact O-N 2.92Å; A33-S36 WeakPolarHBondContact O-CA 3.27Å; A33-S36 WeakPolarHBondContact O-CB 3.22Å; A33-S36 PolarHBondContact O-N 3.47Å; A33-V37 PolarHBondContact O-N 2.99Å; A33-K391 HydrophobicContact CB-CB 4.18Å; A33-K391 HydrophobicContact CB-CD 3.65Å; A33-K391 HydrophobicContact CB-CG 3.78Å; A33-N430 VanDerWaalsContact CB-OD1 3.24Å; A33-N430 WeakPolarHBondContact CB-OD1 3.26Å
34	L	78.7	Confident	71.3	Confident	44 Å²	44	53.9 Å²	53.9	23%	0.23	34%	0.339	C	S	.	.	H	α-helix	trans	-64.5	-24.9	179.9	-75.7	176.1	0	0	0	113.1	S36 V37 A38 N430 Y431 I433 G518 D519	L34-S36 VanDerWaalsContact C-N 3.27Å; L34-S36 PolarHBondContact O-N 3.14Å; L34-V37 HydrophobicContact CD2-CG2 4.34Å; L34-V37 PolarHBondContact O-N 3.38Å; L34-A38 WeakPolarHBondContact O-CB 3.49Å; L34-A38 PolarHBondContact O-N 2.87Å; L34-N430 PolarHBondContact N-OD1 3.15Å; L34-Y431 PolarHBondContact N-O 2.98Å; L34-I433 HydrophobicContact CD2-CG1 3.82Å; L34-G518 WeakPolarHBondContact CD1-O 3.34Å; L34-D519 HydrophobicContact CD1-CB 4.38Å
35	T	74.8	Confident	74.3	Confident	17 Å²	17	57.6 Å²	57.6	10%	0.104	33%	0.332	C	S	.	.	H	α-helix	trans	-59.9	-37.4	167.2	44.4	0	0	0	0	113.3	A33 A38 R39 N430 W521	A33-T35 PolarHBondContact O-N 2.92Å; T35-A38 PolarHBondContact O-N 3.09Å; T35-R39 WeakPolarHBondContact O-CG 3.29Å; T35-R39 PolarHBondContact O-N 3.34Å; T35-N430 PolarHBondContact N-OD1 3.35Å; T35-N430 PolarHBondContact OG1-OD1 2.99Å; T35-W521 HydrophobicContact CG2-CH2 4.19Å; T35-W521 HydrophobicContact CG2-CZ2 3.36Å
36	S	78.1	Confident	77.2	Confident	10 Å²	10	57.9 Å²	57.9	7%	0.07	31%	0.311	C	S	.	.	H	α-helix	trans	-71	-40	178.4	-57.5	0	0	0	0	110.7	T30 A33 L34 A38 R39 A40 K391	T30-S36 WeakPolarHBondContact O-CB 3.44Å; A33-S36 WeakPolarHBondContact O-CA 3.27Å; A33-S36 WeakPolarHBondContact O-CB 3.22Å; A33-S36 PolarHBondContact O-N 3.47Å; L34-S36 VanDerWaalsContact C-N 3.27Å; L34-S36 PolarHBondContact O-N 3.14Å; S36-A38 PolarHBondContact O-N 3.11Å; S36-R39 PolarHBondContact O-N 3.44Å; S36-A40 PolarHBondContact O-N 3.4Å; S36-K391 PolarHBondContact OG-NZ 2.95Å
37	V	80.3	Confident	79.9	Confident	50 Å²	50	55.5 Å²	55.5	30%	0.303	29%	0.285	S	S	.	.	H	α-helix	trans	-58.9	-45.6	170.3	-177.7	0	0	0	0	111.2	T30 A33 L34 R39 A40 I433	T30-V37 HydrophobicContact CG2-CG2 4.33Å; T30-V37 WeakPolarHBondContact O-CG2 3.31Å; A33-V37 PolarHBondContact O-N 2.99Å; L34-V37 HydrophobicContact CD2-CG2 4.34Å; L34-V37 PolarHBondContact O-N 3.38Å; V37-R39 VanDerWaalsContact C-N 3.29Å; V37-R39 PolarHBondContact O-N 2.99Å; V37-A40 VanDerWaalsContact O-CB 3.3Å; V37-A40 WeakPolarHBondContact O-CB 3.48Å; V37-A40 PolarHBondContact O-N 3.13Å; V37-I433 HydrophobicContact CG2-CD1 4.06Å; V37-I433 HydrophobicContact CG2-CG1 4.22Å
38	A	81.4	Confident	82	Confident	58 Å²	58	52.2 Å²	52.2	48%	0.479	28%	0.279	S	S	.	.	H	α-helix	trans	-62	-35.2	178.2	0	0	0	0	0	112.6	L34 T35 S36 A40 L41	L34-A38 WeakPolarHBondContact O-CB 3.49Å; L34-A38 PolarHBondContact O-N 2.87Å; T35-A38 PolarHBondContact O-N 3.09Å; S36-A38 PolarHBondContact O-N 3.11Å; A38-A40 VanDerWaalsContact C-N 3.31Å; A38-A40 PolarHBondContact O-N 3.45Å; A38-L41 WeakPolarHBondContact O-CB 3.34Å; A38-L41 WeakPolarHBondContact O-CG 3.29Å; A38-L41 PolarHBondContact O-N 3.13Å
39	R	82.4	Confident	83.7	Confident	117 Å²	117	51 Å²	51	44%	0.442	27%	0.267	S	S	.	.	H	α-helix	trans	-66.6	-30	174.3	-71.1	177.7	-145.8	152.4	2.8	112.8	T35 S36 V37 L41 G42 P43 E368	T35-R39 WeakPolarHBondContact O-CG 3.29Å; T35-R39 PolarHBondContact O-N 3.34Å; S36-R39 PolarHBondContact O-N 3.44Å; V37-R39 VanDerWaalsContact C-N 3.29Å; V37-R39 PolarHBondContact O-N 2.99Å; R39-L41 PolarHBondContact O-N 3.33Å; R39-G42 PolarHBondContact O-N 2.81Å; R39-P43 VanDerWaalsContact O-CD 3.27Å; R39-P43 WeakPolarHBondContact O-CD 3.37Å; R39-E368 IonicContact CZ-OE1 3.52Å; R39-E368 IonicContact NE-OE1 3.95Å; R39-E368 PolarHBondContact NE-OE1 2.79Å; R39-E368 IonicContact NH2-OE1 3.36Å; R39-E368 PolarHBondContact NH2-OE1 3.16Å
40	A	84.8	Confident	85.2	Confident	30 Å²	30	51.1 Å²	51.1	25%	0.248	27%	0.267	C	S	.	.	H	α-helix	trans	-63.4	-19.2	177.9	0	0	0	0	0	113.3	T30 S36 V37 A38 G42 P43 E44 P128	T30-A40 HydrophobicContact CG2-CB 4.28Å; S36-A40 PolarHBondContact O-N 3.4Å; V37-A40 VanDerWaalsContact O-CB 3.3Å; V37-A40 WeakPolarHBondContact O-CB 3.48Å; V37-A40 PolarHBondContact O-N 3.13Å; A38-A40 VanDerWaalsContact C-N 3.31Å; A38-A40 PolarHBondContact O-N 3.45Å; A40-G42 PolarHBondContact O-N 2.94Å; A40-P43 VanDerWaalsContact O-CD 3.31Å; A40-P43 WeakPolarHBondContact O-CD 3.32Å; A40-E44 PolarHBondContact O-N 3.43Å; A40-P128 HydrophobicContact CB-CG 4.44Å
41	L	87.3	Confident	86.3	Confident	80 Å²	80	53.5 Å²	53.5	42%	0.419	28%	0.279	S	S	.	.	H	α-helix	trans	-63	-25.6	170.6	-62.6	175	0	0	0	113	A38 R39 R45	A38-L41 WeakPolarHBondContact O-CB 3.34Å; A38-L41 WeakPolarHBondContact O-CG 3.29Å; A38-L41 PolarHBondContact O-N 3.13Å; R39-L41 PolarHBondContact O-N 3.33Å; L41-R45 WeakPolarHBondContact O-CB 3.24Å; L41-R45 VanDerWaalsContact O-CG 3.25Å; L41-R45 WeakPolarHBondContact O-CG 3.47Å; L41-R45 PolarHBondContact O-N 2.77Å
42	G	88.8	Confident	87.4	Confident	30 Å²	30	60.3 Å²	60.3	31%	0.309	30%	0.304	S	S	.	.	H	α-helix	trans	-63.2	-58.8	178	0	0	0	0	0	112.4	R39 A40 E44 R45 R46	R39-G42 PolarHBondContact O-N 2.81Å; A40-G42 PolarHBondContact O-N 2.94Å; G42-E44 VanDerWaalsContact C-N 3.33Å; G42-E44 PolarHBondContact O-N 3.23Å; G42-R45 PolarHBondContact O-N 3.48Å; G42-R46 PolarHBondContact O-N 2.86Å
43	P	91.1	Very high	88.7	Confident	11 Å²	11	67.6 Å²	67.6	7%	0.071	33%	0.331	C	S	.	.	H	α-helix	trans	-49.8	-47.7	170.2	-30.4	35.5	0	0	0	113.9	R39 A40 R45 R46 L47 V123 D126 L127	R39-P43 VanDerWaalsContact O-CD 3.27Å; R39-P43 WeakPolarHBondContact O-CD 3.37Å; A40-P43 VanDerWaalsContact O-CD 3.31Å; A40-P43 WeakPolarHBondContact O-CD 3.32Å; P43-R45 PolarHBondContact O-N 3.48Å; P43-R46 WeakPolarHBondContact O-CA 3.45Å; P43-R46 WeakPolarHBondContact O-CB 3.38Å; P43-R46 PolarHBondContact O-N 3.44Å; P43-L47 PolarHBondContact O-N 3.05Å; P43-V123 HydrophobicContact CB-CG1 3.68Å; P43-D126 HydrophobicContact CB-CB 4.35Å; P43-D126 HydrophobicContact CG-CB 3.7Å; P43-L127 HydrophobicContact CB-CD2 3.76Å
44	E	92.8	Very high	89.8	Confident	105 Å²	105	70.4 Å²	70.4	49%	0.491	34%	0.342	S	S	.	.	H	α-helix	trans	-59.6	-44.4	179.4	-172.6	-175.2	-152.2	0	0	112.2	A40 G42 R46 L47 L48	A40-E44 PolarHBondContact O-N 3.43Å; G42-E44 VanDerWaalsContact C-N 3.33Å; G42-E44 PolarHBondContact O-N 3.23Å; E44-R46 PolarHBondContact O-N 3.28Å; E44-L47 WeakPolarHBondContact O-CB 3.43Å; E44-L47 PolarHBondContact O-N 3.01Å; E44-L47 VanDerWaalsContact O-N 3.08Å; E44-L48 WeakPolarHBondContact O-CG 3.35Å; E44-L48 PolarHBondContact O-N 3.17Å
45	R	93.9	Very high	90.7	Very high	180 Å²	180	72.4 Å²	72.4	68%	0.679	35%	0.352	S	S	*	.	H	α-helix	trans	-58.7	-34.6	174.7	-75.2	173.3	-173	177.2	4.7	112.8	L41 G42 P43 G49	L41-R45 WeakPolarHBondContact O-CB 3.24Å; L41-R45 VanDerWaalsContact O-CG 3.25Å; L41-R45 WeakPolarHBondContact O-CG 3.47Å; L41-R45 PolarHBondContact O-N 2.77Å; G42-R45 PolarHBondContact O-N 3.48Å; P43-R45 PolarHBondContact O-N 3.48Å; R45-G49 PolarHBondContact O-N 3.05Å; R45-G49 VanDerWaalsContact O-N 3.14Å
46	R	94.4	Very high	91.8	Very high	109 Å²	109	79.2 Å²	79.2	41%	0.411	38%	0.376	S	S	.	.	H	α-helix	trans	-69.7	-42	174.9	-64.5	-171.2	-60.7	-108.2	8.2	111.3	G42 P43 E44 G49 L50 V123 D126	G42-R46 PolarHBondContact O-N 2.86Å; P43-R46 WeakPolarHBondContact O-CA 3.45Å; P43-R46 WeakPolarHBondContact O-CB 3.38Å; P43-R46 PolarHBondContact O-N 3.44Å; E44-R46 PolarHBondContact O-N 3.28Å; R46-G49 WeakPolarHBondContact O-CA 3.39Å; R46-G49 PolarHBondContact O-N 3.29Å; R46-G49 VanDerWaalsContact O-N 3.14Å; R46-L50 PolarHBondContact O-N 2.85Å; R46-V123 HydrophobicContact CB-CG2 4.38Å; R46-D126 IonicContact CZ-OD2 2.69Å; R46-D126 IonicContact NH2-OD2 3.95Å; R46-D126 PolarHBondContact NH2-OD2 2.93Å
47	L	95.9	Very high	92.7	Very high	41 Å²	41	79.7 Å²	79.7	22%	0.215	38%	0.382	C	S	.	.	H	α-helix	trans	-60.8	-42.7	174	-67.5	179.5	0	0	0	111.7	P43 E44 G49 L50 L51 Y120 V123 L127	P43-L47 PolarHBondContact O-N 3.05Å; E44-L47 WeakPolarHBondContact O-CB 3.43Å; E44-L47 PolarHBondContact O-N 3.01Å; E44-L47 VanDerWaalsContact O-N 3.08Å; L47-G49 VanDerWaalsContact C-N 3.27Å; L47-G49 PolarHBondContact O-N 3.01Å; L47-L50 HydrophobicContact CD2-CD1 4.15Å; L47-L50 WeakPolarHBondContact O-CB 3.35Å; L47-L50 PolarHBondContact O-N 3.12Å; L47-L50 VanDerWaalsContact O-N 3.07Å; L47-L51 WeakPolarHBondContact O-CB 3.29Å; L47-L51 PolarHBondContact O-N 2.85Å; L47-Y120 HydrophobicContact CD1-CD2 4.47Å; L47-Y120 HydrophobicContact CD1-CE2 4.49Å; L47-Y120 HydrophobicContact CD2-CD2 3.76Å; L47-V123 HydrophobicContact CD2-CB 4.24Å; L47-V123 HydrophobicContact CD2-CG1 4.29Å; L47-V123 HydrophobicContact CG-CG1 4.25Å; L47-L127 HydrophobicContact CD1-CD1 4.31Å; L47-L127 HydrophobicContact CD1-CD2 4Å
48	L	96.4	Very high	93.5	Very high	97 Å²	97	78.4 Å²	78.4	51%	0.508	37%	0.373	S	S	.	.	H	α-helix	trans	-58.5	-39.7	172.9	-70.7	175.8	0	0	0	112.1	E44 R52	E44-L48 WeakPolarHBondContact O-CG 3.35Å; E44-L48 PolarHBondContact O-N 3.17Å; L48-R52 VanDerWaalsContact O-CB 3.26Å; L48-R52 WeakPolarHBondContact O-CB 3.47Å; L48-R52 PolarHBondContact O-N 2.75Å
49	G	96.9	Very high	94.3	Very high	25 Å²	25	80.5 Å²	80.5	26%	0.258	37%	0.373	S	S	.	.	H	α-helix	trans	-64.6	-38.9	174	0	0	0	0	0	113.3	R45 R46 L47 R53	R45-G49 PolarHBondContact O-N 3.05Å; R45-G49 VanDerWaalsContact O-N 3.14Å; R46-G49 WeakPolarHBondContact O-CA 3.39Å; R46-G49 PolarHBondContact O-N 3.29Å; R46-G49 VanDerWaalsContact O-N 3.14Å; L47-G49 VanDerWaalsContact C-N 3.27Å; L47-G49 PolarHBondContact O-N 3.01Å; G49-R53 PolarHBondContact O-N 2.86Å
50	L	97	Very high	95	Very high	22 Å²	22	76.5 Å²	76.5	12%	0.115	37%	0.365	C	S	.	.	H	α-helix	trans	-67.6	-48.9	175.5	-74.6	163.5	0	0	0	111.7	R46 L47 R52 R53 Y54 L116 G119	R46-L50 PolarHBondContact O-N 2.85Å; L47-L50 HydrophobicContact CD2-CD1 4.15Å; L47-L50 WeakPolarHBondContact O-CB 3.35Å; L47-L50 PolarHBondContact O-N 3.12Å; L47-L50 VanDerWaalsContact O-N 3.07Å; L50-R52 VanDerWaalsContact C-N 3.32Å; L50-R52 PolarHBondContact O-N 3.41Å; L50-R53 WeakPolarHBondContact O-CB 3.23Å; L50-R53 PolarHBondContact O-N 3.48Å; L50-R53 VanDerWaalsContact O-N 3.08Å; L50-Y54 PolarHBondContact O-N 3.39Å; L50-L116 HydrophobicContact CB-CD1 3.85Å; L50-G119 VanDerWaalsContact CD1-C 3.49Å; L50-G119 WeakPolarHBondContact CD1-O 3.44Å
51	L	97.3	Very high	95.6	Very high	77 Å²	77	78.1 Å²	78.1	40%	0.403	37%	0.365	S	S	.	.	H	α-helix	trans	-60.4	-42.2	177.8	-177.2	60.4	0	0	0	111.2	L47 R53 Y54 L55 L116	L47-L51 WeakPolarHBondContact O-CB 3.29Å; L47-L51 PolarHBondContact O-N 2.85Å; L51-R53 VanDerWaalsContact C-N 3.29Å; L51-R53 PolarHBondContact O-N 3.36Å; L51-Y54 HydrophobicContact CD1-CD1 4.19Å; L51-Y54 WeakPolarHBondContact O-CB 3.45Å; L51-Y54 PolarHBondContact O-N 2.86Å; L51-L55 HydrophobicContact CD1-CG 4.34Å; L51-L55 HydrophobicContact CG-CD1 4.17Å; L51-L55 HydrophobicContact CG-CG 4.4Å; L51-L55 VanDerWaalsContact O-CG 3.31Å; L51-L55 WeakPolarHBondContact O-CG 3.42Å; L51-L55 PolarHBondContact O-N 3.29Å; L51-L116 HydrophobicContact CD1-CD2 4.42Å
52	R	98	Very high	96	Very high	161 Å²	161	78.6 Å²	78.6	61%	0.608	37%	0.367	S	S	*	.	H	α-helix	trans	-59.7	-37.9	174.8	-176	-179	-68.5	172.4	-1.3	112.6	L48 L50 R56	L48-R52 VanDerWaalsContact O-CB 3.26Å; L48-R52 WeakPolarHBondContact O-CB 3.47Å; L48-R52 PolarHBondContact O-N 2.75Å; L50-R52 VanDerWaalsContact C-N 3.32Å; L50-R52 PolarHBondContact O-N 3.41Å; R52-R56 WeakPolarHBondContact O-CG 3.49Å; R52-R56 PolarHBondContact O-N 3.18Å
53	R	97.5	Very high	96.5	Very high	155 Å²	155	84.1 Å²	84.1	59%	0.585	38%	0.379	S	S	*	.	H	α-helix	trans	-68.1	-44.7	175.6	-76.6	-173.1	-69.9	-94.2	3.6	111.3	G49 L50 L51 R56 G57	G49-R53 PolarHBondContact O-N 2.86Å; L50-R53 WeakPolarHBondContact O-CB 3.23Å; L50-R53 PolarHBondContact O-N 3.48Å; L50-R53 VanDerWaalsContact O-N 3.08Å; L51-R53 VanDerWaalsContact C-N 3.29Å; L51-R53 PolarHBondContact O-N 3.36Å; R53-R56 PolarHBondContact O-N 2.9Å; R53-G57 PolarHBondContact O-N 3.28Å
54	Y	97.8	Very high	96.7	Very high	59 Å²	59	86.7 Å²	86.7	23%	0.231	39%	0.392	C	S	.	.	H	α-helix	trans	-57.2	-50.8	175.7	172.5	-105.7	0	0	0	111.7	L50 L51 R56 G57 E58 N112 I113 L116	L50-Y54 PolarHBondContact O-N 3.39Å; L51-Y54 HydrophobicContact CD1-CD1 4.19Å; L51-Y54 WeakPolarHBondContact O-CB 3.45Å; L51-Y54 PolarHBondContact O-N 2.86Å; Y54-R56 VanDerWaalsContact C-N 3.34Å; Y54-R56 PolarHBondContact O-N 2.97Å; Y54-G57 WeakPolarHBondContact O-CA 3.41Å; Y54-G57 PolarHBondContact O-N 3.26Å; Y54-E58 HydrophobicContact CD2-CG 4.25Å; Y54-E58 HydrophobicContact CE1-CG 4.02Å; Y54-E58 HydrophobicContact CE2-CG 3.7Å; Y54-E58 PolarHBondContact O-N 2.98Å; Y54-N112 HydrophobicContact CD2-CB 3.97Å; Y54-N112 WeakPolarHBondContact CD2-O 3.45Å; Y54-N112 HydrophobicContact CE2-CB 4.03Å; Y54-I113 HydrophobicContact CE2-CB 4.04Å; Y54-I113 HydrophobicContact CE2-CD1 3.95Å; Y54-L116 HydrophobicContact CD1-CD2 3.93Å; Y54-L116 HydrophobicContact CD2-CB 4.22Å; Y54-L116 HydrophobicContact CD2-CD2 4.21Å; Y54-L116 HydrophobicContact CE1-CD2 4.43Å; Y54-L116 HydrophobicContact CG-CB 4.33Å; Y54-L116 HydrophobicContact CG-CD2 3.79Å
55	L	97.8	Very high	96.9	Very high	86 Å²	86	84.4 Å²	84.4	45%	0.45	38%	0.383	S	S	.	.	H	α-helix	trans	-57.5	-44.8	178.7	-69.9	172.7	0	0	0	112	L51 G57 E58 E59	L51-L55 HydrophobicContact CD1-CG 4.34Å; L51-L55 HydrophobicContact CG-CD1 4.17Å; L51-L55 HydrophobicContact CG-CG 4.4Å; L51-L55 VanDerWaalsContact O-CG 3.31Å; L51-L55 WeakPolarHBondContact O-CG 3.42Å; L51-L55 PolarHBondContact O-N 3.29Å; L55-G57 VanDerWaalsContact C-N 3.31Å; L55-G57 PolarHBondContact O-N 3.4Å; L55-E58 PolarHBondContact O-N 3.27Å; L55-E59 WeakPolarHBondContact O-CB 3.36Å; L55-E59 VanDerWaalsContact O-CG 3.29Å; L55-E59 WeakPolarHBondContact O-CG 3.35Å; L55-E59 PolarHBondContact O-N 3.43Å
56	R	97.6	Very high	97	Very high	161 Å²	161	79.4 Å²	79.4	61%	0.608	37%	0.372	S	S	*	.	H	α-helix	trans	-62.7	-37.5	175.7	-74.2	177.4	-179.1	-175.4	-0.8	113	R52 R53 Y54 A60	R52-R56 WeakPolarHBondContact O-CG 3.49Å; R52-R56 PolarHBondContact O-N 3.18Å; R53-R56 PolarHBondContact O-N 2.9Å; Y54-R56 VanDerWaalsContact C-N 3.34Å; Y54-R56 PolarHBondContact O-N 2.97Å; R56-A60 WeakPolarHBondContact O-CB 3.26Å; R56-A60 PolarHBondContact O-N 2.98Å
57	G	97.4	Very high	97.2	Very high	19 Å²	19	81.6 Å²	81.6	20%	0.196	38%	0.381	C	S	.	.	H	α-helix	trans	-64.9	-46.3	175.8	0	0	0	0	0	111.7	R53 Y54 L55 A60 R61 N112	R53-G57 PolarHBondContact O-N 3.28Å; Y54-G57 WeakPolarHBondContact O-CA 3.41Å; Y54-G57 PolarHBondContact O-N 3.26Å; L55-G57 VanDerWaalsContact C-N 3.31Å; L55-G57 PolarHBondContact O-N 3.4Å; G57-A60 PolarHBondContact O-N 3.09Å; G57-R61 WeakPolarHBondContact O-CB 3.5Å; G57-R61 PolarHBondContact O-N 3.34Å; G57-N112 PolarHBondContact O-ND2 2.92Å
58	E	97.8	Very high	97.1	Very high	23 Å²	23	80.9 Å²	80.9	11%	0.107	38%	0.376	C	S	.	.	H	α-helix	trans	-65.8	-42.2	176.8	-74.1	-55.2	121.6	0	0	112.4	Y54 L55 A60 R61 L62 N112	Y54-E58 HydrophobicContact CD2-CG 4.25Å; Y54-E58 HydrophobicContact CE1-CG 4.02Å; Y54-E58 HydrophobicContact CE2-CG 3.7Å; Y54-E58 PolarHBondContact O-N 2.98Å; L55-E58 PolarHBondContact O-N 3.27Å; E58-A60 VanDerWaalsContact C-N 3.32Å; E58-A60 PolarHBondContact O-N 3.44Å; E58-R61 PolarHBondContact O-N 3.43Å; E58-R61 IonicContact OE1-NE 2.81Å; E58-R61 PolarHBondContact OE1-NE 3.01Å; E58-R61 IonicContact OE2-CZ 3.19Å; E58-R61 IonicContact OE2-NE 3.25Å; E58-R61 PolarHBondContact OE2-NE 2.83Å; E58-R61 IonicContact OE2-NH2 2.63Å; E58-R61 PolarHBondContact OE2-NH2 3.12Å; E58-L62 WeakPolarHBondContact O-CB 3.41Å; E58-L62 VanDerWaalsContact O-CG 3.3Å; E58-L62 WeakPolarHBondContact O-CG 3.48Å; E58-L62 PolarHBondContact O-N 3.2Å; E58-N112 PolarHBondContact N-ND2 3.33Å; E58-N112 VanDerWaalsContact OE1-CB 3.28Å; E58-N112 WeakPolarHBondContact OE1-CB 3.37Å; E58-N112 PolarHBondContact OE1-ND2 2.81Å
59	E	97.8	Very high	97.1	Very high	103 Å²	103	82.9 Å²	82.9	48%	0.481	38%	0.377	S	S	.	.	H	α-helix	trans	-60.9	-40.4	174.1	-75	174.7	-174.9	0	0	112.1	L55 R63	L55-E59 WeakPolarHBondContact O-CB 3.36Å; L55-E59 VanDerWaalsContact O-CG 3.29Å; L55-E59 WeakPolarHBondContact O-CG 3.35Å; L55-E59 PolarHBondContact O-N 3.43Å; E59-R63 WeakPolarHBondContact O-CB 3.36Å; E59-R63 VanDerWaalsContact O-CG 3.26Å; E59-R63 WeakPolarHBondContact O-CG 3.48Å; E59-R63 PolarHBondContact O-N 3.31Å; E59-R63 IonicContact OE2-NH1 3.75Å
60	A	96.9	Very high	97	Very high	33 Å²	33	85.5 Å²	85.5	27%	0.273	39%	0.386	S	S	.	.	H	α-helix	trans	-64	-48.6	176.3	0	0	0	0	0	111.5	R56 G57 E58 L62 R63 D64	R56-A60 WeakPolarHBondContact O-CB 3.26Å; R56-A60 PolarHBondContact O-N 2.98Å; G57-A60 PolarHBondContact O-N 3.09Å; E58-A60 VanDerWaalsContact C-N 3.32Å; E58-A60 PolarHBondContact O-N 3.44Å; A60-L62 VanDerWaalsContact C-N 3.35Å; A60-L62 PolarHBondContact O-N 3.04Å; A60-R63 VanDerWaalsContact CA-NH2 3.27Å; A60-R63 WeakPolarHBondContact O-CB 3.35Å; A60-R63 PolarHBondContact O-N 2.98Å; A60-D64 PolarHBondContact O-N 3.42Å
61	R	96.3	Very high	96.7	Very high	63 Å²	63	89.8 Å²	89.8	24%	0.238	40%	0.403	C	S	.	.	H	α-helix	trans	-55.6	-49.1	175.5	-176.6	-179	77.8	97.3	-2.3	111.5	G57 E58 D64 L65 E108 A109	G57-R61 WeakPolarHBondContact O-CB 3.5Å; G57-R61 PolarHBondContact O-N 3.34Å; E58-R61 PolarHBondContact O-N 3.43Å; E58-R61 IonicContact OE1-NE 2.81Å; E58-R61 PolarHBondContact OE1-NE 3.01Å; E58-R61 IonicContact OE2-CZ 3.19Å; E58-R61 IonicContact OE2-NE 3.25Å; E58-R61 PolarHBondContact OE2-NE 2.83Å; E58-R61 IonicContact OE2-NH2 2.63Å; E58-R61 PolarHBondContact OE2-NH2 3.12Å; R61-D64 PolarHBondContact O-N 3.44Å; R61-L65 HydrophobicContact CG-CD1 4.21Å; R61-L65 WeakPolarHBondContact O-CG 3.39Å; R61-L65 PolarHBondContact O-N 3.27Å; R61-E108 HydrophobicContact CG-CB 4.19Å; R61-A109 VanDerWaalsContact CZ-CB 3.46Å
62	L	97.6	Very high	96.4	Very high	91 Å²	91	86.9 Å²	86.9	48%	0.476	39%	0.389	S	S	.	.	H	α-helix	trans	-63.4	-41.6	178.6	-72.2	175.3	0	0	0	111.7	E58 A60 D64 L65 T66	E58-L62 WeakPolarHBondContact O-CB 3.41Å; E58-L62 VanDerWaalsContact O-CG 3.3Å; E58-L62 WeakPolarHBondContact O-CG 3.48Å; E58-L62 PolarHBondContact O-N 3.2Å; A60-L62 VanDerWaalsContact C-N 3.35Å; A60-L62 PolarHBondContact O-N 3.04Å; L62-D64 VanDerWaalsContact C-N 3.34Å; L62-D64 PolarHBondContact O-N 3.22Å; L62-L65 PolarHBondContact O-N 3.46Å; L62-T66 WeakPolarHBondContact O-CB 3.29Å; L62-T66 PolarHBondContact O-N 3Å; L62-T66 PolarHBondContact O-OG1 3.33Å
63	R	97.6	Very high	96	Very high	146 Å²	146	82.2 Å²	82.2	55%	0.551	38%	0.376	S	S	*	.	H	α-helix	trans	-59.3	-43	173.9	-77.4	-172.7	-56.2	-96.2	0.7	112.4	E59 A60 R67	E59-R63 WeakPolarHBondContact O-CB 3.36Å; E59-R63 VanDerWaalsContact O-CG 3.26Å; E59-R63 WeakPolarHBondContact O-CG 3.48Å; E59-R63 PolarHBondContact O-N 3.31Å; E59-R63 IonicContact OE2-NH1 3.75Å; A60-R63 VanDerWaalsContact CA-NH2 3.27Å; A60-R63 WeakPolarHBondContact O-CB 3.35Å; A60-R63 PolarHBondContact O-N 2.98Å; R63-R67 WeakPolarHBondContact O-CB 3.3Å; R63-R67 PolarHBondContact O-N 2.86Å
64	D	95.8	Very high	95.5	Very high	64 Å²	64	77.7 Å²	77.7	34%	0.342	37%	0.367	S	S	.	.	H	α-helix	trans	-67.2	-37.5	179	-80.3	-45	0	0	0	112.3	A60 R61 L62 R67 F68	A60-D64 PolarHBondContact O-N 3.42Å; R61-D64 PolarHBondContact O-N 3.44Å; L62-D64 VanDerWaalsContact C-N 3.34Å; L62-D64 PolarHBondContact O-N 3.22Å; D64-R67 IonicContact OD1-CZ 3.05Å; D64-R67 IonicContact OD1-NH1 2.75Å; D64-R67 PolarHBondContact OD1-NH1 2.84Å; D64-R67 IonicContact OD1-NH2 2.86Å; D64-R67 PolarHBondContact OD1-NH2 3.43Å; D64-F68 PolarHBondContact O-N 3.41Å
65	L	96.6	Very high	94.8	Very high	57 Å²	57	78.6 Å²	78.6	30%	0.298	38%	0.376	S	S	.	.	H	α-helix	trans	-66.7	-46.9	173.8	-72	173.2	0	0	0	112.2	R61 L62 F68 Y69 V103	R61-L65 HydrophobicContact CG-CD1 4.21Å; R61-L65 WeakPolarHBondContact O-CG 3.39Å; R61-L65 PolarHBondContact O-N 3.27Å; L62-L65 PolarHBondContact O-N 3.46Å; L65-F68 WeakPolarHBondContact O-CB 3.33Å; L65-F68 PolarHBondContact O-N 2.99Å; L65-F68 VanDerWaalsContact O-N 3.17Å; L65-Y69 WeakPolarHBondContact O-CB 3.46Å; L65-Y69 PolarHBondContact O-N 3.42Å; L65-V103 HydrophobicContact CD2-CG1 3.52Å
66	T	97.3	Very high	93.9	Very high	75 Å²	75	79.2 Å²	79.2	46%	0.46	38%	0.376	S	S	.	.	H	α-helix	trans	-60.3	-46.4	176.2	-61.3	0	0	0	0	110.6	L62 F68 Y69 D70	L62-T66 WeakPolarHBondContact O-CB 3.29Å; L62-T66 PolarHBondContact O-N 3Å; L62-T66 PolarHBondContact O-OG1 3.33Å; T66-F68 VanDerWaalsContact C-N 3.28Å; T66-F68 PolarHBondContact O-N 3.37Å; T66-Y69 WeakPolarHBondContact O-CB 3.42Å; T66-Y69 PolarHBondContact O-N 3.25Å; T66-Y69 VanDerWaalsContact O-N 3.12Å; T66-D70 WeakPolarHBondContact CG2-OD2 3.38Å; T66-D70 VanDerWaalsContact O-CG 3.25Å; T66-D70 PolarHBondContact O-N 2.9Å
67	R	97	Very high	92.6	Very high	156 Å²	156	78.2 Å²	78.2	59%	0.589	38%	0.379	S	S	*	.	H	α-helix	trans	-56.2	-43.1	174.3	-178.5	-162.7	64.9	-146	-14.1	111.9	R63 D64 K71	R63-R67 WeakPolarHBondContact O-CB 3.3Å; R63-R67 PolarHBondContact O-N 2.86Å; D64-R67 IonicContact OD1-CZ 3.05Å; D64-R67 IonicContact OD1-NH1 2.75Å; D64-R67 PolarHBondContact OD1-NH1 2.84Å; D64-R67 IonicContact OD1-NH2 2.86Å; D64-R67 PolarHBondContact OD1-NH2 3.43Å; R67-K71 VanDerWaalsContact O-CB 3.29Å; R67-K71 WeakPolarHBondContact O-CB 3.48Å; R67-K71 PolarHBondContact O-N 3.29Å; R67-K71 VanDerWaalsContact O-N 3.13Å
68	F	95.6	Very high	90.9	Very high	25 Å²	25	83.1 Å²	83.1	11%	0.11	40%	0.4	C	S	.	.	H	α-helix	trans	-65.2	-45	177.1	176.3	-100.6	0	0	0	111.6	D64 L65 T66 K71 V72 D99 W100 V103	D64-F68 PolarHBondContact O-N 3.41Å; L65-F68 WeakPolarHBondContact O-CB 3.33Å; L65-F68 PolarHBondContact O-N 2.99Å; L65-F68 VanDerWaalsContact O-N 3.17Å; T66-F68 VanDerWaalsContact C-N 3.28Å; T66-F68 PolarHBondContact O-N 3.37Å; F68-K71 PolarHBondContact O-N 3.27Å; F68-V72 HydrophobicContact CD1-CG2 4.47Å; F68-V72 HydrophobicContact CD2-CG2 4.44Å; F68-V72 HydrophobicContact CE1-CG2 4.06Å; F68-V72 HydrophobicContact CE2-CG2 4Å; F68-V72 HydrophobicContact CZ-CG2 3.81Å; F68-V72 WeakPolarHBondContact O-CG2 3.48Å; F68-V72 PolarHBondContact O-N 2.96Å; F68-D99 HydrophobicContact CE2-CB 3.83Å; F68-D99 HydrophobicContact CZ-CB 4.43Å; F68-W100 AromaticContact CE1-CD2 3.86Å; F68-W100 HydrophobicContact CE1-CD2 3.86Å; F68-W100 AromaticContact CE1-CE2 3.93Å; F68-W100 AromaticContact CE1-CE3 3.87Å; F68-W100 HydrophobicContact CE1-CE3 3.87Å; F68-W100 HydrophobicContact CE1-CH2 4.03Å; F68-W100 HydrophobicContact CE1-CZ2 4.03Å; F68-W100 AromaticContact CE1-CZ3 3.95Å; F68-W100 HydrophobicContact CE1-CZ3 3.95Å; F68-W100 AromaticContact CZ-CD2 3.87Å; F68-W100 HydrophobicContact CZ-CD2 3.87Å; F68-W100 AromaticContact CZ-CE2 3.94Å; F68-W100 HydrophobicContact CZ-CE3 4.3Å; F68-W100 HydrophobicContact CZ-CG 4.1Å; F68-W100 HydrophobicContact CZ-CZ2 4.43Å; F68-V103 HydrophobicContact CB-CG2 4.47Å; F68-V103 HydrophobicContact CD1-CG1 4.42Å; F68-V103 HydrophobicContact CD1-CG2 3.72Å; F68-V103 HydrophobicContact CD2-CG2 4.11Å; F68-V103 HydrophobicContact CE1-CB 4.45Å; F68-V103 HydrophobicContact CE1-CG2 3.89Å; F68-V103 HydrophobicContact CE2-CG2 4.28Å; F68-V103 HydrophobicContact CG-CG2 3.83Å; F68-V103 HydrophobicContact CZ-CG2 4.16Å
69	Y	95.4	Very high	89	Confident	139 Å²	139	86.8 Å²	86.8	55%	0.545	43%	0.429	S	S	.	.	H	α-helix	trans	-57.9	-53	176.6	171.4	-98.9	0	0	0	111.8	L65 T66 K71 V72 L73	L65-Y69 WeakPolarHBondContact O-CB 3.46Å; L65-Y69 PolarHBondContact O-N 3.42Å; T66-Y69 WeakPolarHBondContact O-CB 3.42Å; T66-Y69 PolarHBondContact O-N 3.25Å; T66-Y69 VanDerWaalsContact O-N 3.12Å; Y69-K71 VanDerWaalsContact C-N 3.31Å; Y69-K71 PolarHBondContact O-N 3.39Å; Y69-V72 CarbonylContact O-C 3.53Å; Y69-V72 PolarHBondContact O-N 2.88Å; Y69-L73 HydrophobicContact CE1-CD2 3.9Å; Y69-L73 WeakPolarHBondContact O-CB 3.27Å; Y69-L73 PolarHBondContact O-N 3.08Å
70	D	95.1	Very high	87	Confident	81 Å²	81	88.7 Å²	88.7	43%	0.433	45%	0.448	S	S	.	.	H	α-helix	trans	-61.6	-39.7	-178.6	-63.3	-26.3	0	0	0	111.8	T66 V72 L73 S74	T66-D70 WeakPolarHBondContact CG2-OD2 3.38Å; T66-D70 VanDerWaalsContact O-CG 3.25Å; T66-D70 PolarHBondContact O-N 2.9Å; D70-V72 VanDerWaalsContact C-N 3.31Å; D70-V72 PolarHBondContact O-N 3.21Å; D70-L73 PolarHBondContact O-N 2.94Å; D70-S74 WeakPolarHBondContact O-CB 3.43Å; D70-S74 PolarHBondContact O-N 3.01Å; D70-S74 PolarHBondContact O-OG 3.04Å
71	K	91.2	Very high	85.2	Confident	111 Å²	111	91.3 Å²	91.3	48%	0.483	46%	0.46	S	S	.	.	H	α-helix	trans	-61.1	-39.9	173.8	178.9	-172.2	174	-169	0	111.8	R67 F68 Y69 S74 L75	R67-K71 VanDerWaalsContact O-CB 3.29Å; R67-K71 WeakPolarHBondContact O-CB 3.48Å; R67-K71 PolarHBondContact O-N 3.29Å; R67-K71 VanDerWaalsContact O-N 3.13Å; F68-K71 PolarHBondContact O-N 3.27Å; Y69-K71 VanDerWaalsContact C-N 3.31Å; Y69-K71 PolarHBondContact O-N 3.39Å; K71-S74 PolarHBondContact O-OG 3.41Å; K71-S74 VanDerWaalsContact O-OG 3.11Å; K71-L75 WeakPolarHBondContact O-CD1 3.46Å; K71-L75 VanDerWaalsContact O-CG 3.32Å; K71-L75 WeakPolarHBondContact O-CG 3.23Å
72	V	89.9	Confident	83.3	Confident	16 Å²	16	92.8 Å²	92.8	10%	0.097	48%	0.478	C	S	.	.	H	α-helix	trans	-75.4	-40	179	175.3	0	0	0	0	110.8	F68 Y69 D70 L75 H76 W100	F68-V72 HydrophobicContact CD1-CG2 4.47Å; F68-V72 HydrophobicContact CD2-CG2 4.44Å; F68-V72 HydrophobicContact CE1-CG2 4.06Å; F68-V72 HydrophobicContact CE2-CG2 4Å; F68-V72 HydrophobicContact CZ-CG2 3.81Å; F68-V72 WeakPolarHBondContact O-CG2 3.48Å; F68-V72 PolarHBondContact O-N 2.96Å; Y69-V72 CarbonylContact O-C 3.53Å; Y69-V72 PolarHBondContact O-N 2.88Å; D70-V72 VanDerWaalsContact C-N 3.31Å; D70-V72 PolarHBondContact O-N 3.21Å; V72-L75 PolarHBondContact O-N 3.36Å; V72-H76 PolarHBondContact O-ND1 3.4Å; V72-W100 HydrophobicContact CG1-CZ2 4.38Å
73	L	90.3	Very high	81.6	Confident	64 Å²	64	93.6 Å²	93.6	34%	0.335	49%	0.486	S	S	.	.	H	α-helix	trans	-62.7	-49.9	-179.3	-177.5	64.9	0	0	0	111.8	Y69 D70 L75 H76 E77	Y69-L73 HydrophobicContact CE1-CD2 3.9Å; Y69-L73 WeakPolarHBondContact O-CB 3.27Å; Y69-L73 PolarHBondContact O-N 3.08Å; D70-L73 PolarHBondContact O-N 2.94Å; L73-L75 PolarHBondContact O-N 3.35Å; L73-L75 VanDerWaalsContact O-N 3.13Å; L73-H76 WeakPolarHBondContact O-CA 3.47Å; L73-H76 PolarHBondContact O-N 3.31Å; L73-E77 HydrophobicContact CG-CG 4.43Å; L73-E77 PolarHBondContact O-N 3.49Å; L73-E77 VanDerWaalsContact O-N 3.14Å
74	S	87.6	Confident	80.1	Confident	59 Å²	59	90.6 Å²	90.6	41%	0.413	49%	0.493	S	S	.	.	H	α-helix	trans	-56.6	-30.5	177.6	51.5	0	0	0	0	113.5	D70 K71 H76	D70-S74 WeakPolarHBondContact O-CB 3.43Å; D70-S74 PolarHBondContact O-N 3.01Å; D70-S74 PolarHBondContact O-OG 3.04Å; K71-S74 PolarHBondContact O-OG 3.41Å; K71-S74 VanDerWaalsContact O-OG 3.11Å; S74-H76 VanDerWaalsContact C-N 3.25Å; S74-H76 PolarHBondContact O-N 3.01Å
75	L	82.5	Confident	79.4	Confident	79 Å²	79	90.9 Å²	90.9	41%	0.414	50%	0.495	S	S	.	.	H	α-helix	trans	-74.7	-11	175.5	-67.5	170.4	0	0	0	113.9	K71 V72 L73	K71-L75 WeakPolarHBondContact O-CD1 3.46Å; K71-L75 VanDerWaalsContact O-CG 3.32Å; K71-L75 WeakPolarHBondContact O-CG 3.23Å; V72-L75 PolarHBondContact O-N 3.36Å; L73-L75 PolarHBondContact O-N 3.35Å; L73-L75 VanDerWaalsContact O-N 3.13Å
76	H	78.6	Confident	78.8	Confident	98 Å²	98	93.2 Å²	93.2	45%	0.454	51%	0.513	S	S	.	.	H	α-helix	trans	-108.9	-19.1	178.6	-68.1	81.9	0	0	0	113.5	V72 L73 S74 D78 S79	V72-H76 PolarHBondContact O-ND1 3.4Å; L73-H76 WeakPolarHBondContact O-CA 3.47Å; L73-H76 PolarHBondContact O-N 3.31Å; S74-H76 VanDerWaalsContact C-N 3.25Å; S74-H76 PolarHBondContact O-N 3.01Å; H76-D78 VanDerWaalsContact C-N 3.27Å; H76-D78 PolarHBondContact O-N 3.08Å; H76-S79 VanDerWaalsContact O-CB 3.22Å; H76-S79 WeakPolarHBondContact O-CB 3.35Å; H76-S79 PolarHBondContact O-N 3.19Å; H76-S79 PolarHBondContact O-OG 3.42Å; H76-S79 VanDerWaalsContact O-OG 3.1Å
77	E	70.8	Confident	78.2	Confident	141 Å²	141	95.8 Å²	95.8	66%	0.659	52%	0.523	S	S	*	.	H	α-helix	trans	-66.5	-27.5	176.7	-72.7	178.4	160.7	0	0	112.5	L73 S79	L73-E77 HydrophobicContact CG-CG 4.43Å; L73-E77 PolarHBondContact O-N 3.49Å; L73-E77 VanDerWaalsContact O-N 3.14Å; E77-S79 PolarHBondContact O-N 3.25Å
78	D	61.7	Low	77.5	Confident	121 Å²	121	91.5 Å²	91.5	65%	0.647	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	25.8	177.5	-74.3	-26.5	0	0	0	114.4	H76 T80 T81	H76-D78 VanDerWaalsContact C-N 3.27Å; H76-D78 PolarHBondContact O-N 3.08Å; D78-T80 PolarHBondContact O-N 3.33Å; D78-T81 PolarHBondContact O-N 2.94Å; D78-T81 PolarHBondContact O-OG1 3.41Å
79	S	56.5	Low	77	Confident	101 Å²	101	91.5 Å²	91.5	71%	0.706	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	24.9	-165.1	55.4	0	0	0	0	118.3	H76 E77	H76-S79 VanDerWaalsContact O-CB 3.22Å; H76-S79 WeakPolarHBondContact O-CB 3.35Å; H76-S79 PolarHBondContact O-N 3.19Å; H76-S79 PolarHBondContact O-OG 3.42Å; H76-S79 VanDerWaalsContact O-OG 3.1Å; E77-S79 PolarHBondContact O-N 3.25Å
80	T	57	Low	76.8	Confident	143 Å²	143	91.1 Å²	91.1	88%	0.877	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-11.6	160.4	54.2	0	0	0	0	113.8	D78 P82	D78-T80 PolarHBondContact O-N 3.33Å; T80-P82 WeakPolarHBondContact O-CD 3.26Å
81	T	59.4	Low	76.5	Confident	88 Å²	88	89.9 Å²	89.9	54%	0.54	51%	0.513	S	S	.	.	S	Bend	trans	-78.2	118.4	178.2	9.1	0	0	0	0	111.9	D78	D78-T81 PolarHBondContact O-N 2.94Å; D78-T81 PolarHBondContact O-OG1 3.41Å
82	P	56.3	Low	76.4	Confident	93 Å²	93	87.3 Å²	87.3	60%	0.604	50%	0.504	S	S	*	.			trans	-66.5	148.2	-179.5	2.7	4.6	0	0	0	111.2	T80 A84	T80-P82 WeakPolarHBondContact O-CD 3.26Å; P82-A84 HydrophobicContact CB-CB 4.17Å; P82-A84 PolarHBondContact O-N 3.35Å
83	V	61.6	Low	76.5	Confident	108 Å²	108	92 Å²	92	66%	0.655	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	5.2	170.2	-175.8	0	0	0	0	113.2	N85 A89	V83-N85 VanDerWaalsContact C-N 3.25Å; V83-N85 PolarHBondContact O-N 2.86Å; V83-A89 HydrophobicContact CG1-CB 4.29Å
84	A	66	Low	76.7	Confident	84 Å²	84	93.9 Å²	93.9	69%	0.694	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-17.2	174.9	0	0	0	0	0	114.2	P82 P86	P82-A84 HydrophobicContact CB-CB 4.17Å; P82-A84 PolarHBondContact O-N 3.35Å; A84-P86 VanDerWaalsContact O-CD 3.27Å; A84-P86 WeakPolarHBondContact O-CD 3.46Å
85	N	81.1	Confident	77	Confident	70 Å²	70	92 Å²	92	37%	0.374	52%	0.517	S	S	.	.	S	Bend	trans	-78.8	114.8	173.6	-176.5	-30.5	0	0	0	110.4	V83 L87 L88 A89	V83-N85 VanDerWaalsContact C-N 3.25Å; V83-N85 PolarHBondContact O-N 2.86Å; N85-L87 PolarHBondContact O-N 3.3Å; N85-L87 VanDerWaalsContact O-N 3.14Å; N85-L87 WeakPolarHBondContact OD1-CB 3.31Å; N85-L87 PolarHBondContact OD1-N 2.83Å; N85-L88 HydrophobicContact CB-CB 4.13Å; N85-L88 HydrophobicContact CB-CD1 3.95Å; N85-L88 HydrophobicContact CB-CG 3.99Å; N85-L88 PolarHBondContact O-N 2.89Å; N85-A89 PolarHBondContact O-N 3.2Å
86	P	84.8	Confident	77.5	Confident	105 Å²	105	93.6 Å²	93.6	68%	0.682	53%	0.525	S	S	*	.	H	α-helix	trans	-59.7	-27.3	-177.6	-24.8	35.8	0	0	0	114.5	A84 F90	A84-P86 VanDerWaalsContact O-CD 3.27Å; A84-P86 WeakPolarHBondContact O-CD 3.46Å; P86-F90 VanDerWaalsContact O-CB 3.29Å; P86-F90 WeakPolarHBondContact O-CB 3.4Å; P86-F90 PolarHBondContact O-N 3.49Å
87	L	84.6	Confident	78.3	Confident	129 Å²	129	95.8 Å²	95.8	68%	0.675	54%	0.536	S	S	*	.	H	α-helix	trans	-73.3	-39.8	176.4	-58.6	177.4	0	0	0	111.7	N85 T91	N85-L87 PolarHBondContact O-N 3.3Å; N85-L87 VanDerWaalsContact O-N 3.14Å; N85-L87 WeakPolarHBondContact OD1-CB 3.31Å; N85-L87 PolarHBondContact OD1-N 2.83Å; L87-T91 WeakPolarHBondContact O-CB 3.28Å; L87-T91 VanDerWaalsContact O-CG2 3.31Å; L87-T91 WeakPolarHBondContact O-CG2 3.09Å; L87-T91 PolarHBondContact O-N 2.7Å; L87-T91 PolarHBondContact O-OG1 2.86Å
88	L	82.4	Confident	79.4	Confident	67 Å²	67	91.4 Å²	91.4	35%	0.351	52%	0.521	S	S	.	.	H	α-helix	trans	-68.2	-41.1	174.3	-65.6	-179.6	0	0	0	110.9	N85 T91 L92	N85-L88 HydrophobicContact CB-CB 4.13Å; N85-L88 HydrophobicContact CB-CD1 3.95Å; N85-L88 HydrophobicContact CB-CG 3.99Å; N85-L88 PolarHBondContact O-N 2.89Å; L88-T91 PolarHBondContact O-N 3.45Å; L88-T91 PolarHBondContact O-OG1 3.2Å; L88-T91 VanDerWaalsContact O-OG1 3.09Å; L88-L92 WeakPolarHBondContact O-CB 3.32Å; L88-L92 PolarHBondContact O-N 3.5Å
89	A	85.1	Confident	81	Confident	24 Å²	24	87 Å²	87	20%	0.198	50%	0.497	C	S	.	.	H	α-helix	trans	-61.6	-47.4	174.5	0	0	0	0	0	112	V83 N85 L92 I93	V83-A89 HydrophobicContact CG1-CB 4.29Å; N85-A89 PolarHBondContact O-N 3.2Å; A89-L92 PolarHBondContact O-N 3.15Å; A89-I93 VanDerWaalsContact O-CG1 3.29Å; A89-I93 WeakPolarHBondContact O-CG1 3.45Å; A89-I93 PolarHBondContact O-N 3.31Å
90	F	89.4	Confident	82.9	Confident	132 Å²	132	87.2 Å²	87.2	58%	0.579	48%	0.482	S	S	*	.	H	α-helix	trans	-60.5	-47.8	176.5	172.6	-100.2	0	0	0	112.2	P86 L92 I93 K94	P86-F90 VanDerWaalsContact O-CB 3.29Å; P86-F90 WeakPolarHBondContact O-CB 3.4Å; P86-F90 PolarHBondContact O-N 3.49Å; F90-L92 VanDerWaalsContact C-N 3.32Å; F90-L92 PolarHBondContact O-N 3.21Å; F90-I93 PolarHBondContact O-N 3.23Å; F90-K94 HydrophobicContact CE1-CD 4.49Å; F90-K94 WeakPolarHBondContact O-CB 3.19Å; F90-K94 PolarHBondContact O-N 3.23Å
91	T	89.4	Confident	84.7	Confident	55 Å²	55	88.3 Å²	88.3	34%	0.337	47%	0.47	S	S	.	.	H	α-helix	trans	-66.9	-33.2	-179.3	54.9	0	0	0	0	112.3	L87 L88 R95	L87-T91 WeakPolarHBondContact O-CB 3.28Å; L87-T91 VanDerWaalsContact O-CG2 3.31Å; L87-T91 WeakPolarHBondContact O-CG2 3.09Å; L87-T91 PolarHBondContact O-N 2.7Å; L87-T91 PolarHBondContact O-OG1 2.86Å; L88-T91 PolarHBondContact O-N 3.45Å; L88-T91 PolarHBondContact O-OG1 3.2Å; L88-T91 VanDerWaalsContact O-OG1 3.09Å; T91-R95 WeakPolarHBondContact O-CB 3.31Å; T91-R95 VanDerWaalsContact O-CG 3.24Å; T91-R95 WeakPolarHBondContact O-CG 3.15Å; T91-R95 PolarHBondContact O-N 3.47Å; T91-R95 PolarHBondContact O-NH1 2.84Å
92	L	90.3	Very high	86.3	Confident	57 Å²	57	89.4 Å²	89.4	30%	0.298	47%	0.473	S	S	.	.	H	α-helix	trans	-63.2	-50.5	170.9	174.8	62.8	0	0	0	111.4	L88 A89 F90 K94 R95 L96	L88-L92 WeakPolarHBondContact O-CB 3.32Å; L88-L92 PolarHBondContact O-N 3.5Å; A89-L92 PolarHBondContact O-N 3.15Å; F90-L92 VanDerWaalsContact C-N 3.32Å; F90-L92 PolarHBondContact O-N 3.21Å; L92-K94 PolarHBondContact O-N 2.98Å; L92-R95 PolarHBondContact O-N 2.86Å; L92-L96 HydrophobicContact CD1-CD1 3.85Å; L92-L96 HydrophobicContact CD1-CG 4.08Å; L92-L96 HydrophobicContact CG-CD1 4.12Å; L92-L96 WeakPolarHBondContact O-CG 3.41Å; L92-L96 PolarHBondContact O-N 3.02Å
93	I	91.4	Very high	88.1	Confident	113 Å²	113	86.9 Å²	86.9	58%	0.579	46%	0.456	S	S	*	.	H	α-helix	trans	-58.7	-47.1	178.2	-67.5	165.8	0	0	0	110.5	A89 F90 R95 L96 Q97	A89-I93 VanDerWaalsContact O-CG1 3.29Å; A89-I93 WeakPolarHBondContact O-CG1 3.45Å; A89-I93 PolarHBondContact O-N 3.31Å; F90-I93 PolarHBondContact O-N 3.23Å; I93-R95 PolarHBondContact O-N 3.45Å; I93-L96 PolarHBondContact O-N 2.92Å; I93-Q97 VanDerWaalsContact O-CB 3.23Å; I93-Q97 WeakPolarHBondContact O-CB 3.36Å; I93-Q97 PolarHBondContact O-N 3.2Å
94	K	94.2	Very high	89.7	Confident	105 Å²	105	86.6 Å²	86.6	46%	0.457	45%	0.454	S	S	.	.	H	α-helix	trans	-59.6	-45.9	176.7	-178.7	-172.1	169.9	-176.1	0	111.9	F90 L92 L96 Q97 S98 D99	F90-K94 HydrophobicContact CE1-CD 4.49Å; F90-K94 WeakPolarHBondContact O-CB 3.19Å; F90-K94 PolarHBondContact O-N 3.23Å; L92-K94 PolarHBondContact O-N 2.98Å; K94-L96 PolarHBondContact O-N 3.31Å; K94-Q97 PolarHBondContact O-N 2.7Å; K94-S98 PolarHBondContact O-N 3.19Å; K94-D99 PolarHBondContact O-N 2.9Å
95	R	94.2	Very high	91	Very high	19 Å²	19	88.6 Å²	88.6	7%	0.072	45%	0.449	C	S	.	.	I	π-helix	trans	-58.9	-48.1	179.3	-79.2	-172.1	-32.2	-97.9	8.5	111.4	T91 L92 I93 D99 W100	T91-R95 WeakPolarHBondContact O-CB 3.31Å; T91-R95 VanDerWaalsContact O-CG 3.24Å; T91-R95 WeakPolarHBondContact O-CG 3.15Å; T91-R95 PolarHBondContact O-N 3.47Å; T91-R95 PolarHBondContact O-NH1 2.84Å; L92-R95 PolarHBondContact O-N 2.86Å; I93-R95 PolarHBondContact O-N 3.45Å; R95-D99 HydrophobicContact CG-CB 4.43Å; R95-D99 WeakPolarHBondContact CG-OD2 3.4Å; R95-D99 PolarHBondContact O-N 3.43Å; R95-W100 VanDerWaalsContact O-CD1 3.3Å; R95-W100 PolarHBondContact O-N 3.03Å
96	L	93.5	Very high	91.7	Very high	113 Å²	113	87.5 Å²	87.5	59%	0.592	45%	0.446	S	S	*	.	I	π-helix	trans	-67.5	-36.7	-179.5	-66.6	176.9	0	0	0	112.3	L92 I93 K94	L92-L96 HydrophobicContact CD1-CD1 3.85Å; L92-L96 HydrophobicContact CD1-CG 4.08Å; L92-L96 HydrophobicContact CG-CD1 4.12Å; L92-L96 WeakPolarHBondContact O-CG 3.41Å; L92-L96 PolarHBondContact O-N 3.02Å; I93-L96 PolarHBondContact O-N 2.92Å; K94-L96 PolarHBondContact O-N 3.31Å
97	Q	93.9	Very high	92.2	Very high	144 Å²	144	87.6 Å²	87.6	67%	0.673	44%	0.44	S	S	*	.	I	π-helix	trans	-83.3	-28.8	-177.1	-178.3	56.2	8.6	0	0	114.3	I93 K94	I93-Q97 VanDerWaalsContact O-CB 3.23Å; I93-Q97 WeakPolarHBondContact O-CB 3.36Å; I93-Q97 PolarHBondContact O-N 3.2Å; K94-Q97 PolarHBondContact O-N 2.7Å
98	S	94.7	Very high	92.7	Very high	49 Å²	49	85.2 Å²	85.2	34%	0.343	43%	0.426	S	S	.	.	I	π-helix	trans	-132.7	-52.6	-171.3	-170.8	0	0	0	0	114.1	K94 W100 R101 N102	K94-S98 PolarHBondContact O-N 3.19Å; S98-W100 PolarHBondContact O-N 2.89Å; S98-R101 WeakPolarHBondContact O-CB 3.28Å; S98-R101 PolarHBondContact O-N 3.39Å; S98-R101 VanDerWaalsContact O-N 3.12Å; S98-N102 PolarHBondContact O-N 3.2Å; S98-N102 VanDerWaalsContact O-N 3.09Å
99	D	95	Very high	93.3	Very high	27 Å²	27	83.6 Å²	83.6	14%	0.144	42%	0.422	C	S	.	.	I	π-helix	trans	-66.1	-43.3	-168.8	-59.2	-7	0	0	0	111.1	F68 K94 R95 R101 N102 V103	F68-D99 HydrophobicContact CE2-CB 3.83Å; F68-D99 HydrophobicContact CZ-CB 4.43Å; K94-D99 PolarHBondContact O-N 2.9Å; R95-D99 HydrophobicContact CG-CB 4.43Å; R95-D99 WeakPolarHBondContact CG-OD2 3.4Å; R95-D99 PolarHBondContact O-N 3.43Å; D99-R101 VanDerWaalsContact C-N 3.29Å; D99-R101 PolarHBondContact O-N 3.48Å; D99-N102 PolarHBondContact O-N 3.38Å; D99-V103 PolarHBondContact O-N 2.91Å
100	W	95.8	Very high	93.8	Very high	107 Å²	107	85.2 Å²	85.2	41%	0.405	43%	0.432	S	S	.	.	H	α-helix	trans	-61.3	-36.8	173.4	-84.4	107.2	0	0	0	112.7	F68 V72 R95 S98 N102 V103 V104	F68-W100 AromaticContact CE1-CD2 3.86Å; F68-W100 HydrophobicContact CE1-CD2 3.86Å; F68-W100 AromaticContact CE1-CE2 3.93Å; F68-W100 AromaticContact CE1-CE3 3.87Å; F68-W100 HydrophobicContact CE1-CE3 3.87Å; F68-W100 HydrophobicContact CE1-CH2 4.03Å; F68-W100 HydrophobicContact CE1-CZ2 4.03Å; F68-W100 AromaticContact CE1-CZ3 3.95Å; F68-W100 HydrophobicContact CE1-CZ3 3.95Å; F68-W100 AromaticContact CZ-CD2 3.87Å; F68-W100 HydrophobicContact CZ-CD2 3.87Å; F68-W100 AromaticContact CZ-CE2 3.94Å; F68-W100 HydrophobicContact CZ-CE3 4.3Å; F68-W100 HydrophobicContact CZ-CG 4.1Å; F68-W100 HydrophobicContact CZ-CZ2 4.43Å; V72-W100 HydrophobicContact CG1-CZ2 4.38Å; R95-W100 VanDerWaalsContact O-CD1 3.3Å; R95-W100 PolarHBondContact O-N 3.03Å; S98-W100 PolarHBondContact O-N 2.89Å; W100-N102 VanDerWaalsContact C-N 3.33Å; W100-N102 PolarHBondContact O-N 3.26Å; W100-V103 PolarHBondContact O-N 3.23Å; W100-V104 HydrophobicContact CE3-CG2 4.45Å; W100-V104 WeakPolarHBondContact O-CB 3.46Å; W100-V104 WeakPolarHBondContact O-CG2 3.44Å; W100-V104 PolarHBondContact O-N 2.81Å
101	R	95.5	Very high	94.1	Very high	166 Å²	166	83.8 Å²	83.8	63%	0.626	43%	0.427	S	S	*	.	H	α-helix	trans	-62.3	-41.6	177.7	-167.3	-178.3	176.6	-176.7	-3.5	111.1	S98 D99 V103 H105	S98-R101 WeakPolarHBondContact O-CB 3.28Å; S98-R101 PolarHBondContact O-N 3.39Å; S98-R101 VanDerWaalsContact O-N 3.12Å; D99-R101 VanDerWaalsContact C-N 3.29Å; D99-R101 PolarHBondContact O-N 3.48Å; R101-V103 VanDerWaalsContact C-N 3.3Å; R101-V103 PolarHBondContact O-N 3.08Å; R101-H105 WeakPolarHBondContact CG-CD2 3.42Å; R101-H105 WeakPolarHBondContact O-CB 3.35Å; R101-H105 PolarHBondContact O-CD2 2.93Å; R101-H105 VanDerWaalsContact O-CD2 3.25Å; R101-H105 PolarHBondContact O-N 2.69Å
102	N	93.5	Very high	94.5	Very high	110 Å²	110	82.9 Å²	82.9	59%	0.588	42%	0.42	S	S	*	.	H	α-helix	trans	-63.6	-36.8	177.1	-65.5	-18.8	0	0	0	112.1	S98 D99 W100 S106	S98-N102 PolarHBondContact O-N 3.2Å; S98-N102 VanDerWaalsContact O-N 3.09Å; D99-N102 PolarHBondContact O-N 3.38Å; W100-N102 VanDerWaalsContact C-N 3.33Å; W100-N102 PolarHBondContact O-N 3.26Å; N102-S106 WeakPolarHBondContact O-CB 3.31Å; N102-S106 PolarHBondContact O-N 3.24Å
103	V	94.1	Very high	94.8	Very high	41 Å²	41	82.8 Å²	82.8	25%	0.248	42%	0.42	C	S	.	.	H	α-helix	trans	-71.7	-50.8	178.1	171.3	0	0	0	0	111.5	L65 F68 D99 W100 R101 H105 S106	L65-V103 HydrophobicContact CD2-CG1 3.52Å; F68-V103 HydrophobicContact CB-CG2 4.47Å; F68-V103 HydrophobicContact CD1-CG1 4.42Å; F68-V103 HydrophobicContact CD1-CG2 3.72Å; F68-V103 HydrophobicContact CD2-CG2 4.11Å; F68-V103 HydrophobicContact CE1-CB 4.45Å; F68-V103 HydrophobicContact CE1-CG2 3.89Å; F68-V103 HydrophobicContact CE2-CG2 4.28Å; F68-V103 HydrophobicContact CG-CG2 3.83Å; F68-V103 HydrophobicContact CZ-CG2 4.16Å; D99-V103 PolarHBondContact O-N 2.91Å; W100-V103 PolarHBondContact O-N 3.23Å; R101-V103 VanDerWaalsContact C-N 3.3Å; R101-V103 PolarHBondContact O-N 3.08Å; V103-H105 PolarHBondContact O-N 3.3Å; V103-S106 PolarHBondContact O-N 3.03Å
104	V	94	Very high	95.1	Very high	102 Å²	102	84.2 Å²	84.2	62%	0.618	42%	0.418	S	S	*	.	H	α-helix	trans	-69.4	-34.3	-175.1	172.7	0	0	0	0	112.3	W100	W100-V104 HydrophobicContact CE3-CG2 4.45Å; W100-V104 WeakPolarHBondContact O-CB 3.46Å; W100-V104 WeakPolarHBondContact O-CG2 3.44Å; W100-V104 PolarHBondContact O-N 2.81Å
105	H	94.6	Very high	95.2	Very high	126 Å²	126	82.1 Å²	82.1	58%	0.583	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98	11	179.4	-61.8	-73.3	0	0	0	113.8	R101 V103 L107	R101-H105 WeakPolarHBondContact CG-CD2 3.42Å; R101-H105 WeakPolarHBondContact O-CB 3.35Å; R101-H105 PolarHBondContact O-CD2 2.93Å; R101-H105 VanDerWaalsContact O-CD2 3.25Å; R101-H105 PolarHBondContact O-N 2.69Å; V103-H105 PolarHBondContact O-N 3.3Å; H105-L107 PolarHBondContact O-N 3.31Å
106	S	94.9	Very high	95.3	Very high	46 Å²	46	83 Å²	83	32%	0.322	43%	0.426	S	S	.	.			trans	-61.7	132.7	172.4	177.2	0	0	0	0	110.3	N102 V103 E108	N102-S106 WeakPolarHBondContact O-CB 3.31Å; N102-S106 PolarHBondContact O-N 3.24Å; V103-S106 PolarHBondContact O-N 3.03Å; S106-E108 WeakPolarHBondContact OG-CG 3.32Å; S106-E108 PolarHBondContact OG-N 2.85Å
107	L	96.1	Very high	95.5	Very high	107 Å²	107	83.6 Å²	83.6	56%	0.56	42%	0.424	S	S	*	.			trans	-95	-1	176.5	-62.6	179.9	0	0	0	112.6	H105 A109 S110 E111	H105-L107 PolarHBondContact O-N 3.31Å; L107-A109 VanDerWaalsContact C-N 3.28Å; L107-A109 PolarHBondContact O-N 3.43Å; L107-A109 VanDerWaalsContact O-N 3.15Å; L107-S110 CarbonylContact O-C 3.58Å; L107-S110 WeakPolarHBondContact O-CA 3.42Å; L107-S110 WeakPolarHBondContact O-CB 3.02Å; L107-S110 PolarHBondContact O-N 3.24Å; L107-E111 HydrophobicContact CB-CG 4.18Å; L107-E111 WeakPolarHBondContact O-CG 3.2Å; L107-E111 PolarHBondContact O-N 3Å
108	E	94.6	Very high	95.6	Very high	80 Å²	80	80 Å²	80	37%	0.374	41%	0.409	S	S	.	.	H	α-helix	trans	-52.8	-43.1	-171.9	-73.5	171.3	-157.4	0	0	112.7	R61 S106 S110 E111 N112	R61-E108 HydrophobicContact CG-CB 4.19Å; S106-E108 WeakPolarHBondContact OG-CG 3.32Å; S106-E108 PolarHBondContact OG-N 2.85Å; E108-S110 PolarHBondContact O-N 2.93Å; E108-E111 PolarHBondContact O-N 3.21Å; E108-N112 WeakPolarHBondContact O-CB 3.41Å; E108-N112 PolarHBondContact O-N 3.25Å; E108-N112 PolarHBondContact O-ND2 3.07Å
109	A	94.1	Very high	95.7	Very high	32 Å²	32	78.1 Å²	78.1	26%	0.264	40%	0.397	S	S	.	.	H	α-helix	trans	-60.9	-45.3	177.6	0	0	0	0	0	112	R61 L107 I113	R61-A109 VanDerWaalsContact CZ-CB 3.46Å; L107-A109 VanDerWaalsContact C-N 3.28Å; L107-A109 PolarHBondContact O-N 3.43Å; L107-A109 VanDerWaalsContact O-N 3.15Å; A109-I113 WeakPolarHBondContact O-CG2 3.41Å; A109-I113 PolarHBondContact O-N 2.96Å; A109-I113 VanDerWaalsContact O-N 3.14Å
110	S	96.2	Very high	95.7	Very high	59 Å²	59	81.4 Å²	81.4	41%	0.413	41%	0.408	S	S	.	.	H	α-helix	trans	-68.1	-36.9	179.1	-63.7	0	0	0	0	111.5	L107 E108 I113 R114	L107-S110 CarbonylContact O-C 3.58Å; L107-S110 WeakPolarHBondContact O-CA 3.42Å; L107-S110 WeakPolarHBondContact O-CB 3.02Å; L107-S110 PolarHBondContact O-N 3.24Å; E108-S110 PolarHBondContact O-N 2.93Å; S110-I113 WeakPolarHBondContact O-CG2 3.42Å; S110-R114 WeakPolarHBondContact O-CB 3.28Å; S110-R114 PolarHBondContact O-N 3.42Å
111	E	96.8	Very high	95.7	Very high	101 Å²	101	82.3 Å²	82.3	47%	0.472	42%	0.417	S	S	.	.	H	α-helix	trans	-69.4	-44	177.4	-70.7	172.2	168.5	0	0	111.4	L107 E108 R114 A115	L107-E111 HydrophobicContact CB-CG 4.18Å; L107-E111 WeakPolarHBondContact O-CG 3.2Å; L107-E111 PolarHBondContact O-N 3Å; E108-E111 PolarHBondContact O-N 3.21Å; E111-R114 PolarHBondContact O-N 3.33Å; E111-A115 WeakPolarHBondContact O-CB 3.36Å; E111-A115 PolarHBondContact O-N 2.68Å
112	N	96.3	Very high	95.6	Very high	36 Å²	36	81.9 Å²	81.9	19%	0.193	42%	0.42	C	S	.	.	H	α-helix	trans	-58.6	-51.6	176.4	-73.2	-21	0	0	0	111.3	Y54 G57 E58 E108 A115 L116	Y54-N112 HydrophobicContact CD2-CB 3.97Å; Y54-N112 WeakPolarHBondContact CD2-O 3.45Å; Y54-N112 HydrophobicContact CE2-CB 4.03Å; G57-N112 PolarHBondContact O-ND2 2.92Å; E58-N112 PolarHBondContact N-ND2 3.33Å; E58-N112 VanDerWaalsContact OE1-CB 3.28Å; E58-N112 WeakPolarHBondContact OE1-CB 3.37Å; E58-N112 PolarHBondContact OE1-ND2 2.81Å; E108-N112 WeakPolarHBondContact O-CB 3.41Å; E108-N112 PolarHBondContact O-N 3.25Å; E108-N112 PolarHBondContact O-ND2 3.07Å; N112-A115 PolarHBondContact O-N 3.14Å; N112-L116 PolarHBondContact O-N 3.14Å
113	I	97.1	Very high	95.5	Very high	56 Å²	56	77 Å²	77	29%	0.287	39%	0.394	S	S	.	.	H	α-helix	trans	-68.6	-35.6	-179.5	-169.4	59.9	0	0	0	112	Y54 A109 S110 L116 K117	Y54-I113 HydrophobicContact CE2-CB 4.04Å; Y54-I113 HydrophobicContact CE2-CD1 3.95Å; A109-I113 WeakPolarHBondContact O-CG2 3.41Å; A109-I113 PolarHBondContact O-N 2.96Å; A109-I113 VanDerWaalsContact O-N 3.14Å; S110-I113 WeakPolarHBondContact O-CG2 3.42Å; I113-L116 HydrophobicContact CD1-CD2 4.21Å; I113-L116 PolarHBondContact O-N 3.19Å; I113-K117 HydrophobicContact CG1-CD 4.43Å; I113-K117 WeakPolarHBondContact O-CG 3.42Å; I113-K117 PolarHBondContact O-N 2.84Å
114	R	97.7	Very high	95.3	Very high	143 Å²	143	79.6 Å²	79.6	54%	0.54	40%	0.403	S	S	.	.	H	α-helix	trans	-61.7	-45.2	174.8	-175.3	-179.5	-62.1	144.5	2.6	110.7	S110 E111 L116 K117 D118	S110-R114 WeakPolarHBondContact O-CB 3.28Å; S110-R114 PolarHBondContact O-N 3.42Å; E111-R114 PolarHBondContact O-N 3.33Å; R114-L116 VanDerWaalsContact C-N 3.27Å; R114-L116 PolarHBondContact O-N 3.36Å; R114-K117 PolarHBondContact O-N 3.01Å; R114-K117 VanDerWaalsContact O-N 3.16Å; R114-D118 WeakPolarHBondContact O-CB 3.44Å; R114-D118 PolarHBondContact O-N 2.97Å
115	A	96.3	Very high	94.9	Very high	61 Å²	61	81.3 Å²	81.3	50%	0.504	41%	0.405	S	S	.	.	H	α-helix	trans	-61.2	-35	177	0	0	0	0	0	113.1	E111 N112 G119	E111-A115 WeakPolarHBondContact O-CB 3.36Å; E111-A115 PolarHBondContact O-N 2.68Å; N112-A115 PolarHBondContact O-N 3.14Å; A115-G119 PolarHBondContact O-N 3.14Å; A115-G119 VanDerWaalsContact O-N 3.17Å
116	L	97.3	Very high	94.5	Very high	38 Å²	38	79.1 Å²	79.1	20%	0.199	40%	0.397	C	S	.	.	H	α-helix	trans	-66.7	-47.7	173.3	-179.4	58.7	0	0	0	111.3	L50 L51 Y54 N112 I113 R114 G119 Y120	L50-L116 HydrophobicContact CB-CD1 3.85Å; L51-L116 HydrophobicContact CD1-CD2 4.42Å; Y54-L116 HydrophobicContact CD1-CD2 3.93Å; Y54-L116 HydrophobicContact CD2-CB 4.22Å; Y54-L116 HydrophobicContact CD2-CD2 4.21Å; Y54-L116 HydrophobicContact CE1-CD2 4.43Å; Y54-L116 HydrophobicContact CG-CB 4.33Å; Y54-L116 HydrophobicContact CG-CD2 3.79Å; N112-L116 PolarHBondContact O-N 3.14Å; I113-L116 HydrophobicContact CD1-CD2 4.21Å; I113-L116 PolarHBondContact O-N 3.19Å; R114-L116 VanDerWaalsContact C-N 3.27Å; R114-L116 PolarHBondContact O-N 3.36Å; L116-G119 PolarHBondContact O-N 2.91Å; L116-Y120 PolarHBondContact O-N 3.37Å
117	K	97.4	Very high	94.2	Very high	125 Å²	125	78.3 Å²	78.3	54%	0.543	39%	0.389	S	S	.	.	H	α-helix	trans	-60.8	-51.6	178.8	-72.3	178.7	174.6	-172	0	112.2	I113 R114 G119 Y120 E121	I113-K117 HydrophobicContact CG1-CD 4.43Å; I113-K117 WeakPolarHBondContact O-CG 3.42Å; I113-K117 PolarHBondContact O-N 2.84Å; R114-K117 PolarHBondContact O-N 3.01Å; R114-K117 VanDerWaalsContact O-N 3.16Å; K117-G119 PolarHBondContact O-N 2.91Å; K117-G119 VanDerWaalsContact O-N 3.15Å; K117-Y120 WeakPolarHBondContact O-CB 3.46Å; K117-Y120 PolarHBondContact O-N 2.84Å; K117-E121 WeakPolarHBondContact O-CG 3.43Å; K117-E121 PolarHBondContact O-N 3.18Å
118	D	96.6	Very high	93.8	Very high	68 Å²	68	76.3 Å²	76.3	36%	0.364	38%	0.383	S	S	.	.	H	α-helix	trans	-59.7	-29.8	177.2	-62	-2.5	0	0	0	111.9	R114 K122	R114-D118 WeakPolarHBondContact O-CB 3.44Å; R114-D118 PolarHBondContact O-N 2.97Å; D118-K122 WeakPolarHBondContact O-CD 3.48Å; D118-K122 WeakPolarHBondContact O-CE 3.27Å; D118-K122 WeakPolarHBondContact O-CG 3.49Å
119	G	95.7	Very high	93.4	Very high	9 Å²	9	74 Å²	74	9%	0.093	38%	0.377	C	S	.	.	H	α-helix	trans	-73.8	-40.6	174.2	0	0	0	0	0	113.1	L50 A115 L116 K117 K122	L50-G119 VanDerWaalsContact CD1-C 3.49Å; L50-G119 WeakPolarHBondContact CD1-O 3.44Å; A115-G119 PolarHBondContact O-N 3.14Å; A115-G119 VanDerWaalsContact O-N 3.17Å; L116-G119 PolarHBondContact O-N 2.91Å; K117-G119 PolarHBondContact O-N 2.91Å; K117-G119 VanDerWaalsContact O-N 3.15Å; G119-K122 PolarHBondContact O-N 2.8Å
120	Y	96.1	Very high	92.9	Very high	97 Å²	97	78.1 Å²	78.1	38%	0.38	39%	0.389	S	S	.	.	H	α-helix	trans	-63.8	-47.4	176	177.3	-89.1	0	0	0	111.3	L47 L116 K117 K122 V123 E124 L127	L47-Y120 HydrophobicContact CD1-CD2 4.47Å; L47-Y120 HydrophobicContact CD1-CE2 4.49Å; L47-Y120 HydrophobicContact CD2-CD2 3.76Å; L116-Y120 PolarHBondContact O-N 3.37Å; K117-Y120 WeakPolarHBondContact O-CB 3.46Å; K117-Y120 PolarHBondContact O-N 2.84Å; Y120-K122 PolarHBondContact O-N 2.78Å; Y120-K122 VanDerWaalsContact O-N 3.11Å; Y120-V123 CarbonylContact O-C 3.46Å; Y120-V123 WeakPolarHBondContact O-CA 3.41Å; Y120-V123 PolarHBondContact O-N 2.71Å; Y120-E124 HydrophobicContact CD1-CB 4.46Å; Y120-E124 HydrophobicContact CE1-CB 4.12Å; Y120-E124 HydrophobicContact CE1-CG 4.01Å; Y120-E124 PolarHBondContact O-N 3.21Å; Y120-L127 HydrophobicContact CE2-CD1 3.61Å
121	E	95.5	Very high	92.3	Very high	126 Å²	126	81.2 Å²	81.2	59%	0.589	40%	0.397	S	S	*	.	H	α-helix	trans	-54.3	-34.3	178.7	-71.7	175	-178.2	0	0	112.4	K117 V123	K117-E121 WeakPolarHBondContact O-CG 3.43Å; K117-E121 PolarHBondContact O-N 3.18Å; E121-V123 VanDerWaalsContact C-N 3.29Å; E121-V123 PolarHBondContact O-N 3.1Å
122	K	93	Very high	91.7	Very high	157 Å²	157	77.3 Å²	77.3	68%	0.683	38%	0.379	S	S	*	.	H	α-helix	trans	-71.9	-21.4	177.1	-69.1	169.5	-171.6	171.5	0	113.9	D118 G119 Y120	D118-K122 WeakPolarHBondContact O-CD 3.48Å; D118-K122 WeakPolarHBondContact O-CE 3.27Å; D118-K122 WeakPolarHBondContact O-CG 3.49Å; G119-K122 PolarHBondContact O-N 2.8Å; Y120-K122 PolarHBondContact O-N 2.78Å; Y120-K122 VanDerWaalsContact O-N 3.11Å
123	V	92.3	Very high	91.2	Very high	8 Å²	8	79.5 Å²	79.5	5%	0.048	39%	0.391	C	S	.	.	H	α-helix	trans	-102.6	-21.4	-178.2	-179.7	0	0	0	0	111.4	P43 R46 L47 Y120 E121 Q125 D126 L127	P43-V123 HydrophobicContact CB-CG1 3.68Å; R46-V123 HydrophobicContact CB-CG2 4.38Å; L47-V123 HydrophobicContact CD2-CB 4.24Å; L47-V123 HydrophobicContact CD2-CG1 4.29Å; L47-V123 HydrophobicContact CG-CG1 4.25Å; Y120-V123 CarbonylContact O-C 3.46Å; Y120-V123 WeakPolarHBondContact O-CA 3.41Å; Y120-V123 PolarHBondContact O-N 2.71Å; E121-V123 VanDerWaalsContact C-N 3.29Å; E121-V123 PolarHBondContact O-N 3.1Å; V123-Q125 VanDerWaalsContact C-N 3.28Å; V123-Q125 PolarHBondContact O-N 3.47Å; V123-Q125 VanDerWaalsContact O-N 3.16Å; V123-D126 WeakPolarHBondContact O-CA 3.45Å; V123-D126 WeakPolarHBondContact O-CB 3.41Å; V123-D126 PolarHBondContact O-N 3Å; V123-L127 HydrophobicContact CG1-CD2 4.1Å; V123-L127 HydrophobicContact CG1-CG 4.41Å; V123-L127 PolarHBondContact O-N 2.91Å
124	E	89.7	Confident	90.7	Very high	95 Å²	95	79.1 Å²	79.1	44%	0.444	39%	0.388	S	S	.	.	H	α-helix	trans	-52.7	-39.2	-173.5	-173.7	172.8	-144.2	0	0	114.1	R27 Y120 D126 L127	R27-E124 PolarHBondContact NH2-O 2.81Å; Y120-E124 HydrophobicContact CD1-CB 4.46Å; Y120-E124 HydrophobicContact CE1-CB 4.12Å; Y120-E124 HydrophobicContact CE1-CG 4.01Å; Y120-E124 PolarHBondContact O-N 3.21Å; E124-D126 PolarHBondContact O-N 3.27Å; E124-L127 WeakPolarHBondContact O-CB 3.49Å; E124-L127 PolarHBondContact O-N 2.89Å; E124-L127 VanDerWaalsContact O-N 3.1Å
125	Q	85.7	Confident	90.1	Very high	138 Å²	138	72.7 Å²	72.7	65%	0.645	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-25	177.1	65.9	178.7	3.6	0	0	113.7	R27 V123	R27-Q125 PolarHBondContact NE-O 3.46Å; R27-Q125 VanDerWaalsContact NE-O 3.12Å; R27-Q125 PolarHBondContact NH2-O 3.19Å; R27-Q125 VanDerWaalsContact NH2-O 3.1Å; V123-Q125 VanDerWaalsContact C-N 3.28Å; V123-Q125 PolarHBondContact O-N 3.47Å; V123-Q125 VanDerWaalsContact O-N 3.16Å
126	D	85.4	Confident	89.8	Confident	79 Å²	79	71 Å²	71	42%	0.422	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-7.7	179.2	-59.5	-19.1	0	0	0	112.3	P43 R46 V123 E124	P43-D126 HydrophobicContact CB-CB 4.35Å; P43-D126 HydrophobicContact CG-CB 3.7Å; R46-D126 IonicContact CZ-OD2 2.69Å; R46-D126 IonicContact NH2-OD2 3.95Å; R46-D126 PolarHBondContact NH2-OD2 2.93Å; V123-D126 WeakPolarHBondContact O-CA 3.45Å; V123-D126 WeakPolarHBondContact O-CB 3.41Å; V123-D126 PolarHBondContact O-N 3Å; E124-D126 PolarHBondContact O-N 3.27Å
127	L	88.1	Confident	89.5	Confident	29 Å²	29	69.3 Å²	69.3	15%	0.152	34%	0.344	C	S	.	.	S	Bend	trans	-78.6	151.7	179.1	-61.1	-179.7	0	0	0	111.3	R27 P43 L47 Y120 V123 E124	R27-L127 PolarHBondContact NH2-O 3.42Å; P43-L127 HydrophobicContact CB-CD2 3.76Å; L47-L127 HydrophobicContact CD1-CD1 4.31Å; L47-L127 HydrophobicContact CD1-CD2 4Å; Y120-L127 HydrophobicContact CE2-CD1 3.61Å; V123-L127 HydrophobicContact CG1-CD2 4.1Å; V123-L127 HydrophobicContact CG1-CG 4.41Å; V123-L127 PolarHBondContact O-N 2.91Å; E124-L127 WeakPolarHBondContact O-CB 3.49Å; E124-L127 PolarHBondContact O-N 2.89Å; E124-L127 VanDerWaalsContact O-N 3.1Å
128	P	87.9	Confident	89.1	Confident	66 Å²	66	66.5 Å²	66.5	43%	0.429	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-56.5	147.8	171.2	-22.9	34	0	0	0	111.9	T30 A40 D132	T30-P128 HydrophobicContact CG2-CG 4.41Å; A40-P128 HydrophobicContact CB-CG 4.44Å; P128-D132 WeakPolarHBondContact CA-OD2 3.43Å; P128-D132 HydrophobicContact CB-CB 3.92Å
129	A	86.8	Confident	88.8	Confident	31 Å²	31	63.2 Å²	63.2	26%	0.256	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-91.9	172	175.6	0	0	0	0	0	111.3	E131 D132 L133	A129-E131 WeakPolarHBondContact CB-OE2 3.45Å; A129-E131 PolarHBondContact O-N 2.79Å; A129-D132 PolarHBondContact N-OD2 3.5Å; A129-D132 VanDerWaalsContact O-CB 3.32Å; A129-D132 WeakPolarHBondContact O-CB 3.47Å; A129-D132 PolarHBondContact O-N 2.92Å; A129-L133 PolarHBondContact O-N 3.19Å
130	F	83.4	Confident	88.6	Confident	118 Å²	118	64.7 Å²	64.7	52%	0.518	32%	0.318	S	S	.	.	H	α-helix	trans	-59.9	-34.9	178.2	179	-98.3	0	0	0	112	D132 L133 E134	F130-D132 PolarHBondContact O-N 3.05Å; F130-L133 WeakPolarHBondContact O-CB 3.43Å; F130-L133 PolarHBondContact O-N 3.33Å; F130-L133 VanDerWaalsContact O-N 3.08Å; F130-E134 PolarHBondContact O-N 3.4Å
131	E	83.3	Confident	88.5	Confident	124 Å²	124	60.4 Å²	60.4	58%	0.579	30%	0.301	S	S	*	.	H	α-helix	trans	-63	-26	176.5	-57.8	81.6	179.3	0	0	112.3	A129 G135	A129-E131 WeakPolarHBondContact CB-OE2 3.45Å; A129-E131 PolarHBondContact O-N 2.79Å; E131-G135 PolarHBondContact O-N 3.42Å
132	D	84	Confident	88.2	Confident	19 Å²	19	56.4 Å²	56.4	10%	0.102	28%	0.281	C	S	.	.	H	α-helix	trans	-72.6	-38.8	174.3	-68.5	-45.5	0	0	0	111.8	D29 T30 F31 P128 A129 F130 G135 A136	D29-D132 WeakPolarHBondContact CA-OD1 3.13Å; T30-D132 PolarHBondContact N-OD1 2.9Å; T30-D132 PolarHBondContact OG1-OD2 3.42Å; F31-D132 HydrophobicContact CD1-CB 4.44Å; F31-D132 WeakPolarHBondContact CD1-OD1 3.36Å; P128-D132 WeakPolarHBondContact CA-OD2 3.43Å; P128-D132 HydrophobicContact CB-CB 3.92Å; A129-D132 PolarHBondContact N-OD2 3.5Å; A129-D132 VanDerWaalsContact O-CB 3.32Å; A129-D132 WeakPolarHBondContact O-CB 3.47Å; A129-D132 PolarHBondContact O-N 2.92Å; F130-D132 PolarHBondContact O-N 3.05Å; D132-G135 PolarHBondContact O-N 2.81Å; D132-A136 WeakPolarHBondContact O-CB 3.37Å; D132-A136 PolarHBondContact O-N 2.62Å
133	L	86.3	Confident	88.2	Confident	82 Å²	82	49.2 Å²	49.2	43%	0.429	25%	0.25	S	C	.	.	H	α-helix	trans	-65	-45.6	174.7	179.7	62.1	0	0	0	110.5	A129 F130 G135 A136 A137	A129-L133 PolarHBondContact O-N 3.19Å; F130-L133 WeakPolarHBondContact O-CB 3.43Å; F130-L133 PolarHBondContact O-N 3.33Å; F130-L133 VanDerWaalsContact O-N 3.08Å; L133-G135 VanDerWaalsContact C-N 3.34Å; L133-G135 PolarHBondContact O-N 3.48Å; L133-A136 PolarHBondContact O-N 3.09Å; L133-A137 PolarHBondContact O-N 2.91Å
134	E	87.4	Confident	88.2	Confident	48 Å²	48	49.5 Å²	49.5	22%	0.224	25%	0.251	C	S	.	.	H	α-helix	trans	-59.6	-45.2	175	-166.8	-173.8	163	0	0	111.5	F130 A136 A137 R138 V190	F130-E134 PolarHBondContact O-N 3.4Å; E134-A136 VanDerWaalsContact C-N 3.33Å; E134-A136 PolarHBondContact O-N 2.95Å; E134-A137 PolarHBondContact O-N 3.16Å; E134-R138 WeakPolarHBondContact O-CB 3.49Å; E134-R138 WeakPolarHBondContact O-CG 3.06Å; E134-R138 PolarHBondContact O-N 3.36Å; E134-R138 IonicContact OE1-CZ 3.87Å; E134-R138 VanDerWaalsContact OE1-CZ 3.25Å; E134-R138 IonicContact OE1-NE 2.77Å; E134-R138 PolarHBondContact OE1-NE 3.41Å; E134-R138 IonicContact OE1-NH2 3.29Å; E134-R138 PolarHBondContact OE1-NH2 2.85Å; E134-V190 HydrophobicContact CG-CG1 3.75Å; E134-V190 HydrophobicContact CG-CG2 4.43Å
135	G	84.6	Confident	88.2	Confident	8 Å²	8	45.9 Å²	45.9	8%	0.082	23%	0.234	C	C	.	.	H	α-helix	trans	-60.3	-39.3	175.7	0	0	0	0	0	113.3	E131 D132 L133 A139	E131-G135 PolarHBondContact O-N 3.42Å; D132-G135 PolarHBondContact O-N 2.81Å; L133-G135 VanDerWaalsContact C-N 3.34Å; L133-G135 PolarHBondContact O-N 3.48Å; G135-A139 PolarHBondContact O-N 2.93Å
136	A	89.3	Confident	88.5	Confident	25 Å²	25	39.6 Å²	39.6	21%	0.207	21%	0.205	C	C	.	.	H	α-helix	trans	-68.5	-43.6	175.7	0	0	0	0	0	112.3	D132 L133 E134 R138 A139 L140 I433	D132-A136 WeakPolarHBondContact O-CB 3.37Å; D132-A136 PolarHBondContact O-N 2.62Å; L133-A136 PolarHBondContact O-N 3.09Å; E134-A136 VanDerWaalsContact C-N 3.33Å; E134-A136 PolarHBondContact O-N 2.95Å; A136-R138 PolarHBondContact O-N 2.91Å; A136-A139 WeakPolarHBondContact O-CA 3.39Å; A136-A139 WeakPolarHBondContact O-CB 3.45Å; A136-A139 PolarHBondContact O-N 2.85Å; A136-A139 VanDerWaalsContact O-N 3.07Å; A136-L140 PolarHBondContact O-N 3.47Å; A136-I433 HydrophobicContact CB-CD1 4.35Å
137	A	91.9	Very high	88.8	Confident	4 Å²	4	35.9 Å²	35.9	3%	0.033	19%	0.185	C	C	.	.	H	α-helix	trans	-60.6	-46.3	175.4	0	0	0	0	0	111.4	L133 E134 A139 L140 M141 V187 V190	L133-A137 PolarHBondContact O-N 2.91Å; E134-A137 PolarHBondContact O-N 3.16Å; A137-A139 PolarHBondContact O-N 3.19Å; A137-L140 PolarHBondContact O-N 2.93Å; A137-L140 VanDerWaalsContact O-N 3.09Å; A137-M141 WeakPolarHBondContact O-CG 3.45Å; A137-M141 PolarHBondContact O-N 3.04Å; A137-V187 HydrophobicContact CB-CG1 4.29Å; A137-V187 HydrophobicContact CB-CG2 4.39Å; A137-V190 HydrophobicContact CB-CB 3.92Å; A137-V190 HydrophobicContact CB-CG1 3.98Å; A137-V190 HydrophobicContact CB-CG2 3.9Å
138	R	89.3	Confident	88.9	Confident	65 Å²	65	38.4 Å²	38.4	25%	0.245	20%	0.197	C	C	.	.	H	α-helix	trans	-60.1	-30.4	173.4	-69.3	177.7	-177.3	-158.4	6.8	113	E134 A136 M141 R142 V190 M194 E386	E134-R138 WeakPolarHBondContact O-CB 3.49Å; E134-R138 WeakPolarHBondContact O-CG 3.06Å; E134-R138 PolarHBondContact O-N 3.36Å; E134-R138 IonicContact OE1-CZ 3.87Å; E134-R138 VanDerWaalsContact OE1-CZ 3.25Å; E134-R138 IonicContact OE1-NE 2.77Å; E134-R138 PolarHBondContact OE1-NE 3.41Å; E134-R138 IonicContact OE1-NH2 3.29Å; E134-R138 PolarHBondContact OE1-NH2 2.85Å; A136-R138 PolarHBondContact O-N 2.91Å; R138-M141 HydrophobicContact CB-CE 4.16Å; R138-M141 HydrophobicContact CG-CE 3.75Å; R138-R142 WeakPolarHBondContact O-CB 3.45Å; R138-R142 PolarHBondContact O-N 3.23Å; R138-V190 HydrophobicContact CG-CG1 4.42Å; R138-M194 HydrophobicContact CG-SD 4.19Å; R138-M194 PolarHBondContact NE-SD 2.89Å; R138-M194 VanDerWaalsContact NE-SD 3.4Å; R138-E386 IonicContact CZ-OE1 3.57Å; R138-E386 IonicContact NH1-OE1 3.57Å; R138-E386 PolarHBondContact NH1-OE1 3Å; R138-E386 IonicContact NH1-OE2 3.62Å
139	A	88.8	Confident	89.1	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-69.4	-41.1	173.2	0	0	0	0	0	113.4	G135 A136 A137 M141 R142 L143 I433	G135-A139 PolarHBondContact O-N 2.93Å; A136-A139 WeakPolarHBondContact O-CA 3.39Å; A136-A139 WeakPolarHBondContact O-CB 3.45Å; A136-A139 PolarHBondContact O-N 2.85Å; A136-A139 VanDerWaalsContact O-N 3.07Å; A137-A139 PolarHBondContact O-N 3.19Å; A139-M141 VanDerWaalsContact C-N 3.34Å; A139-R142 PolarHBondContact O-N 3.45Å; A139-L143 WeakPolarHBondContact O-CG 3.35Å; A139-L143 PolarHBondContact O-N 2.88Å; A139-I433 HydrophobicContact CB-CB 4.16Å; A139-I433 HydrophobicContact CB-CG2 3.77Å; A139-I433 WeakPolarHBondContact CB-O 3.45Å
140	L	92.9	Very high	89.4	Confident	39 Å²	39	37 Å²	37	20%	0.204	18%	0.182	C	C	.	.	H	α-helix	trans	-61.9	-43.2	174.2	-66	175.7	0	0	0	111.5	A136 A137 R142 L143 Q144 L154 V187 W203	A136-L140 PolarHBondContact O-N 3.47Å; A137-L140 PolarHBondContact O-N 2.93Å; A137-L140 VanDerWaalsContact O-N 3.09Å; L140-R142 PolarHBondContact O-N 3.41Å; L140-L143 PolarHBondContact O-N 3.22Å; L140-Q144 WeakPolarHBondContact O-CB 3.39Å; L140-Q144 PolarHBondContact O-N 3.34Å; L140-L154 HydrophobicContact CD2-CD2 4.46Å; L140-V187 HydrophobicContact CD1-CG2 3.77Å; L140-W203 HydrophobicContact CB-CZ2 4.09Å; L140-W203 HydrophobicContact CD1-CH2 4.2Å; L140-W203 HydrophobicContact CD1-CZ2 4.48Å
141	M	92.2	Very high	90	Very high	8 Å²	8	31.8 Å²	31.8	4%	0.039	16%	0.16	C	C	.	.	H	α-helix	trans	-60.7	-43.3	175.5	-65.8	-172.5	-74.5	0	0	112.3	A137 R138 A139 L143 Q144 D145 V187 V190 A191 H199	A137-M141 WeakPolarHBondContact O-CG 3.45Å; A137-M141 PolarHBondContact O-N 3.04Å; R138-M141 HydrophobicContact CB-CE 4.16Å; R138-M141 HydrophobicContact CG-CE 3.75Å; A139-M141 VanDerWaalsContact C-N 3.34Å; M141-L143 VanDerWaalsContact C-N 3.35Å; M141-L143 PolarHBondContact O-N 2.8Å; M141-Q144 VanDerWaalsContact O-CB 3.32Å; M141-Q144 WeakPolarHBondContact O-CB 3.38Å; M141-Q144 PolarHBondContact O-N 2.91Å; M141-D145 PolarHBondContact O-N 3.44Å; M141-V187 HydrophobicContact CG-CG1 4.46Å; M141-V190 HydrophobicContact CE-CG1 4.21Å; M141-A191 HydrophobicContact CE-CB 4.38Å; M141-A191 HydrophobicContact SD-CB 3.56Å; M141-A191 VanDerWaalsContact SD-CB 3.56Å; M141-H199 HydrophobicContact CG-CB 3.98Å; M141-H199 HydrophobicContact SD-CB 3.41Å; M141-H199 WeakPolarHBondContact SD-CB 3.48Å
142	R	90	Very high	90.5	Very high	42 Å²	42	30.1 Å²	30.1	16%	0.158	15%	0.151	C	C	.	.	H	α-helix	trans	-62.9	-39.2	174.5	171	173.2	44.4	-94.8	-9.6	113.1	R138 A139 L140 Q144 D145 V146 G434 H436 P514	R138-R142 WeakPolarHBondContact O-CB 3.45Å; R138-R142 PolarHBondContact O-N 3.23Å; A139-R142 PolarHBondContact O-N 3.45Å; L140-R142 PolarHBondContact O-N 3.41Å; R142-Q144 VanDerWaalsContact C-N 3.35Å; R142-D145 PolarHBondContact O-N 2.94Å; R142-V146 HydrophobicContact CG-CG2 4.25Å; R142-V146 WeakPolarHBondContact O-CB 3.38Å; R142-V146 WeakPolarHBondContact O-CG2 3.5Å; R142-V146 PolarHBondContact O-N 2.98Å; R142-G434 PolarHBondContact NE-O 3.34Å; R142-H436 WeakPolarHBondContact CD-CE1 3.47Å; R142-H436 WeakPolarHBondContact CD-ND1 3.35Å; R142-H436 PolarHBondContact NE-CE1 3.25Å; R142-H436 PolarHBondContact NE-ND1 3.15Å; R142-H436 VanDerWaalsContact NE-ND1 3.16Å; R142-P514 HydrophobicContact CG-CG 4.19Å
143	L	92.3	Very high	90.9	Very high	5 Å²	5	29.4 Å²	29.4	3%	0.026	15%	0.148	C	C	.	.	H	α-helix	trans	-65.6	-41.8	175	-69	-179.9	0	0	0	111	A139 L140 M141 D145 Y147 L149 P514 L516	A139-L143 WeakPolarHBondContact O-CG 3.35Å; A139-L143 PolarHBondContact O-N 2.88Å; L140-L143 PolarHBondContact O-N 3.22Å; M141-L143 VanDerWaalsContact C-N 3.35Å; M141-L143 PolarHBondContact O-N 2.8Å; L143-D145 VanDerWaalsContact C-N 3.31Å; L143-D145 PolarHBondContact O-N 2.98Å; L143-Y147 HydrophobicContact CD2-CD2 4.13Å; L143-Y147 HydrophobicContact CD2-CE2 3.98Å; L143-Y147 WeakPolarHBondContact O-CB 3.34Å; L143-Y147 PolarHBondContact O-N 2.96Å; L143-Y147 VanDerWaalsContact O-N 3.14Å; L143-L149 HydrophobicContact CB-CD1 3.96Å; L143-P514 HydrophobicContact CD2-CB 3.64Å; L143-L516 HydrophobicContact CD2-CD2 4.03Å
144	Q	92.8	Very high	91.1	Very high	15 Å²	15	26 Å²	26	7%	0.07	13%	0.13	C	C	.	.	H	α-helix	trans	-54.2	-49	173.2	166	-175.9	-9.3	0	0	111.1	L140 M141 R142 M148 L149 V151	L140-Q144 WeakPolarHBondContact O-CB 3.39Å; L140-Q144 PolarHBondContact O-N 3.34Å; M141-Q144 VanDerWaalsContact O-CB 3.32Å; M141-Q144 WeakPolarHBondContact O-CB 3.38Å; M141-Q144 PolarHBondContact O-N 2.91Å; R142-Q144 VanDerWaalsContact C-N 3.35Å; Q144-M148 CarbonylContact O-C 3.57Å; Q144-M148 WeakPolarHBondContact O-CA 3.4Å; Q144-M148 PolarHBondContact O-N 2.92Å; Q144-L149 PolarHBondContact O-N 3.05Å; Q144-V151 HydrophobicContact CG-CG2 4.5Å
145	D	90.8	Very high	91.5	Very high	19 Å²	19	23.9 Å²	23.9	10%	0.102	12%	0.12	C	C	.	.	H	α-helix	trans	-63.8	-61.5	178.9	-82.1	-25.4	0	0	0	112.8	M141 R142 L143 Y147 M148 H199 R289	M141-D145 PolarHBondContact O-N 3.44Å; R142-D145 PolarHBondContact O-N 2.94Å; L143-D145 VanDerWaalsContact C-N 3.31Å; L143-D145 PolarHBondContact O-N 2.98Å; D145-Y147 VanDerWaalsContact C-N 3.25Å; D145-Y147 PolarHBondContact O-N 3.2Å; D145-M148 PolarHBondContact O-N 3.5Å; D145-M148 VanDerWaalsContact O-N 3.17Å; D145-H199 VanDerWaalsContact CG-NE2 3.25Å; D145-H199 IonicContact OD1-CE1 3.56Å; D145-H199 IonicContact OD1-NE2 3.54Å; D145-H199 PolarHBondContact OD1-NE2 3.25Å; D145-H199 IonicContact OD2-CE1 3.87Å; D145-H199 PolarHBondContact OD2-CE1 2.94Å; D145-H199 VanDerWaalsContact OD2-CE1 3.27Å; D145-H199 IonicContact OD2-NE2 3.12Å; D145-H199 PolarHBondContact OD2-NE2 3.35Å; D145-R289 IonicContact OD1-CZ 3.83Å; D145-R289 IonicContact OD1-NE 2.76Å; D145-R289 PolarHBondContact OD1-NE 3.08Å; D145-R289 VanDerWaalsContact OD1-NE 3.11Å; D145-R289 IonicContact OD1-NH2 2.98Å; D145-R289 IonicContact OD2-CZ 2.72Å; D145-R289 IonicContact OD2-NE 3.63Å; D145-R289 PolarHBondContact OD2-NE 2.95Å; D145-R289 IonicContact OD2-NH2 3.88Å; D145-R289 PolarHBondContact OD2-NH2 2.65Å
146	V	90.6	Very high	91.9	Very high	5 Å²	5	29.6 Å²	29.6	3%	0.03	14%	0.139	C	C	.	.	H	α-helix	trans	-62.7	-36.9	-168.2	170.5	0	0	0	0	111.2	R142 Y301 E302 C305 Q306 P514	R142-V146 HydrophobicContact CG-CG2 4.25Å; R142-V146 WeakPolarHBondContact O-CB 3.38Å; R142-V146 WeakPolarHBondContact O-CG2 3.5Å; R142-V146 PolarHBondContact O-N 2.98Å; V146-Y301 HydrophobicContact CG2-CE1 4.46Å; V146-E302 HydrophobicContact CB-CG 4.39Å; V146-E302 HydrophobicContact CG1-CG 4.47Å; V146-E302 HydrophobicContact CG2-CG 4.04Å; V146-C305 HydrophobicContact CG1-CB 3.58Å; V146-Q306 WeakPolarHBondContact O-CG 3.24Å; V146-Q306 PolarHBondContact O-NE2 3.45Å; V146-P514 HydrophobicContact CB-CG 4.13Å; V146-P514 HydrophobicContact CG1-CG 4Å; V146-P514 HydrophobicContact CG2-CG 3.89Å
147	Y	91.6	Very high	91.9	Very high	1 Å²	1	28.9 Å²	28.9	0%	0.004	13%	0.134	C	C	.	.	H	α-helix	trans	-103.4	5.5	-177.8	-63.8	-76	0	0	0	113.9	L143 D145 L149 C305 L308 G473 G474 P514 L516	L143-Y147 HydrophobicContact CD2-CD2 4.13Å; L143-Y147 HydrophobicContact CD2-CE2 3.98Å; L143-Y147 WeakPolarHBondContact O-CB 3.34Å; L143-Y147 PolarHBondContact O-N 2.96Å; L143-Y147 VanDerWaalsContact O-N 3.14Å; D145-Y147 VanDerWaalsContact C-N 3.25Å; D145-Y147 PolarHBondContact O-N 3.2Å; Y147-L149 VanDerWaalsContact C-N 3.25Å; Y147-L149 PolarHBondContact O-N 3.42Å; Y147-C305 HydrophobicContact CE1-CB 4.24Å; Y147-C305 WeakPolarHBondContact CE1-O 3.39Å; Y147-L308 HydrophobicContact CD1-CD2 4.24Å; Y147-L308 HydrophobicContact CE1-CD2 3.75Å; Y147-G473 WeakPolarHBondContact OH-CA 3.49Å; Y147-G474 PolarHBondContact OH-N 2.96Å; Y147-P514 HydrophobicContact CE2-CB 4.16Å; Y147-P514 HydrophobicContact CE2-CG 4.38Å; Y147-P514 WeakPolarHBondContact CE2-O 3.5Å; Y147-P514 PolarHBondContact OH-O 3.35Å; Y147-L516 HydrophobicContact CD1-CD1 3.69Å; Y147-L516 HydrophobicContact CD1-CG 4.3Å; Y147-L516 HydrophobicContact CD2-CD1 3.92Å; Y147-L516 HydrophobicContact CD2-CD2 3.42Å; Y147-L516 VanDerWaalsContact CD2-CD2 3.42Å; Y147-L516 HydrophobicContact CD2-CG 3.6Å; Y147-L516 HydrophobicContact CE1-CD1 3.66Å; Y147-L516 HydrophobicContact CE1-CG 4.16Å; Y147-L516 HydrophobicContact CE2-CD1 3.89Å; Y147-L516 HydrophobicContact CE2-CD2 3.77Å; Y147-L516 HydrophobicContact CE2-CG 3.43Å; Y147-L516 VanDerWaalsContact CE2-CG 3.43Å; Y147-L516 HydrophobicContact CG-CD1 3.8Å; Y147-L516 HydrophobicContact CG-CD2 3.87Å; Y147-L516 HydrophobicContact CG-CG 4.02Å
148	M	91.2	Very high	91.8	Very high	82 Å²	82	29.6 Å²	29.6	40%	0.404	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	45.2	-175.8	-58.7	-177.8	-62.6	0	0	112.3	Q144 D145 R161 Q306	Q144-M148 CarbonylContact O-C 3.57Å; Q144-M148 WeakPolarHBondContact O-CA 3.4Å; Q144-M148 PolarHBondContact O-N 2.92Å; D145-M148 PolarHBondContact O-N 3.5Å; D145-M148 VanDerWaalsContact O-N 3.17Å; M148-R161 HydrophobicContact CB-CB 4.45Å; M148-R161 WeakPolarHBondContact O-CA 3.43Å; M148-R161 WeakPolarHBondContact O-CB 3.3Å; M148-Q306 HydrophobicContact CE-CG 4.48Å
149	L	92.9	Very high	91.9	Very high	9 Å²	9	27.9 Å²	27.9	5%	0.047	13%	0.133	C	C	.	.	B	Isolated β-bridge	trans	-73.7	139.3	-175.7	-53.1	174.3	0	0	0	111.1	L143 Q144 Y147 L154 F159 Q160 L170 L516	L143-L149 HydrophobicContact CB-CD1 3.96Å; Q144-L149 PolarHBondContact O-N 3.05Å; Y147-L149 VanDerWaalsContact C-N 3.25Å; Y147-L149 PolarHBondContact O-N 3.42Å; L149-L154 HydrophobicContact CD1-CD1 4.32Å; L149-L154 HydrophobicContact CD1-CD2 4.49Å; L149-F159 HydrophobicContact CD1-CD1 3.93Å; L149-F159 HydrophobicContact CD2-CB 4.27Å; L149-Q160 CarbonylContact C-O 3.46Å; L149-Q160 WeakPolarHBondContact CA-O 3.37Å; L149-L170 HydrophobicContact CD2-CD1 3.58Å; L149-L516 HydrophobicContact CD1-CD2 3.92Å
150	N	92.9	Very high	92	Very high	59 Å²	59	30.1 Å²	30.1	32%	0.316	14%	0.143	S	C	.	.			trans	-77.6	125.3	170	177.2	-94	0	0	0	110.4	K152 G153 L154 Q160 V162	N150-K152 VanDerWaalsContact C-N 3.33Å; N150-K152 PolarHBondContact O-N 3.03Å; N150-K152 WeakPolarHBondContact OD1-CB 3.25Å; N150-K152 PolarHBondContact OD1-N 2.94Å; N150-G153 PolarHBondContact O-N 3.28Å; N150-G153 VanDerWaalsContact O-N 3.16Å; N150-G153 PolarHBondContact OD1-N 3.26Å; N150-L154 PolarHBondContact O-N 3.22Å; N150-Q160 PolarHBondContact N-O 2.93Å; N150-V162 HydrophobicContact CB-CG2 3.77Å
151	V	94.8	Very high	91.8	Very high	9 Å²	9	31.5 Å²	31.5	6%	0.055	15%	0.146	C	C	.	.	H	α-helix	trans	-59.4	-41	-177.4	172.5	0	0	0	0	112.5	Q144 G153 L154 A155 P202 W203 E206	Q144-V151 HydrophobicContact CG-CG2 4.5Å; V151-G153 PolarHBondContact O-N 3.27Å; V151-L154 WeakPolarHBondContact O-CB 3.41Å; V151-L154 PolarHBondContact O-N 3.05Å; V151-A155 WeakPolarHBondContact O-CB 3.35Å; V151-A155 PolarHBondContact O-N 3.17Å; V151-P202 HydrophobicContact CB-CB 4.37Å; V151-P202 HydrophobicContact CG2-CB 3.91Å; V151-P202 HydrophobicContact CG2-CG 4.29Å; V151-W203 HydrophobicContact CG1-CD2 3.59Å; V151-W203 HydrophobicContact CG1-CE3 3.72Å; V151-W203 HydrophobicContact CG1-CG 4.01Å; V151-W203 HydrophobicContact CG1-CH2 4.42Å; V151-W203 HydrophobicContact CG1-CZ2 4.31Å; V151-W203 HydrophobicContact CG1-CZ3 4.13Å; V151-W203 HydrophobicContact CG2-CD2 4.43Å; V151-W203 HydrophobicContact CG2-CG 4.49Å; V151-E206 HydrophobicContact CG1-CB 4.17Å
152	K	93.6	Very high	91.3	Very high	89 Å²	89	34.1 Å²	34.1	39%	0.387	16%	0.162	S	C	.	.	H	α-helix	trans	-64.8	-38.6	177.4	177	172.6	-169.3	167.3	0	112.8	N150 R156 E206	N150-K152 VanDerWaalsContact C-N 3.33Å; N150-K152 PolarHBondContact O-N 3.03Å; N150-K152 WeakPolarHBondContact OD1-CB 3.25Å; N150-K152 PolarHBondContact OD1-N 2.94Å; K152-R156 VanDerWaalsContact CE-CZ 3.49Å; K152-R156 WeakPolarHBondContact O-CD 3.39Å; K152-R156 VanDerWaalsContact O-CG 3.28Å; K152-R156 WeakPolarHBondContact O-CG 3.41Å; K152-R156 PolarHBondContact O-N 3.38Å; K152-E206 WeakPolarHBondContact CB-OE2 3.45Å; K152-E206 WeakPolarHBondContact CG-OE2 3.41Å
153	G	91.9	Very high	90.8	Very high	4 Å²	4	36 Å²	36	4%	0.041	18%	0.178	C	C	.	.	H	α-helix	trans	-61.2	-50	170.3	0	0	0	0	0	110.9	N150 V151 A155 R156 G157 V158	N150-G153 PolarHBondContact O-N 3.28Å; N150-G153 VanDerWaalsContact O-N 3.16Å; N150-G153 PolarHBondContact OD1-N 3.26Å; V151-G153 PolarHBondContact O-N 3.27Å; G153-A155 PolarHBondContact O-N 3.01Å; G153-R156 CarbonylContact O-C 3.58Å; G153-R156 WeakPolarHBondContact O-CA 3.33Å; G153-R156 WeakPolarHBondContact O-CB 3.36Å; G153-R156 PolarHBondContact O-N 3.34Å; G153-G157 PolarHBondContact O-N 3.13Å; G153-V158 CarbonylContact C-O 3.45Å; G153-V158 WeakPolarHBondContact CA-O 3.46Å; G153-V158 PolarHBondContact O-N 3.25Å
154	L	92.4	Very high	90.1	Very high	11 Å²	11	39.4 Å²	39.4	6%	0.058	21%	0.214	C	C	.	.	H	α-helix	trans	-60.6	-43.3	-178.7	-171.8	60.1	0	0	0	112.1	L140 L149 N150 V151 R156 G157 V158 F159 W203	L140-L154 HydrophobicContact CD2-CD2 4.46Å; L149-L154 HydrophobicContact CD1-CD1 4.32Å; L149-L154 HydrophobicContact CD1-CD2 4.49Å; N150-L154 PolarHBondContact O-N 3.22Å; V151-L154 WeakPolarHBondContact O-CB 3.41Å; V151-L154 PolarHBondContact O-N 3.05Å; L154-R156 PolarHBondContact O-N 2.94Å; L154-G157 WeakPolarHBondContact O-CA 3.27Å; L154-G157 PolarHBondContact O-N 3.4Å; L154-V158 PolarHBondContact N-O 3.44Å; L154-F159 HydrophobicContact CD1-CD1 3.81Å; L154-F159 HydrophobicContact CD1-CE1 3.51Å; L154-F159 HydrophobicContact CD1-CZ 3.97Å; L154-W203 HydrophobicContact CD2-CH2 3.84Å; L154-W203 HydrophobicContact CD2-CZ2 3.62Å; L154-W203 HydrophobicContact CG-CH2 4.2Å; L154-W203 HydrophobicContact CG-CZ2 4.46Å
155	A	94.6	Very high	89.4	Confident	2 Å²	2	44.7 Å²	44.7	2%	0.017	25%	0.253	C	S	.	.	H	α-helix	trans	-61.1	-25.7	174.3	0	0	0	0	0	112.8	V151 G153 G157 S178 L179 E206	V151-A155 WeakPolarHBondContact O-CB 3.35Å; V151-A155 PolarHBondContact O-N 3.17Å; G153-A155 PolarHBondContact O-N 3.01Å; A155-G157 VanDerWaalsContact C-N 3.35Å; A155-S178 CarbonylContact O-C 3.2Å; A155-S178 WeakPolarHBondContact O-CA 3.38Å; A155-L179 HydrophobicContact CB-CB 4.41Å; A155-L179 PolarHBondContact O-N 3.17Å; A155-E206 HydrophobicContact CB-CG 3.83Å
156	R	92.4	Very high	89	Confident	128 Å²	128	46.3 Å²	46.3	48%	0.483	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	-1.2	174.6	-66.5	167.5	-177.3	-155.1	-10.7	113.2	K152 G153 L154 F177	K152-R156 VanDerWaalsContact CE-CZ 3.49Å; K152-R156 WeakPolarHBondContact O-CD 3.39Å; K152-R156 VanDerWaalsContact O-CG 3.28Å; K152-R156 WeakPolarHBondContact O-CG 3.41Å; K152-R156 PolarHBondContact O-N 3.38Å; G153-R156 CarbonylContact O-C 3.58Å; G153-R156 WeakPolarHBondContact O-CA 3.33Å; G153-R156 WeakPolarHBondContact O-CB 3.36Å; G153-R156 PolarHBondContact O-N 3.34Å; L154-R156 PolarHBondContact O-N 2.94Å; R156-F177 CarbonylContact C-O 3.6Å
157	G	90	Very high	88.8	Confident	10 Å²	10	51.2 Å²	51.2	10%	0.103	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	18.9	-176	0	0	0	0	0	114	G153 L154 A155 P173 F177	G153-G157 PolarHBondContact O-N 3.13Å; L154-G157 WeakPolarHBondContact O-CA 3.27Å; L154-G157 PolarHBondContact O-N 3.4Å; A155-G157 VanDerWaalsContact C-N 3.35Å; G157-P173 WeakPolarHBondContact O-CD 3.41Å; G157-P173 WeakPolarHBondContact O-CG 3.44Å; G157-F177 WeakPolarHBondContact CA-O 3.29Å; G157-F177 PolarHBondContact N-O 3.22Å
158	V	90.8	Very high	88.5	Confident	19 Å²	19	53.4 Å²	53.4	12%	0.115	31%	0.308	C	S	.	.			trans	-113.2	121	178.6	-171.1	0	0	0	0	109.7	G153 L154 Q160 L176	G153-V158 CarbonylContact C-O 3.45Å; G153-V158 WeakPolarHBondContact CA-O 3.46Å; G153-V158 PolarHBondContact O-N 3.25Å; L154-V158 PolarHBondContact N-O 3.44Å; V158-Q160 HydrophobicContact CG1-CG 3.79Å; V158-Q160 PolarHBondContact O-N 3.42Å; V158-L176 HydrophobicContact CG2-CD2 3.68Å
159	F	91	Very high	88.3	Confident	30 Å²	30	54.2 Å²	54.2	13%	0.132	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	91.5	-176	-63	-106.1	0	0	0	108.5	L149 L154 L170 Y171 L516 V517	L149-F159 HydrophobicContact CD1-CD1 3.93Å; L149-F159 HydrophobicContact CD2-CB 4.27Å; L154-F159 HydrophobicContact CD1-CD1 3.81Å; L154-F159 HydrophobicContact CD1-CE1 3.51Å; L154-F159 HydrophobicContact CD1-CZ 3.97Å; F159-L170 WeakPolarHBondContact O-CA 3.5Å; F159-L170 WeakPolarHBondContact O-CB 3.4Å; F159-L170 PolarHBondContact O-N 3.24Å; F159-Y171 WeakPolarHBondContact CB-O 3.21Å; F159-Y171 AromaticContact CD2-CD1 3.75Å; F159-Y171 HydrophobicContact CD2-CD1 3.75Å; F159-Y171 HydrophobicContact CE2-CD1 4.12Å; F159-Y171 PolarHBondContact N-O 3.44Å; F159-Y171 PolarHBondContact O-N 3.3Å; F159-L516 HydrophobicContact CD1-CD2 3.88Å; F159-L516 HydrophobicContact CE1-CD2 4.38Å; F159-V517 HydrophobicContact CE2-CG2 4.22Å; F159-V517 HydrophobicContact CZ-CG2 4.22Å
160	Q	91	Very high	87.9	Confident	47 Å²	47	55 Å²	55	22%	0.22	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	137.3	-175.9	-88.4	165.6	-11	0	0	110.8	L149 N150 V158 I167 T168 D169	L149-Q160 CarbonylContact C-O 3.46Å; L149-Q160 WeakPolarHBondContact CA-O 3.37Å; N150-Q160 PolarHBondContact N-O 2.93Å; V158-Q160 HydrophobicContact CG1-CG 3.79Å; V158-Q160 PolarHBondContact O-N 3.42Å; Q160-I167 HydrophobicContact CB-CG2 4.21Å; Q160-I167 HydrophobicContact CG-CG2 3.82Å; Q160-T168 WeakPolarHBondContact CA-O 3.19Å; Q160-D169 VanDerWaalsContact CD-OD1 3.3Å; Q160-D169 WeakPolarHBondContact CG-OD1 3.29Å; Q160-D169 PolarHBondContact NE2-OD1 3.26Å
161	R	88.3	Confident	87.7	Confident	67 Å²	67	55.2 Å²	55.2	25%	0.253	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	142	162.9	64.9	175.1	-171.8	-158.5	0.8	110.1	M148 T168 L170	M148-R161 HydrophobicContact CB-CB 4.45Å; M148-R161 WeakPolarHBondContact O-CA 3.43Å; M148-R161 WeakPolarHBondContact O-CB 3.3Å; R161-T168 PolarHBondContact N-O 3.08Å; R161-T168 VanDerWaalsContact NE-CB 3.35Å; R161-T168 PolarHBondContact NE-OG1 3Å; R161-T168 PolarHBondContact O-N 3.49Å; R161-L170 HydrophobicContact CB-CD1 4.35Å; R161-L170 HydrophobicContact CG-CD1 4.47Å; R161-L170 HydrophobicContact CG-CG 4.46Å
162	V	82	Confident	87.2	Confident	64 Å²	64	58 Å²	58	39%	0.388	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	119.8	178.1	-178.6	0	0	0	0	108.4	N150 A166 I167	N150-V162 HydrophobicContact CB-CG2 3.77Å; V162-A166 WeakPolarHBondContact CA-O 3.2Å; V162-I167 HydrophobicContact CG2-CG1 4.33Å
163	T	79.1	Confident	86.7	Confident	81 Å²	81	55.2 Å²	55.2	50%	0.497	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	101.9	-179.1	-32.1	0	0	0	0	108.6	S165 A166	T163-S165 PolarHBondContact O-N 3.29Å; T163-A166 PolarHBondContact N-O 3.04Å; T163-A166 PolarHBondContact O-N 3.19Å; T163-A166 VanDerWaalsContact O-N 3.08Å
164	G	78.6	Confident	86.3	Confident	76 Å²	76	65.8 Å²	65.8	78%	0.784	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	-122.6	-167.9	0	0	0	0	0	110.9
165	S	76.8	Confident	85.9	Confident	126 Å²	126	76 Å²	76	88%	0.881	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-6.4	174.6	55.7	0	0	0	0	114.1	T163	T163-S165 PolarHBondContact O-N 3.29Å
166	A	83.4	Confident	85.4	Confident	54 Å²	54	80.4 Å²	80.4	45%	0.446	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	129.6	-177.8	0	0	0	0	0	111	V162 T163	V162-A166 WeakPolarHBondContact CA-O 3.2Å; T163-A166 PolarHBondContact N-O 3.04Å; T163-A166 PolarHBondContact O-N 3.19Å; T163-A166 VanDerWaalsContact O-N 3.08Å
167	I	84.8	Confident	85.1	Confident	107 Å²	107	81.5 Å²	81.5	55%	0.549	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	125.5	172	-55.6	178	0	0	0	107.2	Q160 V162	Q160-I167 HydrophobicContact CB-CG2 4.21Å; Q160-I167 HydrophobicContact CG-CG2 3.82Å; V162-I167 HydrophobicContact CG2-CG1 4.33Å
168	T	86	Confident	85.2	Confident	48 Å²	48	84.2 Å²	84.2	29%	0.294	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	122.6	171.5	-44.2	0	0	0	0	109.5	Q160 R161 L170	Q160-T168 WeakPolarHBondContact CA-O 3.19Å; R161-T168 PolarHBondContact N-O 3.08Å; R161-T168 VanDerWaalsContact NE-CB 3.35Å; R161-T168 PolarHBondContact NE-OG1 3Å; R161-T168 PolarHBondContact O-N 3.49Å; T168-L170 PolarHBondContact O-N 3.04Å
169	D	86.4	Confident	85.4	Confident	99 Å²	99	85 Å²	85	53%	0.529	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	119.4	172	-64.7	-13.9	0	0	0	109.2	Q160	Q160-D169 VanDerWaalsContact CD-OD1 3.3Å; Q160-D169 WeakPolarHBondContact CG-OD1 3.29Å; Q160-D169 PolarHBondContact NE2-OD1 3.26Å
170	L	86	Confident	85.5	Confident	24 Å²	24	85.8 Å²	85.8	13%	0.126	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	-37.8	172.6	-62.1	169.9	0	0	0	110.7	L149 F159 R161 T168 L308	L149-L170 HydrophobicContact CD2-CD1 3.58Å; F159-L170 WeakPolarHBondContact O-CA 3.5Å; F159-L170 WeakPolarHBondContact O-CB 3.4Å; F159-L170 PolarHBondContact O-N 3.24Å; R161-L170 HydrophobicContact CB-CD1 4.35Å; R161-L170 HydrophobicContact CG-CD1 4.47Å; R161-L170 HydrophobicContact CG-CG 4.46Å; T168-L170 PolarHBondContact O-N 3.04Å; L170-L308 HydrophobicContact CD2-CD1 3.95Å
171	Y	87.4	Confident	85.7	Confident	65 Å²	65	83.9 Å²	83.9	26%	0.255	46%	0.46	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	141	173.8	177.3	-95.1	0	0	0	111.4	F159 P173 E471 A472 V517	F159-Y171 WeakPolarHBondContact CB-O 3.21Å; F159-Y171 AromaticContact CD2-CD1 3.75Å; F159-Y171 HydrophobicContact CD2-CD1 3.75Å; F159-Y171 HydrophobicContact CE2-CD1 4.12Å; F159-Y171 PolarHBondContact N-O 3.44Å; F159-Y171 PolarHBondContact O-N 3.3Å; Y171-P173 HydrophobicContact CE1-CB 3.73Å; Y171-P173 HydrophobicContact CE1-CG 4.09Å; Y171-E471 HydrophobicContact CE2-CB 4.24Å; Y171-A472 HydrophobicContact CD2-CB 4.18Å; Y171-A472 HydrophobicContact CG-CB 4.28Å; Y171-V517 HydrophobicContact CD1-CB 4.37Å; Y171-V517 HydrophobicContact CD1-CG2 3.5Å; Y171-V517 HydrophobicContact CD2-CG2 4.49Å; Y171-V517 HydrophobicContact CE1-CB 4.22Å; Y171-V517 HydrophobicContact CE1-CG1 3.93Å; Y171-V517 HydrophobicContact CE1-CG2 3.62Å; Y171-V517 HydrophobicContact CE2-CG1 4.26Å; Y171-V517 HydrophobicContact CG-CG2 3.96Å
172	S	84.1	Confident	86.1	Confident	67 Å²	67	81.3 Å²	81.3	47%	0.469	45%	0.452	S	S	.	.			trans	-137.1	115.7	172.8	-170.3	0	0	0	0	109.7
173	P	83.1	Confident	86.7	Confident	30 Å²	30	81.3 Å²	81.3	20%	0.195	45%	0.449	C	S	.	.			trans	-71.9	151.6	-179.2	27.8	-30.6	0	0	0	111.2	G157 Y171 R175 L176	G157-P173 WeakPolarHBondContact O-CD 3.41Å; G157-P173 WeakPolarHBondContact O-CG 3.44Å; Y171-P173 HydrophobicContact CE1-CB 3.73Å; Y171-P173 HydrophobicContact CE1-CG 4.09Å; P173-R175 PolarHBondContact O-N 2.91Å; P173-L176 HydrophobicContact CG-CD2 4.21Å
174	K	83.8	Confident	87.6	Confident	227 Å²	227	77.4 Å²	77.4	99%	0.987	43%	0.426	S	S	*	.	S	Bend	trans	-58.7	-31.4	175.1	-67.7	-176	-179.9	178.3	0	113.1
175	R	84.2	Confident	88.5	Confident	225 Å²	225	74.2 Å²	74.2	85%	0.849	39%	0.39	S	S	*	.	S	Bend	trans	-118.6	114.9	174.6	-177.5	178	179.6	-178.5	-0.9	107.6	P173	P173-R175 PolarHBondContact O-N 2.91Å
176	L	84.9	Confident	89.4	Confident	95 Å²	95	69.4 Å²	69.4	50%	0.497	35%	0.353	S	S	.	.			trans	-69.4	138	174.3	-61.2	177.5	0	0	0	109.5	V158 P173	V158-L176 HydrophobicContact CG2-CD2 3.68Å; P173-L176 HydrophobicContact CG-CD2 4.21Å
177	F	85.3	Confident	90.1	Very high	151 Å²	151	67.4 Å²	67.4	66%	0.662	34%	0.336	S	S	*	.			trans	-119	124.9	167.7	-179.8	-95.2	0	0	0	106.4	R156 G157 L179	R156-F177 CarbonylContact C-O 3.6Å; G157-F177 WeakPolarHBondContact CA-O 3.29Å; G157-F177 PolarHBondContact N-O 3.22Å; F177-L179 HydrophobicContact CE1-CD2 3.96Å
178	S	91.8	Very high	90.7	Very high	67 Å²	67	62.3 Å²	62.3	47%	0.469	31%	0.31	S	S	.	.			trans	-113.5	135.5	-176.7	-54.1	0	0	0	0	109.8	A155	A155-S178 CarbonylContact O-C 3.2Å; A155-S178 WeakPolarHBondContact O-CA 3.38Å
179	L	94.6	Very high	91.2	Very high	36 Å²	36	62.7 Å²	62.7	19%	0.188	31%	0.307	C	S	.	.			trans	-71.7	144.6	170.3	-61.1	-175.1	0	0	0	109.5	A155 F177 D183 W203	A155-L179 HydrophobicContact CB-CB 4.41Å; A155-L179 PolarHBondContact O-N 3.17Å; F177-L179 HydrophobicContact CE1-CD2 3.96Å; L179-D183 HydrophobicContact CB-CB 3.79Å; L179-D183 HydrophobicContact CD2-CB 4.02Å; L179-D183 HydrophobicContact CG-CB 4.33Å; L179-W203 HydrophobicContact CD1-CH2 3.98Å; L179-W203 HydrophobicContact CD1-CZ3 3.73Å
180	T	94.4	Very high	91.6	Very high	46 Å²	46	58.4 Å²	58.4	28%	0.282	29%	0.285	S	S	.	.			trans	-79.6	172.7	171.8	64.2	0	0	0	0	111.1	D182 D183 C184	T180-D182 PolarHBondContact O-N 3.27Å; T180-D182 PolarHBondContact OG1-N 2.98Å; T180-D183 WeakPolarHBondContact CB-OD2 3.47Å; T180-D183 PolarHBondContact N-OD2 3.16Å; T180-D183 PolarHBondContact O-N 3.41Å; T180-D183 PolarHBondContact OG1-N 3.31Å; T180-D183 VanDerWaalsContact OG1-N 3.1Å; T180-D183 PolarHBondContact OG1-OD2 3.36Å; T180-C184 PolarHBondContact O-N 3.06Å; T180-C184 VanDerWaalsContact O-N 3.09Å
181	G	95.4	Very high	92	Very high	6 Å²	6	57.2 Å²	57.2	6%	0.062	28%	0.279	C	S	.	.	H	α-helix	trans	-58.4	-39.2	170.9	0	0	0	0	0	112	C184 F185 A207 F211	G181-C184 PolarHBondContact O-N 3.46Å; G181-F185 WeakPolarHBondContact O-CB 3.45Å; G181-F185 PolarHBondContact O-N 3.08Å; G181-A207 WeakPolarHBondContact O-CB 3.35Å; G181-F211 VanDerWaalsContact C-CE2 3.42Å; G181-F211 WeakPolarHBondContact O-CE2 3.39Å
182	D	95.4	Very high	92.4	Very high	14 Å²	14	56.2 Å²	56.2	8%	0.075	28%	0.275	C	S	.	.	H	α-helix	trans	-65.8	-47	177.4	-170.7	75.6	0	0	0	111.7	T180 C184 F185 Q186 F211 D222 E223 A224	T180-D182 PolarHBondContact O-N 3.27Å; T180-D182 PolarHBondContact OG1-N 2.98Å; D182-C184 VanDerWaalsContact C-N 3.33Å; D182-C184 PolarHBondContact O-N 3.04Å; D182-F185 CarbonylContact O-C 3.4Å; D182-F185 WeakPolarHBondContact O-CA 3.42Å; D182-F185 WeakPolarHBondContact O-CB 3.49Å; D182-F185 PolarHBondContact O-N 3.03Å; D182-Q186 WeakPolarHBondContact O-CG 3.39Å; D182-Q186 PolarHBondContact O-N 2.85Å; D182-F211 HydrophobicContact CB-CZ 4.09Å; D182-F211 VanDerWaalsContact N-CZ 3.28Å; D182-D222 HydrophobicContact CB-CB 4.47Å; D182-E223 PolarHBondContact OD1-N 3.18Å; D182-A224 WeakPolarHBondContact OD1-CB 3.4Å; D182-A224 PolarHBondContact OD1-N 3.01Å
183	D	95.8	Very high	92.8	Very high	63 Å²	63	57.5 Å²	57.5	34%	0.337	28%	0.276	S	S	.	.	H	α-helix	trans	-56.2	-46.9	175.9	-65.8	-54.3	0	0	0	111.8	L179 T180 F185 Q186 V187	L179-D183 HydrophobicContact CB-CB 3.79Å; L179-D183 HydrophobicContact CD2-CB 4.02Å; L179-D183 HydrophobicContact CG-CB 4.33Å; T180-D183 WeakPolarHBondContact CB-OD2 3.47Å; T180-D183 PolarHBondContact N-OD2 3.16Å; T180-D183 PolarHBondContact O-N 3.41Å; T180-D183 PolarHBondContact OG1-N 3.31Å; T180-D183 VanDerWaalsContact OG1-N 3.1Å; T180-D183 PolarHBondContact OG1-OD2 3.36Å; D183-F185 VanDerWaalsContact C-N 3.33Å; D183-F185 PolarHBondContact O-N 3.44Å; D183-Q186 PolarHBondContact O-N 3.37Å; D183-V187 WeakPolarHBondContact O-CG2 3.41Å; D183-V187 PolarHBondContact O-N 2.58Å
184	C	97.5	Very high	93.2	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-64.1	-39	176.5	-75.2	0	0	0	0	111.9	T180 G181 D182 V187 G188 W203 A207	T180-C184 PolarHBondContact O-N 3.06Å; T180-C184 VanDerWaalsContact O-N 3.09Å; G181-C184 PolarHBondContact O-N 3.46Å; D182-C184 VanDerWaalsContact C-N 3.33Å; D182-C184 PolarHBondContact O-N 3.04Å; C184-V187 PolarHBondContact O-N 2.98Å; C184-G188 PolarHBondContact O-N 3.34Å; C184-W203 HydrophobicContact CB-CE3 4.13Å; C184-A207 HydrophobicContact CB-CB 3.78Å
185	F	97.5	Very high	93.5	Very high	8 Å²	8	51.3 Å²	51.3	4%	0.035	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-43.5	176.5	174.4	-95.9	0	0	0	111.3	G181 D182 D183 V187 G188 K189 L204 A207 F211 A224 D228 A229 H232	G181-F185 WeakPolarHBondContact O-CB 3.45Å; G181-F185 PolarHBondContact O-N 3.08Å; D182-F185 CarbonylContact O-C 3.4Å; D182-F185 WeakPolarHBondContact O-CA 3.42Å; D182-F185 WeakPolarHBondContact O-CB 3.49Å; D182-F185 PolarHBondContact O-N 3.03Å; D183-F185 VanDerWaalsContact C-N 3.33Å; D183-F185 PolarHBondContact O-N 3.44Å; F185-V187 PolarHBondContact O-N 3.17Å; F185-G188 CarbonylContact O-C 3.53Å; F185-G188 PolarHBondContact O-N 3.25Å; F185-K189 HydrophobicContact CE1-CB 4.23Å; F185-K189 HydrophobicContact CE1-CD 3.76Å; F185-K189 HydrophobicContact CE1-CG 4.48Å; F185-K189 HydrophobicContact CZ-CB 4.42Å; F185-K189 HydrophobicContact CZ-CD 4.11Å; F185-K189 WeakPolarHBondContact O-CB 3.44Å; F185-K189 PolarHBondContact O-N 3.47Å; F185-L204 HydrophobicContact CD2-CD2 3.58Å; F185-L204 HydrophobicContact CE2-CD2 3.95Å; F185-L204 HydrophobicContact CG-CD2 4.49Å; F185-A207 HydrophobicContact CB-CB 3.94Å; F185-F211 HydrophobicContact CB-CE2 4.1Å; F185-A224 HydrophobicContact CB-CB 4.38Å; F185-A224 HydrophobicContact CD1-CB 3.17Å; F185-A224 HydrophobicContact CD2-CB 4.4Å; F185-A224 HydrophobicContact CE1-CB 3.35Å; F185-A224 HydrophobicContact CG-CB 3.74Å; F185-A224 HydrophobicContact CZ-CB 4.07Å; F185-D228 HydrophobicContact CE2-CB 4.25Å; F185-D228 HydrophobicContact CZ-CB 4.09Å; F185-A229 HydrophobicContact CD2-CB 3.84Å; F185-A229 HydrophobicContact CE2-CB 4.34Å; F185-H232 HydrophobicContact CE2-CB 4.17Å; F185-H232 AromaticContact CE2-CG 3.86Å; F185-H232 AromaticContact CE2-ND1 3.64Å; F185-H232 AromaticContact CZ-CE1 3.72Å; F185-H232 AromaticContact CZ-ND1 3.69Å
186	Q	96.4	Very high	93.9	Very high	25 Å²	25	41.6 Å²	41.6	12%	0.117	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-42.1	179.5	-67	-66.8	-10.7	0	0	112	D182 D183 K189 V190 E223	D182-Q186 WeakPolarHBondContact O-CG 3.39Å; D182-Q186 PolarHBondContact O-N 2.85Å; D183-Q186 PolarHBondContact O-N 3.37Å; Q186-K189 PolarHBondContact O-N 2.72Å; Q186-V190 WeakPolarHBondContact O-CG2 3.25Å; Q186-V190 PolarHBondContact O-N 3.21Å; Q186-E223 PolarHBondContact NE2-OE2 3.23Å
187	V	96.6	Very high	94.4	Very high	12 Å²	12	39.5 Å²	39.5	7%	0.073	21%	0.21	C	C	.	.	H	α-helix	trans	-62.8	-46.3	174.5	-178.1	0	0	0	0	110.9	A137 L140 M141 D183 C184 F185 K189 V190 A191 W203	A137-V187 HydrophobicContact CB-CG1 4.29Å; A137-V187 HydrophobicContact CB-CG2 4.39Å; L140-V187 HydrophobicContact CD1-CG2 3.77Å; M141-V187 HydrophobicContact CG-CG1 4.46Å; D183-V187 WeakPolarHBondContact O-CG2 3.41Å; D183-V187 PolarHBondContact O-N 2.58Å; C184-V187 PolarHBondContact O-N 2.98Å; F185-V187 PolarHBondContact O-N 3.17Å; V187-K189 VanDerWaalsContact C-N 3.32Å; V187-K189 PolarHBondContact O-N 2.9Å; V187-V190 PolarHBondContact O-N 3.19Å; V187-A191 PolarHBondContact O-N 3.04Å; V187-W203 HydrophobicContact CB-CD2 3.83Å; V187-W203 HydrophobicContact CB-CE3 3.85Å; V187-W203 HydrophobicContact CB-CG 4.2Å; V187-W203 HydrophobicContact CB-CZ3 4.26Å; V187-W203 HydrophobicContact CG1-CD2 3.51Å; V187-W203 VanDerWaalsContact CG1-CE2 3.47Å; V187-W203 HydrophobicContact CG1-CE3 4.01Å; V187-W203 HydrophobicContact CG1-CG 3.8Å; V187-W203 HydrophobicContact CG1-CH2 4.37Å; V187-W203 HydrophobicContact CG1-CZ2 3.92Å; V187-W203 HydrophobicContact CG1-CZ3 4.41Å; V187-W203 HydrophobicContact CG2-CE3 4.32Å; V187-W203 HydrophobicContact CG2-CH2 4.48Å; V187-W203 HydrophobicContact CG2-CZ3 4.24Å
188	G	97.4	Very high	94.8	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.8	-35.6	177.3	0	0	0	0	0	113.4	C184 F185 A191 Y192 A200	C184-G188 PolarHBondContact O-N 3.34Å; F185-G188 CarbonylContact O-C 3.53Å; F185-G188 PolarHBondContact O-N 3.25Å; G188-A191 PolarHBondContact O-N 2.76Å; G188-Y192 VanDerWaalsContact O-CB 3.29Å; G188-Y192 WeakPolarHBondContact O-CB 3.34Å; G188-Y192 PolarHBondContact O-N 3.05Å; G188-A200 WeakPolarHBondContact O-CB 3.47Å
189	K	96.6	Very high	94.9	Very high	56 Å²	56	33.1 Å²	33.1	24%	0.243	17%	0.172	C	C	.	.	H	α-helix	trans	-68.6	-41.5	178.3	-176.7	-180	177.3	-62.4	0	111.7	F185 Q186 V187 A191 Y192 D193	F185-K189 HydrophobicContact CE1-CB 4.23Å; F185-K189 HydrophobicContact CE1-CD 3.76Å; F185-K189 HydrophobicContact CE1-CG 4.48Å; F185-K189 HydrophobicContact CZ-CB 4.42Å; F185-K189 HydrophobicContact CZ-CD 4.11Å; F185-K189 WeakPolarHBondContact O-CB 3.44Å; F185-K189 PolarHBondContact O-N 3.47Å; Q186-K189 PolarHBondContact O-N 2.72Å; V187-K189 VanDerWaalsContact C-N 3.32Å; V187-K189 PolarHBondContact O-N 2.9Å; K189-A191 VanDerWaalsContact C-N 3.31Å; K189-A191 PolarHBondContact O-N 3.31Å; K189-Y192 WeakPolarHBondContact O-CB 3.43Å; K189-Y192 PolarHBondContact O-N 3.49Å; K189-D193 IonicContact NZ-OD2 2.6Å; K189-D193 PolarHBondContact NZ-OD2 3.41Å; K189-D193 WeakPolarHBondContact O-CB 3.43Å; K189-D193 VanDerWaalsContact O-CG 3.28Å; K189-D193 PolarHBondContact O-N 3.27Å
190	V	94.8	Very high	95	Very high	9 Å²	9	31.4 Å²	31.4	6%	0.055	16%	0.163	C	C	.	.	H	α-helix	trans	-57.5	-47.3	173.2	167.9	0	0	0	0	110.6	E134 A137 R138 M141 Q186 V187 Y192 D193 M194	E134-V190 HydrophobicContact CG-CG1 3.75Å; E134-V190 HydrophobicContact CG-CG2 4.43Å; A137-V190 HydrophobicContact CB-CB 3.92Å; A137-V190 HydrophobicContact CB-CG1 3.98Å; A137-V190 HydrophobicContact CB-CG2 3.9Å; R138-V190 HydrophobicContact CG-CG1 4.42Å; M141-V190 HydrophobicContact CE-CG1 4.21Å; Q186-V190 WeakPolarHBondContact O-CG2 3.25Å; Q186-V190 PolarHBondContact O-N 3.21Å; V187-V190 PolarHBondContact O-N 3.19Å; V190-Y192 PolarHBondContact O-N 3.4Å; V190-D193 PolarHBondContact O-N 2.89Å; V190-M194 HydrophobicContact CG1-SD 4.1Å; V190-M194 VanDerWaalsContact O-CG 3.29Å; V190-M194 WeakPolarHBondContact O-CG 3.48Å; V190-M194 PolarHBondContact O-N 3.19Å
191	A	94.3	Very high	95.2	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-61.7	-43.9	176.5	0	0	0	0	0	112.2	M141 V187 G188 K189 M194 G195 D196 H199 A200	M141-A191 HydrophobicContact CE-CB 4.38Å; M141-A191 HydrophobicContact SD-CB 3.56Å; M141-A191 VanDerWaalsContact SD-CB 3.56Å; V187-A191 PolarHBondContact O-N 3.04Å; G188-A191 PolarHBondContact O-N 2.76Å; K189-A191 VanDerWaalsContact C-N 3.31Å; K189-A191 PolarHBondContact O-N 3.31Å; A191-M194 PolarHBondContact O-N 2.88Å; A191-G195 PolarHBondContact O-N 2.6Å; A191-D196 HydrophobicContact CB-CB 4.48Å; A191-D196 WeakPolarHBondContact O-CA 3.39Å; A191-D196 PolarHBondContact O-N 3.1Å; A191-H199 HydrophobicContact CB-CB 3.84Å; A191-A200 HydrophobicContact CB-CB 3.82Å
192	Y	95.8	Very high	95.2	Very high	44 Å²	44	30.7 Å²	30.7	17%	0.173	16%	0.158	C	C	.	.	H	α-helix	trans	-59	-47.4	177.5	175.2	-82.2	0	0	0	112.1	G188 K189 V190 M194 G195 Y197 H232 F235 A236	G188-Y192 VanDerWaalsContact O-CB 3.29Å; G188-Y192 WeakPolarHBondContact O-CB 3.34Å; G188-Y192 PolarHBondContact O-N 3.05Å; K189-Y192 WeakPolarHBondContact O-CB 3.43Å; K189-Y192 PolarHBondContact O-N 3.49Å; V190-Y192 PolarHBondContact O-N 3.4Å; Y192-M194 PolarHBondContact O-N 3.35Å; Y192-G195 PolarHBondContact O-N 2.82Å; Y192-Y197 HydrophobicContact CD2-CD1 4.44Å; Y192-Y197 HydrophobicContact CD2-CE1 4.02Å; Y192-Y197 HydrophobicContact CE2-CE1 4.26Å; Y192-H232 AromaticContact CD1-CD2 3.9Å; Y192-H232 HydrophobicContact CD2-CB 4.38Å; Y192-H232 AromaticContact CE1-CD2 3.86Å; Y192-H232 HydrophobicContact CE2-CB 4.33Å; Y192-F235 HydrophobicContact CE2-CB 4.08Å; Y192-F235 AromaticContact CE2-CD1 3.4Å; Y192-F235 HydrophobicContact CE2-CD1 3.4Å; Y192-F235 VanDerWaalsContact CE2-CD1 3.4Å; Y192-F235 HydrophobicContact CE2-CE1 4.19Å; Y192-F235 HydrophobicContact CE2-CG 4.13Å; Y192-F235 AromaticContact CZ-CD1 3.5Å; Y192-F235 AromaticContact CZ-CE1 3.98Å; Y192-F235 WeakPolarHBondContact OH-CD1 3.39Å; Y192-F235 WeakPolarHBondContact OH-CE1 3.5Å; Y192-F235 WeakPolarHBondContact OH-CG 3.48Å; Y192-A236 HydrophobicContact CD2-CB 4.31Å
193	D	93.8	Very high	95.4	Very high	93 Å²	93	30 Å²	30	50%	0.497	15%	0.154	S	C	.	.	H	α-helix	trans	-65.5	-27.1	-178.8	-72.3	-22.3	0	0	0	111.5	K189 V190 G195	K189-D193 IonicContact NZ-OD2 2.6Å; K189-D193 PolarHBondContact NZ-OD2 3.41Å; K189-D193 WeakPolarHBondContact O-CB 3.43Å; K189-D193 VanDerWaalsContact O-CG 3.28Å; K189-D193 PolarHBondContact O-N 3.27Å; V190-D193 PolarHBondContact O-N 2.89Å; D193-G195 VanDerWaalsContact C-N 3.3Å
194	M	90	Very high	95.5	Very high	89 Å²	89	27 Å²	27	44%	0.438	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-6.7	172.5	-65.9	173.8	62.4	0	0	113.7	R138 V190 A191 Y192 D196	R138-M194 HydrophobicContact CG-SD 4.19Å; R138-M194 PolarHBondContact NE-SD 2.89Å; R138-M194 VanDerWaalsContact NE-SD 3.4Å; V190-M194 HydrophobicContact CG1-SD 4.1Å; V190-M194 VanDerWaalsContact O-CG 3.29Å; V190-M194 WeakPolarHBondContact O-CG 3.48Å; V190-M194 PolarHBondContact O-N 3.19Å; A191-M194 PolarHBondContact O-N 2.88Å; Y192-M194 PolarHBondContact O-N 3.35Å; M194-D196 VanDerWaalsContact C-N 3.26Å
195	G	91.6	Very high	95.5	Very high	38 Å²	38	31.3 Å²	31.3	39%	0.392	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.2	13.7	-172.4	0	0	0	0	0	114.1	A191 Y192 D193 Y197	A191-G195 PolarHBondContact O-N 2.6Å; Y192-G195 PolarHBondContact O-N 2.82Å; D193-G195 VanDerWaalsContact C-N 3.3Å; G195-Y197 WeakPolarHBondContact O-CD2 3.45Å; G195-Y197 PolarHBondContact O-N 3.46Å
196	D	92.5	Very high	95.5	Very high	22 Å²	22	31.6 Å²	31.6	12%	0.118	16%	0.16	C	C	.	.			trans	-88.9	77.7	178.1	-172.7	-12.3	0	0	0	110.5	A191 M194 Y198 H199 A200 P290	A191-D196 HydrophobicContact CB-CB 4.48Å; A191-D196 WeakPolarHBondContact O-CA 3.39Å; A191-D196 PolarHBondContact O-N 3.1Å; M194-D196 VanDerWaalsContact C-N 3.26Å; D196-Y198 PolarHBondContact O-N 3.43Å; D196-Y198 WeakPolarHBondContact OD1-CB 3.47Å; D196-Y198 PolarHBondContact OD1-N 2.98Å; D196-H199 VanDerWaalsContact CG-ND1 3.28Å; D196-H199 PolarHBondContact O-N 3.25Å; D196-H199 IonicContact OD1-CG 3.97Å; D196-H199 PolarHBondContact OD1-N 3.42Å; D196-H199 IonicContact OD1-ND1 3.74Å; D196-H199 PolarHBondContact OD1-ND1 3.05Å; D196-H199 IonicContact OD2-CE1 2.82Å; D196-H199 IonicContact OD2-CG 2.66Å; D196-H199 IonicContact OD2-ND1 4Å; D196-H199 PolarHBondContact OD2-ND1 3.2Å; D196-A200 WeakPolarHBondContact O-CB 3.36Å; D196-A200 PolarHBondContact O-N 2.87Å; D196-P290 HydrophobicContact CB-CG 4.3Å; D196-P290 VanDerWaalsContact CG-CG 3.49Å; D196-P290 WeakPolarHBondContact OD1-CG 3.36Å
197	Y	94.3	Very high	95.6	Very high	50 Å²	50	30.4 Å²	30.4	20%	0.196	15%	0.154	C	C	.	.	H	α-helix	trans	-70.7	-17.2	-179.4	-53.4	-64.5	0	0	0	113.4	Y192 G195 I201 F235 A236 Q239	Y192-Y197 HydrophobicContact CD2-CD1 4.44Å; Y192-Y197 HydrophobicContact CD2-CE1 4.02Å; Y192-Y197 HydrophobicContact CE2-CE1 4.26Å; G195-Y197 WeakPolarHBondContact O-CD2 3.45Å; G195-Y197 PolarHBondContact O-N 3.46Å; Y197-I201 WeakPolarHBondContact O-CB 3.37Å; Y197-I201 WeakPolarHBondContact O-CD1 3.43Å; Y197-I201 VanDerWaalsContact O-CG1 3.29Å; Y197-I201 WeakPolarHBondContact O-CG1 3.44Å; Y197-I201 PolarHBondContact O-N 2.85Å; Y197-F235 HydrophobicContact CE1-CD1 4.42Å; Y197-F235 HydrophobicContact CE1-CE1 4.46Å; Y197-A236 HydrophobicContact CD1-CB 3.78Å; Y197-A236 HydrophobicContact CE1-CB 4.45Å; Y197-Q239 HydrophobicContact CD1-CB 4.3Å; Y197-Q239 HydrophobicContact CD2-CB 3.63Å; Y197-Q239 HydrophobicContact CE1-CB 4.05Å; Y197-Q239 HydrophobicContact CE1-CG 4.07Å; Y197-Q239 HydrophobicContact CE2-CB 3.36Å; Y197-Q239 HydrophobicContact CE2-CG 3.81Å; Y197-Q239 HydrophobicContact CG-CB 4.1Å
198	Y	93.8	Very high	95.7	Very high	79 Å²	79	29.9 Å²	29.9	31%	0.31	15%	0.151	S	C	.	.	H	α-helix	trans	-62.4	-44.7	173.9	172.4	-98.1	0	0	0	111.2	D196 P202 I287 R289	D196-Y198 PolarHBondContact O-N 3.43Å; D196-Y198 WeakPolarHBondContact OD1-CB 3.47Å; D196-Y198 PolarHBondContact OD1-N 2.98Å; Y198-P202 WeakPolarHBondContact O-CD 3.31Å; Y198-P202 WeakPolarHBondContact O-CG 2.82Å; Y198-I287 HydrophobicContact CD2-CG2 4.15Å; Y198-R289 HydrophobicContact CD1-CB 4.02Å; Y198-R289 HydrophobicContact CD1-CG 3.92Å; Y198-R289 HydrophobicContact CD2-CB 4.21Å; Y198-R289 HydrophobicContact CE1-CB 3.98Å; Y198-R289 HydrophobicContact CE1-CG 3.84Å; Y198-R289 HydrophobicContact CE2-CB 4.17Å; Y198-R289 HydrophobicContact CG-CB 4.14Å; Y198-R289 HydrophobicContact CG-CG 4.5Å
199	H	95.2	Very high	95.6	Very high	6 Å²	6	32.4 Å²	32.4	3%	0.028	17%	0.169	C	C	.	.	H	α-helix	trans	-84.1	-36.3	174.3	-68.2	108.2	0	0	0	112.9	M141 D145 A191 D196 I201 P202 W203	M141-H199 HydrophobicContact CG-CB 3.98Å; M141-H199 HydrophobicContact SD-CB 3.41Å; M141-H199 WeakPolarHBondContact SD-CB 3.48Å; D145-H199 VanDerWaalsContact CG-NE2 3.25Å; D145-H199 IonicContact OD1-CE1 3.56Å; D145-H199 IonicContact OD1-NE2 3.54Å; D145-H199 PolarHBondContact OD1-NE2 3.25Å; D145-H199 IonicContact OD2-CE1 3.87Å; D145-H199 PolarHBondContact OD2-CE1 2.94Å; D145-H199 VanDerWaalsContact OD2-CE1 3.27Å; D145-H199 IonicContact OD2-NE2 3.12Å; D145-H199 PolarHBondContact OD2-NE2 3.35Å; A191-H199 HydrophobicContact CB-CB 3.84Å; D196-H199 VanDerWaalsContact CG-ND1 3.28Å; D196-H199 PolarHBondContact O-N 3.25Å; D196-H199 IonicContact OD1-CG 3.97Å; D196-H199 PolarHBondContact OD1-N 3.42Å; D196-H199 IonicContact OD1-ND1 3.74Å; D196-H199 PolarHBondContact OD1-ND1 3.05Å; D196-H199 IonicContact OD2-CE1 2.82Å; D196-H199 IonicContact OD2-CG 2.66Å; D196-H199 IonicContact OD2-ND1 4Å; D196-H199 PolarHBondContact OD2-ND1 3.2Å; H199-I201 PolarHBondContact O-N 3.08Å; H199-P202 VanDerWaalsContact O-CD 3.28Å; H199-P202 WeakPolarHBondContact O-CD 3.49Å; H199-P202 WeakPolarHBondContact O-CG 3.38Å; H199-W203 VanDerWaalsContact O-CD1 3.3Å
200	A	96.8	Very high	95.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.4	-46	-175.8	0	0	0	0	0	112.4	G188 A191 D196 W203 L204	G188-A200 WeakPolarHBondContact O-CB 3.47Å; A191-A200 HydrophobicContact CB-CB 3.82Å; D196-A200 WeakPolarHBondContact O-CB 3.36Å; D196-A200 PolarHBondContact O-N 2.87Å; A200-W203 PolarHBondContact O-N 3.15Å; A200-L204 HydrophobicContact CB-CD1 4.18Å; A200-L204 VanDerWaalsContact O-CB 3.27Å; A200-L204 WeakPolarHBondContact O-CB 3.22Å; A200-L204 WeakPolarHBondContact O-CG 3.32Å; A200-L204 PolarHBondContact O-N 3.29Å
201	I	96.9	Very high	95.7	Very high	6 Å²	6	32.6 Å²	32.6	3%	0.031	17%	0.171	C	C	.	.	H	α-helix	trans	-57.5	-57.3	-174.9	-72.4	167.7	0	0	0	112.6	Y197 H199 W203 L204 E205 L233 A236 Y237 A240 I287	Y197-I201 WeakPolarHBondContact O-CB 3.37Å; Y197-I201 WeakPolarHBondContact O-CD1 3.43Å; Y197-I201 VanDerWaalsContact O-CG1 3.29Å; Y197-I201 WeakPolarHBondContact O-CG1 3.44Å; Y197-I201 PolarHBondContact O-N 2.85Å; H199-I201 PolarHBondContact O-N 3.08Å; I201-W203 VanDerWaalsContact C-N 3.28Å; I201-W203 PolarHBondContact O-N 3.29Å; I201-L204 PolarHBondContact O-N 3.12Å; I201-E205 HydrophobicContact CG2-CG 4.21Å; I201-E205 WeakPolarHBondContact O-CB 3.18Å; I201-E205 WeakPolarHBondContact O-CG 3.28Å; I201-E205 PolarHBondContact O-N 2.87Å; I201-L233 HydrophobicContact CB-CD1 4.5Å; I201-L233 HydrophobicContact CG1-CD1 4.47Å; I201-L233 HydrophobicContact CG2-CD1 4.25Å; I201-A236 HydrophobicContact CD1-CB 4.34Å; I201-A236 HydrophobicContact CG1-CB 3.71Å; I201-Y237 HydrophobicContact CD1-CD1 4Å; I201-Y237 HydrophobicContact CD1-CE1 4.23Å; I201-Y237 HydrophobicContact CD1-CG 4.47Å; I201-Y237 HydrophobicContact CG2-CD1 4.47Å; I201-Y237 HydrophobicContact CG2-CE1 3.7Å; I201-Y237 HydrophobicContact CG2-CE2 4.23Å; I201-A240 HydrophobicContact CD1-CB 3.81Å; I201-I287 HydrophobicContact CD1-CD1 3.52Å
202	P	96.8	Very high	95.7	Very high	31 Å²	31	37.9 Å²	37.9	20%	0.201	19%	0.191	C	C	.	.	H	α-helix	trans	-64	-31.5	-176.1	24.8	-35.9	0	0	0	113.5	V151 Y198 H199 E206	V151-P202 HydrophobicContact CB-CB 4.37Å; V151-P202 HydrophobicContact CG2-CB 3.91Å; V151-P202 HydrophobicContact CG2-CG 4.29Å; Y198-P202 WeakPolarHBondContact O-CD 3.31Å; Y198-P202 WeakPolarHBondContact O-CG 2.82Å; H199-P202 VanDerWaalsContact O-CD 3.28Å; H199-P202 WeakPolarHBondContact O-CD 3.49Å; H199-P202 WeakPolarHBondContact O-CG 3.38Å; P202-E206 PolarHBondContact O-N 2.88Å
203	W	98.1	Very high	95.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-71.3	-43	174	-80.2	102.1	0	0	0	112.7	L140 V151 L154 L179 C184 V187 H199 A200 I201 E206 A207	L140-W203 HydrophobicContact CB-CZ2 4.09Å; L140-W203 HydrophobicContact CD1-CH2 4.2Å; L140-W203 HydrophobicContact CD1-CZ2 4.48Å; V151-W203 HydrophobicContact CG1-CD2 3.59Å; V151-W203 HydrophobicContact CG1-CE3 3.72Å; V151-W203 HydrophobicContact CG1-CG 4.01Å; V151-W203 HydrophobicContact CG1-CH2 4.42Å; V151-W203 HydrophobicContact CG1-CZ2 4.31Å; V151-W203 HydrophobicContact CG1-CZ3 4.13Å; V151-W203 HydrophobicContact CG2-CD2 4.43Å; V151-W203 HydrophobicContact CG2-CG 4.49Å; L154-W203 HydrophobicContact CD2-CH2 3.84Å; L154-W203 HydrophobicContact CD2-CZ2 3.62Å; L154-W203 HydrophobicContact CG-CH2 4.2Å; L154-W203 HydrophobicContact CG-CZ2 4.46Å; L179-W203 HydrophobicContact CD1-CH2 3.98Å; L179-W203 HydrophobicContact CD1-CZ3 3.73Å; C184-W203 HydrophobicContact CB-CE3 4.13Å; V187-W203 HydrophobicContact CB-CD2 3.83Å; V187-W203 HydrophobicContact CB-CE3 3.85Å; V187-W203 HydrophobicContact CB-CG 4.2Å; V187-W203 HydrophobicContact CB-CZ3 4.26Å; V187-W203 HydrophobicContact CG1-CD2 3.51Å; V187-W203 VanDerWaalsContact CG1-CE2 3.47Å; V187-W203 HydrophobicContact CG1-CE3 4.01Å; V187-W203 HydrophobicContact CG1-CG 3.8Å; V187-W203 HydrophobicContact CG1-CH2 4.37Å; V187-W203 HydrophobicContact CG1-CZ2 3.92Å; V187-W203 HydrophobicContact CG1-CZ3 4.41Å; V187-W203 HydrophobicContact CG2-CE3 4.32Å; V187-W203 HydrophobicContact CG2-CH2 4.48Å; V187-W203 HydrophobicContact CG2-CZ3 4.24Å; H199-W203 VanDerWaalsContact O-CD1 3.3Å; A200-W203 PolarHBondContact O-N 3.15Å; I201-W203 VanDerWaalsContact C-N 3.28Å; I201-W203 PolarHBondContact O-N 3.29Å; W203-E206 PolarHBondContact O-N 3.12Å; W203-A207 WeakPolarHBondContact O-CB 3.38Å; W203-A207 PolarHBondContact O-N 3.04Å
204	L	98.4	Very high	95.4	Very high	0 Å²	0	37 Å²	37	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-69.3	-33.3	176.4	-70	171.7	0	0	0	112	F185 A200 I201 A207 V208 H232 L233 A236	F185-L204 HydrophobicContact CD2-CD2 3.58Å; F185-L204 HydrophobicContact CE2-CD2 3.95Å; F185-L204 HydrophobicContact CG-CD2 4.49Å; A200-L204 HydrophobicContact CB-CD1 4.18Å; A200-L204 VanDerWaalsContact O-CB 3.27Å; A200-L204 WeakPolarHBondContact O-CB 3.22Å; A200-L204 WeakPolarHBondContact O-CG 3.32Å; A200-L204 PolarHBondContact O-N 3.29Å; I201-L204 PolarHBondContact O-N 3.12Å; L204-A207 PolarHBondContact O-N 3.33Å; L204-V208 WeakPolarHBondContact O-CB 3.38Å; L204-V208 VanDerWaalsContact O-CG2 3.3Å; L204-V208 WeakPolarHBondContact O-CG2 3.49Å; L204-V208 PolarHBondContact O-N 3.45Å; L204-H232 HydrophobicContact CD1-CB 3.93Å; L204-H232 HydrophobicContact CD2-CB 4.13Å; L204-L233 HydrophobicContact CB-CB 4.05Å; L204-L233 HydrophobicContact CB-CD1 3.69Å; L204-L233 HydrophobicContact CB-CG 4.34Å; L204-A236 HydrophobicContact CD1-CB 4.42Å
205	E	97.9	Very high	95.4	Very high	90 Å²	90	37.9 Å²	37.9	42%	0.421	21%	0.209	S	C	.	.	H	α-helix	trans	-61.1	-47.8	171.8	-78.4	-177.7	121.6	0	0	111.6	I201 V208 S209 L233 Y237	I201-E205 HydrophobicContact CG2-CG 4.21Å; I201-E205 WeakPolarHBondContact O-CB 3.18Å; I201-E205 WeakPolarHBondContact O-CG 3.28Å; I201-E205 PolarHBondContact O-N 2.87Å; E205-V208 PolarHBondContact O-N 3.06Å; E205-S209 WeakPolarHBondContact O-CB 3.22Å; E205-S209 PolarHBondContact O-N 3.31Å; E205-L233 HydrophobicContact CG-CD1 3.98Å; E205-L233 HydrophobicContact CG-CD2 4.1Å; E205-Y237 WeakPolarHBondContact CG-OH 3.13Å; E205-Y237 PolarHBondContact OE1-OH 2.99Å
206	E	97.9	Very high	94.9	Very high	14 Å²	14	39.4 Å²	39.4	7%	0.065	23%	0.225	C	C	.	.	H	α-helix	trans	-66.5	-39.2	177.1	-172.6	63.9	-169.1	0	0	110.9	V151 K152 A155 P202 W203 S209 L210	V151-E206 HydrophobicContact CG1-CB 4.17Å; K152-E206 WeakPolarHBondContact CB-OE2 3.45Å; K152-E206 WeakPolarHBondContact CG-OE2 3.41Å; A155-E206 HydrophobicContact CB-CG 3.83Å; P202-E206 PolarHBondContact O-N 2.88Å; W203-E206 PolarHBondContact O-N 3.12Å; E206-S209 WeakPolarHBondContact O-CB 3.47Å; E206-S209 PolarHBondContact O-N 3.23Å; E206-L210 HydrophobicContact CG-CD1 4.2Å; E206-L210 HydrophobicContact CG-CG 4.47Å; E206-L210 WeakPolarHBondContact O-CG 3.26Å; E206-L210 PolarHBondContact O-N 3.13Å
207	A	97.9	Very high	94.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-57.4	-51.7	173.8	0	0	0	0	0	111.9	G181 C184 F185 W203 L204 S209 L210 F211	G181-A207 WeakPolarHBondContact O-CB 3.35Å; C184-A207 HydrophobicContact CB-CB 3.78Å; F185-A207 HydrophobicContact CB-CB 3.94Å; W203-A207 WeakPolarHBondContact O-CB 3.38Å; W203-A207 PolarHBondContact O-N 3.04Å; L204-A207 PolarHBondContact O-N 3.33Å; A207-S209 VanDerWaalsContact C-N 3.3Å; A207-S209 PolarHBondContact O-N 3.14Å; A207-L210 PolarHBondContact O-N 3.13Å; A207-F211 HydrophobicContact CB-CD2 4.46Å; A207-F211 HydrophobicContact CB-CE2 4.49Å; A207-F211 WeakPolarHBondContact O-CB 3.45Å; A207-F211 WeakPolarHBondContact O-CD2 3.27Å; A207-F211 PolarHBondContact O-N 3.42Å
208	V	98	Very high	94	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.006	27%	0.27	C	S	.	.	H	α-helix	trans	-58.7	-42.6	175.5	168.3	0	0	0	0	110.7	L204 E205 L210 F211 R212 L226 A229 L230 L233	L204-V208 WeakPolarHBondContact O-CB 3.38Å; L204-V208 VanDerWaalsContact O-CG2 3.3Å; L204-V208 WeakPolarHBondContact O-CG2 3.49Å; L204-V208 PolarHBondContact O-N 3.45Å; E205-V208 PolarHBondContact O-N 3.06Å; V208-L210 VanDerWaalsContact C-N 3.34Å; V208-L210 PolarHBondContact O-N 3.35Å; V208-F211 PolarHBondContact O-N 2.84Å; V208-R212 HydrophobicContact CG1-CG 4.47Å; V208-R212 WeakPolarHBondContact O-CB 3.4Å; V208-R212 VanDerWaalsContact O-CG 3.28Å; V208-R212 WeakPolarHBondContact O-CG 3.08Å; V208-R212 PolarHBondContact O-N 3.47Å; V208-L226 HydrophobicContact CG1-CD1 4.07Å; V208-A229 HydrophobicContact CG2-CB 3.61Å; V208-L230 HydrophobicContact CG1-CD2 3.76Å; V208-L230 HydrophobicContact CG1-CG 4.46Å; V208-L230 HydrophobicContact CG2-CD2 4.09Å; V208-L230 HydrophobicContact CG2-CG 4.33Å; V208-L233 HydrophobicContact CB-CD2 4.37Å; V208-L233 HydrophobicContact CG2-CD2 3.89Å
209	S	97.4	Very high	93.6	Very high	53 Å²	53	50.9 Å²	50.9	37%	0.371	28%	0.275	S	S	.	.	H	α-helix	trans	-59.8	-42.9	177	-176.5	0	0	0	0	112.4	E205 E206 A207	E205-S209 WeakPolarHBondContact O-CB 3.22Å; E205-S209 PolarHBondContact O-N 3.31Å; E206-S209 WeakPolarHBondContact O-CB 3.47Å; E206-S209 PolarHBondContact O-N 3.23Å; A207-S209 VanDerWaalsContact C-N 3.3Å; A207-S209 PolarHBondContact O-N 3.14Å
210	L	95.9	Very high	93.1	Very high	54 Å²	54	57.2 Å²	57.2	28%	0.283	31%	0.314	S	S	.	.	H	α-helix	trans	-71.1	-45.2	178.9	-68.8	172.5	0	0	0	111.5	E206 A207 V208 R212 G213 S214	E206-L210 HydrophobicContact CG-CD1 4.2Å; E206-L210 HydrophobicContact CG-CG 4.47Å; E206-L210 WeakPolarHBondContact O-CG 3.26Å; E206-L210 PolarHBondContact O-N 3.13Å; A207-L210 PolarHBondContact O-N 3.13Å; V208-L210 VanDerWaalsContact C-N 3.34Å; V208-L210 PolarHBondContact O-N 3.35Å; L210-R212 VanDerWaalsContact C-N 3.32Å; L210-R212 PolarHBondContact O-N 3.26Å; L210-G213 WeakPolarHBondContact O-CA 3.27Å; L210-G213 PolarHBondContact O-N 2.95Å; L210-S214 PolarHBondContact O-N 2.78Å; L210-S214 PolarHBondContact O-OG 2.66Å
211	F	95.9	Very high	92.5	Very high	14 Å²	14	63.1 Å²	63.1	6%	0.061	34%	0.342	C	S	.	.	H	α-helix	trans	-62.3	-35.3	177.8	-80.2	-53.8	0	0	0	113.3	G181 D182 F185 A207 V208 G213 S214 Y215 A224 L226 A229	G181-F211 VanDerWaalsContact C-CE2 3.42Å; G181-F211 WeakPolarHBondContact O-CE2 3.39Å; D182-F211 HydrophobicContact CB-CZ 4.09Å; D182-F211 VanDerWaalsContact N-CZ 3.28Å; F185-F211 HydrophobicContact CB-CE2 4.1Å; A207-F211 HydrophobicContact CB-CD2 4.46Å; A207-F211 HydrophobicContact CB-CE2 4.49Å; A207-F211 WeakPolarHBondContact O-CB 3.45Å; A207-F211 WeakPolarHBondContact O-CD2 3.27Å; A207-F211 PolarHBondContact O-N 3.42Å; V208-F211 PolarHBondContact O-N 2.84Å; F211-G213 PolarHBondContact O-N 3Å; F211-S214 CarbonylContact O-C 3.58Å; F211-S214 PolarHBondContact O-N 3.15Å; F211-Y215 WeakPolarHBondContact O-CA 3.34Å; F211-Y215 PolarHBondContact O-N 3.03Å; F211-A224 WeakPolarHBondContact CE1-O 3.39Å; F211-A224 HydrophobicContact CZ-CB 4.33Å; F211-A224 VanDerWaalsContact CZ-O 3.25Å; F211-A224 WeakPolarHBondContact CZ-O 3.47Å; F211-L226 HydrophobicContact CB-CB 3.94Å; F211-L226 HydrophobicContact CB-CD1 3.73Å; F211-L226 HydrophobicContact CB-CG 4.38Å; F211-A229 HydrophobicContact CD2-CB 3.87Å; F211-A229 HydrophobicContact CE2-CB 4.1Å
212	R	95.4	Very high	92.2	Very high	111 Å²	111	64 Å²	64	42%	0.419	35%	0.346	S	S	.	.	H	α-helix	trans	-60	-37.8	171.7	-76.9	175.3	-175.7	140.2	-1.5	111.9	V208 L210 S214 L226 E252	V208-R212 HydrophobicContact CG1-CG 4.47Å; V208-R212 WeakPolarHBondContact O-CB 3.4Å; V208-R212 VanDerWaalsContact O-CG 3.28Å; V208-R212 WeakPolarHBondContact O-CG 3.08Å; V208-R212 PolarHBondContact O-N 3.47Å; L210-R212 VanDerWaalsContact C-N 3.32Å; L210-R212 PolarHBondContact O-N 3.26Å; R212-S214 VanDerWaalsContact C-N 3.32Å; R212-L226 HydrophobicContact CG-CD1 4.02Å; R212-L226 HydrophobicContact CG-CD2 4.22Å; R212-E252 IonicContact CZ-OE1 2.86Å; R212-E252 IonicContact CZ-OE2 2.7Å; R212-E252 IonicContact NE-OE1 3.27Å; R212-E252 PolarHBondContact NE-OE1 3.46Å; R212-E252 IonicContact NE-OE2 3.71Å; R212-E252 VanDerWaalsContact NH2-CD 3.25Å; R212-E252 IonicContact NH2-OE1 3.24Å; R212-E252 PolarHBondContact NH2-OE1 3.45Å; R212-E252 IonicContact NH2-OE2 3.5Å; R212-E252 PolarHBondContact NH2-OE2 3.11Å
213	G	92.5	Very high	91.8	Very high	74 Å²	74	69.6 Å²	69.6	76%	0.763	37%	0.37	S	S	*	.	H	α-helix	trans	-70.3	-27.5	179.3	0	0	0	0	0	113.8	L210 F211	L210-G213 WeakPolarHBondContact O-CA 3.27Å; L210-G213 PolarHBondContact O-N 2.95Å; F211-G213 PolarHBondContact O-N 3Å
214	S	90	Very high	91.6	Very high	44 Å²	44	69.7 Å²	69.7	31%	0.308	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	20.7	-179.3	65.1	0	0	0	0	113.3	L210 F211 R212 G216 E217	L210-S214 PolarHBondContact O-N 2.78Å; L210-S214 PolarHBondContact O-OG 2.66Å; F211-S214 CarbonylContact O-C 3.58Å; F211-S214 PolarHBondContact O-N 3.15Å; R212-S214 VanDerWaalsContact C-N 3.32Å; S214-G216 PolarHBondContact O-N 2.78Å; S214-E217 WeakPolarHBondContact O-CB 3.45Å; S214-E217 PolarHBondContact O-N 2.66Å
215	Y	89.7	Confident	91.4	Very high	108 Å²	108	70.9 Å²	70.9	42%	0.424	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	129.5	-173.7	-171.9	-102.7	0	0	0	111.2	F211 E217 L226 E227 Y256	F211-Y215 WeakPolarHBondContact O-CA 3.34Å; F211-Y215 PolarHBondContact O-N 3.03Å; Y215-E217 VanDerWaalsContact C-N 3.34Å; Y215-L226 HydrophobicContact CD2-CB 3.79Å; Y215-L226 HydrophobicContact CD2-CD2 3.41Å; Y215-L226 VanDerWaalsContact CD2-CD2 3.41Å; Y215-L226 HydrophobicContact CD2-CG 4.24Å; Y215-L226 HydrophobicContact CE2-CB 3.96Å; Y215-L226 HydrophobicContact CE2-CD2 3.83Å; Y215-L226 HydrophobicContact CE2-CG 4.47Å; Y215-L226 HydrophobicContact CG-CD2 4.15Å; Y215-E227 PolarHBondContact OH-OE1 3.24Å; Y215-Y256 HydrophobicContact CD1-CD1 4.4Å; Y215-Y256 HydrophobicContact CD1-CE1 4.01Å; Y215-Y256 HydrophobicContact CD2-CE1 4.32Å; Y215-Y256 AromaticContact CE1-CD1 3.64Å; Y215-Y256 HydrophobicContact CE1-CD1 3.64Å; Y215-Y256 AromaticContact CE1-CE1 3.69Å; Y215-Y256 HydrophobicContact CE1-CE1 3.69Å; Y215-Y256 AromaticContact CE2-CD1 3.81Å; Y215-Y256 HydrophobicContact CE2-CD1 3.81Å; Y215-Y256 HydrophobicContact CE2-CE1 4.03Å; Y215-Y256 HydrophobicContact CE2-CG 4.41Å; Y215-Y256 HydrophobicContact CG-CE1 4.31Å; Y215-Y256 AromaticContact CZ-CD1 3.29Å; Y215-Y256 AromaticContact CZ-CE1 3.71Å; Y215-Y256 VanDerWaalsContact OH-CD1 3.27Å; Y215-Y256 WeakPolarHBondContact OH-CD1 3.39Å
216	G	81.9	Confident	91.3	Very high	71 Å²	71	66.8 Å²	66.8	73%	0.732	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.1	-9.5	-175.3	0	0	0	0	0	114.9	S214 W218	S214-G216 PolarHBondContact O-N 2.78Å; G216-W218 PolarHBondContact O-N 3.37Å
217	E	85.8	Confident	91.2	Very high	142 Å²	142	67.7 Å²	67.7	66%	0.664	36%	0.364	S	S	*	.			trans	-96.7	67.2	173.3	-62.5	-172.6	171.5	0	0	110.7	S214 Y215 K219	S214-E217 WeakPolarHBondContact O-CB 3.45Å; S214-E217 PolarHBondContact O-N 2.66Å; Y215-E217 VanDerWaalsContact C-N 3.34Å; E217-K219 PolarHBondContact O-N 3.33Å
218	W	81.2	Confident	91.1	Very high	155 Å²	155	70.8 Å²	70.8	59%	0.587	38%	0.381	S	S	*	.			trans	-67	127.8	177.5	-178.5	-92.9	0	0	0	111.4	G216 D222 A224	G216-W218 PolarHBondContact O-N 3.37Å; W218-D222 HydrophobicContact CD2-CB 4.48Å; W218-D222 HydrophobicContact CE3-CB 4.34Å; W218-D222 HydrophobicContact CH2-CB 3.85Å; W218-D222 WeakPolarHBondContact CH2-O 3.31Å; W218-D222 HydrophobicContact CZ2-CB 4Å; W218-D222 WeakPolarHBondContact CZ2-O 3.27Å; W218-D222 HydrophobicContact CZ3-CB 4.03Å; W218-A224 VanDerWaalsContact CZ3-O 3.31Å; W218-A224 WeakPolarHBondContact CZ3-O 3.4Å
219	K	85.6	Confident	91.1	Very high	94 Å²	94	70.8 Å²	70.8	41%	0.409	38%	0.381	S	S	.	.			trans	-100.4	151.8	173.2	-53.8	178.6	-176.8	167.3	0	111	E217 E221 D222	E217-K219 PolarHBondContact O-N 3.33Å; K219-E221 VanDerWaalsContact CB-CD 3.47Å; K219-E221 HydrophobicContact CB-CG 4.16Å; K219-E221 WeakPolarHBondContact CB-OE2 3.43Å; K219-E221 WeakPolarHBondContact CD-OE1 3.15Å; K219-E221 PolarHBondContact O-N 3.28Å; K219-D222 VanDerWaalsContact CB-OD2 3.31Å; K219-D222 WeakPolarHBondContact CB-OD2 3.34Å; K219-D222 PolarHBondContact N-OD2 2.98Å; K219-D222 PolarHBondContact O-N 3.47Å
220	T	84.6	Confident	91.1	Very high	140 Å²	140	68.2 Å²	68.2	86%	0.859	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-23.8	-177.3	42.5	0	0	0	0	114.1
221	E	85.6	Confident	91.2	Very high	124 Å²	124	66.8 Å²	66.8	58%	0.579	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-14.2	-178.7	60.3	-90.4	-150.9	0	0	114.2	K219	K219-E221 VanDerWaalsContact CB-CD 3.47Å; K219-E221 HydrophobicContact CB-CG 4.16Å; K219-E221 WeakPolarHBondContact CB-OE2 3.43Å; K219-E221 WeakPolarHBondContact CD-OE1 3.15Å; K219-E221 PolarHBondContact O-N 3.28Å
222	D	89	Confident	91.3	Very high	23 Å²	23	67.7 Å²	67.7	12%	0.123	36%	0.36	C	S	.	.			trans	-71.2	139	-179.7	-60.7	-32.1	0	0	0	109.7	D182 W218 K219	D182-D222 HydrophobicContact CB-CB 4.47Å; W218-D222 HydrophobicContact CD2-CB 4.48Å; W218-D222 HydrophobicContact CE3-CB 4.34Å; W218-D222 HydrophobicContact CH2-CB 3.85Å; W218-D222 WeakPolarHBondContact CH2-O 3.31Å; W218-D222 HydrophobicContact CZ2-CB 4Å; W218-D222 WeakPolarHBondContact CZ2-O 3.27Å; W218-D222 HydrophobicContact CZ3-CB 4.03Å; K219-D222 VanDerWaalsContact CB-OD2 3.31Å; K219-D222 WeakPolarHBondContact CB-OD2 3.34Å; K219-D222 PolarHBondContact N-OD2 2.98Å; K219-D222 PolarHBondContact O-N 3.47Å
223	E	88.9	Confident	91.5	Very high	150 Å²	150	62.6 Å²	62.6	70%	0.701	34%	0.341	S	S	*	.			trans	-102.6	-27.2	173.5	-69.4	-169.1	167.1	0	0	112.2	D182 Q186	D182-E223 PolarHBondContact OD1-N 3.18Å; Q186-E223 PolarHBondContact NE2-OE2 3.23Å
224	A	93.1	Very high	91.7	Very high	2 Å²	2	59.1 Å²	59.1	2%	0.017	31%	0.305	C	S	.	.			trans	-117.8	151.7	-175	0	0	0	0	0	112.8	D182 F185 F211 W218 D228	D182-A224 WeakPolarHBondContact OD1-CB 3.4Å; D182-A224 PolarHBondContact OD1-N 3.01Å; F185-A224 HydrophobicContact CB-CB 4.38Å; F185-A224 HydrophobicContact CD1-CB 3.17Å; F185-A224 HydrophobicContact CD2-CB 4.4Å; F185-A224 HydrophobicContact CE1-CB 3.35Å; F185-A224 HydrophobicContact CG-CB 3.74Å; F185-A224 HydrophobicContact CZ-CB 4.07Å; F211-A224 WeakPolarHBondContact CE1-O 3.39Å; F211-A224 HydrophobicContact CZ-CB 4.33Å; F211-A224 VanDerWaalsContact CZ-O 3.25Å; F211-A224 WeakPolarHBondContact CZ-O 3.47Å; W218-A224 VanDerWaalsContact CZ3-O 3.31Å; W218-A224 WeakPolarHBondContact CZ3-O 3.4Å; A224-D228 HydrophobicContact CB-CB 4.36Å
225	S	94.2	Very high	92.1	Very high	24 Å²	24	60.3 Å²	60.3	17%	0.168	31%	0.305	C	S	.	.			trans	-107.5	172.5	177.6	65.5	0	0	0	0	112.8	E227 D228 A229	S225-E227 WeakPolarHBondContact CB-OE2 3.48Å; S225-E227 PolarHBondContact O-N 2.9Å; S225-E227 PolarHBondContact OG-N 3.16Å; S225-E227 PolarHBondContact OG-OE2 3.46Å; S225-D228 WeakPolarHBondContact CB-OD2 3.46Å; S225-D228 PolarHBondContact N-OD2 2.53Å; S225-D228 PolarHBondContact O-N 2.87Å; S225-D228 VanDerWaalsContact OG-CG 3.24Å; S225-D228 PolarHBondContact OG-N 2.96Å; S225-D228 VanDerWaalsContact OG-N 3.15Å; S225-D228 PolarHBondContact OG-OD2 2.86Å; S225-A229 PolarHBondContact O-N 3.49Å
226	L	95.9	Very high	92.4	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.021	29%	0.285	C	S	.	.	H	α-helix	trans	-58.6	-39.9	170.6	177.8	57.5	0	0	0	110.7	V208 F211 R212 Y215 A229 L230 Y256	V208-L226 HydrophobicContact CG1-CD1 4.07Å; F211-L226 HydrophobicContact CB-CB 3.94Å; F211-L226 HydrophobicContact CB-CD1 3.73Å; F211-L226 HydrophobicContact CB-CG 4.38Å; R212-L226 HydrophobicContact CG-CD1 4.02Å; R212-L226 HydrophobicContact CG-CD2 4.22Å; Y215-L226 HydrophobicContact CD2-CB 3.79Å; Y215-L226 HydrophobicContact CD2-CD2 3.41Å; Y215-L226 VanDerWaalsContact CD2-CD2 3.41Å; Y215-L226 HydrophobicContact CD2-CG 4.24Å; Y215-L226 HydrophobicContact CE2-CB 3.96Å; Y215-L226 HydrophobicContact CE2-CD2 3.83Å; Y215-L226 HydrophobicContact CE2-CG 4.47Å; Y215-L226 HydrophobicContact CG-CD2 4.15Å; L226-A229 PolarHBondContact O-N 3.35Å; L226-L230 HydrophobicContact CD1-CD1 4.13Å; L226-L230 HydrophobicContact CD1-CG 4.05Å; L226-L230 HydrophobicContact CG-CD1 3.91Å; L226-L230 HydrophobicContact CG-CG 4.29Å; L226-L230 WeakPolarHBondContact O-CB 3.46Å; L226-L230 VanDerWaalsContact O-CG 3.27Å; L226-L230 WeakPolarHBondContact O-CG 3.47Å; L226-L230 PolarHBondContact O-N 3.06Å; L226-Y256 HydrophobicContact CD2-CD2 4.26Å; L226-Y256 HydrophobicContact CD2-CE1 4.08Å; L226-Y256 HydrophobicContact CD2-CE2 3.69Å; L226-Y256 HydrophobicContact CG-CE2 4.48Å
227	E	95.8	Very high	93	Very high	34 Å²	34	53 Å²	53	16%	0.159	25%	0.254	C	S	.	.	H	α-helix	trans	-60.8	-45.2	178	-65.2	84.2	167	0	0	110.8	Y215 S225 L230 D231 F253	Y215-E227 PolarHBondContact OH-OE1 3.24Å; S225-E227 WeakPolarHBondContact CB-OE2 3.48Å; S225-E227 PolarHBondContact O-N 2.9Å; S225-E227 PolarHBondContact OG-N 3.16Å; S225-E227 PolarHBondContact OG-OE2 3.46Å; E227-L230 PolarHBondContact O-N 3.42Å; E227-D231 WeakPolarHBondContact O-CB 3.23Å; E227-D231 PolarHBondContact O-N 3.2Å; E227-F253 HydrophobicContact CB-CD2 4.25Å; E227-F253 HydrophobicContact CB-CE2 3.74Å; E227-F253 HydrophobicContact CB-CZ 4.37Å; E227-F253 HydrophobicContact CG-CE2 4.48Å; E227-F253 VanDerWaalsContact O-CD2 3.29Å; E227-F253 WeakPolarHBondContact O-CD2 3.27Å; E227-F253 WeakPolarHBondContact O-CE2 3.3Å
228	D	96.5	Very high	93.4	Very high	65 Å²	65	48.3 Å²	48.3	35%	0.348	23%	0.232	S	C	.	.	H	α-helix	trans	-62.3	-46.1	176	-62	-53.8	0	0	0	111.4	F185 A224 S225 L230 D231 H232	F185-D228 HydrophobicContact CE2-CB 4.25Å; F185-D228 HydrophobicContact CZ-CB 4.09Å; A224-D228 HydrophobicContact CB-CB 4.36Å; S225-D228 WeakPolarHBondContact CB-OD2 3.46Å; S225-D228 PolarHBondContact N-OD2 2.53Å; S225-D228 PolarHBondContact O-N 2.87Å; S225-D228 VanDerWaalsContact OG-CG 3.24Å; S225-D228 PolarHBondContact OG-N 2.96Å; S225-D228 VanDerWaalsContact OG-N 3.15Å; S225-D228 PolarHBondContact OG-OD2 2.86Å; D228-L230 PolarHBondContact O-N 2.77Å; D228-D231 PolarHBondContact O-N 3.1Å; D228-H232 PolarHBondContact O-N 2.72Å; D228-H232 PolarHBondContact O-ND1 3.47Å
229	A	97.7	Very high	94	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.5	-43.1	178.8	0	0	0	0	0	112.2	F185 V208 F211 S225 L226 L233	F185-A229 HydrophobicContact CD2-CB 3.84Å; F185-A229 HydrophobicContact CE2-CB 4.34Å; V208-A229 HydrophobicContact CG2-CB 3.61Å; F211-A229 HydrophobicContact CD2-CB 3.87Å; F211-A229 HydrophobicContact CE2-CB 4.1Å; S225-A229 PolarHBondContact O-N 3.49Å; L226-A229 PolarHBondContact O-N 3.35Å; A229-L233 WeakPolarHBondContact O-CB 3.47Å; A229-L233 PolarHBondContact O-N 3.25Å
230	L	98.3	Very high	94.2	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.6	-40.4	176.1	-74.9	172.1	0	0	0	112.3	V208 L226 E227 D228 A234 L249 E252 F253 Y256	V208-L230 HydrophobicContact CG1-CD2 3.76Å; V208-L230 HydrophobicContact CG1-CG 4.46Å; V208-L230 HydrophobicContact CG2-CD2 4.09Å; V208-L230 HydrophobicContact CG2-CG 4.33Å; L226-L230 HydrophobicContact CD1-CD1 4.13Å; L226-L230 HydrophobicContact CD1-CG 4.05Å; L226-L230 HydrophobicContact CG-CD1 3.91Å; L226-L230 HydrophobicContact CG-CG 4.29Å; L226-L230 WeakPolarHBondContact O-CB 3.46Å; L226-L230 VanDerWaalsContact O-CG 3.27Å; L226-L230 WeakPolarHBondContact O-CG 3.47Å; L226-L230 PolarHBondContact O-N 3.06Å; E227-L230 PolarHBondContact O-N 3.42Å; D228-L230 PolarHBondContact O-N 2.77Å; L230-A234 WeakPolarHBondContact O-CB 3.38Å; L230-A234 PolarHBondContact O-N 3.43Å; L230-L249 HydrophobicContact CD2-CD2 3.78Å; L230-E252 HydrophobicContact CD1-CG 4.01Å; L230-E252 HydrophobicContact CD2-CG 4.33Å; L230-F253 HydrophobicContact CB-CB 4.29Å; L230-F253 HydrophobicContact CB-CD2 4.16Å; L230-F253 HydrophobicContact CD1-CB 4.41Å; L230-Y256 HydrophobicContact CD1-CD2 4.01Å; L230-Y256 HydrophobicContact CD1-CE2 4.05Å
231	D	98	Very high	94.4	Very high	24 Å²	24	37.4 Å²	37.4	13%	0.128	20%	0.197	C	C	.	.	H	α-helix	trans	-64.1	-49.6	178.6	-174.2	53.6	0	0	0	111.7	E227 D228 A234 F235 F253 R262 M263	E227-D231 WeakPolarHBondContact O-CB 3.23Å; E227-D231 PolarHBondContact O-N 3.2Å; D228-D231 PolarHBondContact O-N 3.1Å; D231-A234 PolarHBondContact O-N 3.17Å; D231-F235 PolarHBondContact O-N 3.03Å; D231-F235 VanDerWaalsContact O-N 3.1Å; D231-F253 HydrophobicContact CB-CD2 4.25Å; D231-F253 HydrophobicContact CB-CE2 4.07Å; D231-R262 IonicContact OD1-CZ 3.28Å; D231-R262 IonicContact OD1-NE 2.79Å; D231-R262 IonicContact OD1-NH2 2.86Å; D231-R262 PolarHBondContact OD1-NH2 3.33Å; D231-R262 IonicContact OD2-CZ 3.04Å; D231-R262 IonicContact OD2-NH1 2.97Å; D231-R262 IonicContact OD2-NH2 2.74Å; D231-R262 PolarHBondContact OD2-NH2 3.43Å; D231-M263 HydrophobicContact CB-CE 4.09Å; D231-M263 WeakPolarHBondContact OD1-CE 2.9Å
232	H	98.5	Very high	94.7	Very high	32 Å²	32	34 Å²	34	15%	0.148	18%	0.183	C	C	.	.	H	α-helix	trans	-64.5	-43.3	178.4	-70.6	75.4	0	0	0	111.2	F185 Y192 L204 D228 F235 A236	F185-H232 HydrophobicContact CE2-CB 4.17Å; F185-H232 AromaticContact CE2-CG 3.86Å; F185-H232 AromaticContact CE2-ND1 3.64Å; F185-H232 AromaticContact CZ-CE1 3.72Å; F185-H232 AromaticContact CZ-ND1 3.69Å; Y192-H232 AromaticContact CD1-CD2 3.9Å; Y192-H232 HydrophobicContact CD2-CB 4.38Å; Y192-H232 AromaticContact CE1-CD2 3.86Å; Y192-H232 HydrophobicContact CE2-CB 4.33Å; L204-H232 HydrophobicContact CD1-CB 3.93Å; L204-H232 HydrophobicContact CD2-CB 4.13Å; D228-H232 PolarHBondContact O-N 2.72Å; D228-H232 PolarHBondContact O-ND1 3.47Å; H232-F235 PolarHBondContact O-N 3.25Å; H232-A236 WeakPolarHBondContact O-CB 3.4Å; H232-A236 PolarHBondContact O-N 3.08Å
233	L	98.3	Very high	94.8	Very high	4 Å²	4	34.1 Å²	34.1	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-64.9	-43.4	179.3	-174.5	60.6	0	0	0	111.7	I201 L204 E205 V208 A229 F235 A236 Y237 L249	I201-L233 HydrophobicContact CB-CD1 4.5Å; I201-L233 HydrophobicContact CG1-CD1 4.47Å; I201-L233 HydrophobicContact CG2-CD1 4.25Å; L204-L233 HydrophobicContact CB-CB 4.05Å; L204-L233 HydrophobicContact CB-CD1 3.69Å; L204-L233 HydrophobicContact CB-CG 4.34Å; E205-L233 HydrophobicContact CG-CD1 3.98Å; E205-L233 HydrophobicContact CG-CD2 4.1Å; V208-L233 HydrophobicContact CB-CD2 4.37Å; V208-L233 HydrophobicContact CG2-CD2 3.89Å; A229-L233 WeakPolarHBondContact O-CB 3.47Å; A229-L233 PolarHBondContact O-N 3.25Å; L233-F235 VanDerWaalsContact C-N 3.32Å; L233-F235 PolarHBondContact O-N 3.33Å; L233-A236 PolarHBondContact O-N 3.06Å; L233-Y237 HydrophobicContact CD1-CD2 3.87Å; L233-Y237 HydrophobicContact CD1-CE2 3.48Å; L233-Y237 VanDerWaalsContact CD1-CE2 3.48Å; L233-Y237 HydrophobicContact CD2-CE2 4.12Å; L233-Y237 HydrophobicContact CG-CD2 3.86Å; L233-Y237 HydrophobicContact CG-CE2 3.63Å; L233-Y237 VanDerWaalsContact O-CD2 3.29Å; L233-Y237 WeakPolarHBondContact O-CD2 3.13Å; L233-Y237 PolarHBondContact O-N 3.31Å; L233-L249 HydrophobicContact CB-CD1 4.28Å; L233-L249 HydrophobicContact CD2-CD1 3.84Å; L233-L249 HydrophobicContact CD2-CD2 4.02Å; L233-L249 HydrophobicContact CG-CD1 3.66Å
234	A	97.8	Very high	95	Very high	2 Å²	2	30.4 Å²	30.4	2%	0.017	18%	0.175	C	C	.	.	H	α-helix	trans	-60	-43.1	177.1	0	0	0	0	0	111.5	L230 D231 F238 A246 L249	L230-A234 WeakPolarHBondContact O-CB 3.38Å; L230-A234 PolarHBondContact O-N 3.43Å; D231-A234 PolarHBondContact O-N 3.17Å; A234-F238 PolarHBondContact O-N 2.91Å; A234-F238 VanDerWaalsContact O-N 3.08Å; A234-A246 WeakPolarHBondContact O-CB 3.48Å; A234-L249 HydrophobicContact CB-CB 3.84Å; A234-L249 HydrophobicContact CB-CD1 4.5Å
235	F	97.1	Very high	95	Very high	69 Å²	69	32.4 Å²	32.4	30%	0.303	19%	0.188	S	C	.	.	H	α-helix	trans	-67.1	-42.2	175.7	-175.4	-90.9	0	0	0	112.3	Y192 Y197 D231 H232 L233 Y237 F238 Q239	Y192-F235 HydrophobicContact CE2-CB 4.08Å; Y192-F235 AromaticContact CE2-CD1 3.4Å; Y192-F235 HydrophobicContact CE2-CD1 3.4Å; Y192-F235 VanDerWaalsContact CE2-CD1 3.4Å; Y192-F235 HydrophobicContact CE2-CE1 4.19Å; Y192-F235 HydrophobicContact CE2-CG 4.13Å; Y192-F235 AromaticContact CZ-CD1 3.5Å; Y192-F235 AromaticContact CZ-CE1 3.98Å; Y192-F235 WeakPolarHBondContact OH-CD1 3.39Å; Y192-F235 WeakPolarHBondContact OH-CE1 3.5Å; Y192-F235 WeakPolarHBondContact OH-CG 3.48Å; Y197-F235 HydrophobicContact CE1-CD1 4.42Å; Y197-F235 HydrophobicContact CE1-CE1 4.46Å; D231-F235 PolarHBondContact O-N 3.03Å; D231-F235 VanDerWaalsContact O-N 3.1Å; H232-F235 PolarHBondContact O-N 3.25Å; L233-F235 VanDerWaalsContact C-N 3.32Å; L233-F235 PolarHBondContact O-N 3.33Å; F235-Y237 PolarHBondContact O-N 3.18Å; F235-F238 WeakPolarHBondContact O-CB 3.17Å; F235-F238 PolarHBondContact O-N 3.5Å; F235-F238 VanDerWaalsContact O-N 3.11Å; F235-Q239 HydrophobicContact CD1-CG 3.67Å; F235-Q239 HydrophobicContact CE1-CG 3.37Å; F235-Q239 HydrophobicContact CE2-CG 4.46Å; F235-Q239 HydrophobicContact CG-CG 4.42Å; F235-Q239 HydrophobicContact CZ-CG 3.82Å; F235-Q239 WeakPolarHBondContact O-CG 3.33Å; F235-Q239 PolarHBondContact O-N 3.07Å
236	A	96.5	Very high	95.1	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.6	-45.6	177.9	0	0	0	0	0	111.7	Y192 Y197 I201 L204 H232 L233 F238 Q239 A240	Y192-A236 HydrophobicContact CD2-CB 4.31Å; Y197-A236 HydrophobicContact CD1-CB 3.78Å; Y197-A236 HydrophobicContact CE1-CB 4.45Å; I201-A236 HydrophobicContact CD1-CB 4.34Å; I201-A236 HydrophobicContact CG1-CB 3.71Å; L204-A236 HydrophobicContact CD1-CB 4.42Å; H232-A236 WeakPolarHBondContact O-CB 3.4Å; H232-A236 PolarHBondContact O-N 3.08Å; L233-A236 PolarHBondContact O-N 3.06Å; A236-F238 VanDerWaalsContact C-N 3.34Å; A236-F238 PolarHBondContact O-N 3.22Å; A236-Q239 PolarHBondContact O-N 3.46Å; A236-A240 WeakPolarHBondContact O-CB 3.29Å; A236-A240 PolarHBondContact O-N 2.94Å
237	Y	95.4	Very high	95.2	Very high	24 Å²	24	31.8 Å²	31.8	9%	0.094	18%	0.183	C	C	.	.	H	α-helix	trans	-62.9	-39	173.6	-82.8	-63.3	0	0	0	113.3	I201 E205 L233 F235 Q239 A240 G241 N242 C245 L249	I201-Y237 HydrophobicContact CD1-CD1 4Å; I201-Y237 HydrophobicContact CD1-CE1 4.23Å; I201-Y237 HydrophobicContact CD1-CG 4.47Å; I201-Y237 HydrophobicContact CG2-CD1 4.47Å; I201-Y237 HydrophobicContact CG2-CE1 3.7Å; I201-Y237 HydrophobicContact CG2-CE2 4.23Å; E205-Y237 WeakPolarHBondContact CG-OH 3.13Å; E205-Y237 PolarHBondContact OE1-OH 2.99Å; L233-Y237 HydrophobicContact CD1-CD2 3.87Å; L233-Y237 HydrophobicContact CD1-CE2 3.48Å; L233-Y237 VanDerWaalsContact CD1-CE2 3.48Å; L233-Y237 HydrophobicContact CD2-CE2 4.12Å; L233-Y237 HydrophobicContact CG-CD2 3.86Å; L233-Y237 HydrophobicContact CG-CE2 3.63Å; L233-Y237 VanDerWaalsContact O-CD2 3.29Å; L233-Y237 WeakPolarHBondContact O-CD2 3.13Å; L233-Y237 PolarHBondContact O-N 3.31Å; F235-Y237 PolarHBondContact O-N 3.18Å; Y237-Q239 VanDerWaalsContact C-N 3.33Å; Y237-A240 CarbonylContact O-C 3.57Å; Y237-A240 PolarHBondContact O-N 3.03Å; Y237-G241 PolarHBondContact O-N 3.43Å; Y237-G241 VanDerWaalsContact O-N 3.15Å; Y237-N242 HydrophobicContact CD1-CB 4.02Å; Y237-N242 PolarHBondContact O-N 2.98Å; Y237-C245 HydrophobicContact CD1-CB 3.98Å; Y237-C245 HydrophobicContact CD2-CB 4.04Å; Y237-C245 HydrophobicContact CE1-CB 4.33Å; Y237-C245 HydrophobicContact CE2-CB 4.34Å; Y237-C245 HydrophobicContact CG-CB 3.81Å; Y237-L249 HydrophobicContact CD2-CD1 3.41Å; Y237-L249 VanDerWaalsContact CD2-CD1 3.41Å; Y237-L249 HydrophobicContact CE2-CD1 3.66Å
238	F	93.8	Very high	95.2	Very high	44 Å²	44	33.8 Å²	33.8	19%	0.193	20%	0.2	C	C	.	.	H	α-helix	trans	-61.2	-43.8	175.7	173.7	-106.8	0	0	0	111.4	A234 F235 A236 A240 G241 V243 A246 Y270 L273	A234-F238 PolarHBondContact O-N 2.91Å; A234-F238 VanDerWaalsContact O-N 3.08Å; F235-F238 WeakPolarHBondContact O-CB 3.17Å; F235-F238 PolarHBondContact O-N 3.5Å; F235-F238 VanDerWaalsContact O-N 3.11Å; A236-F238 VanDerWaalsContact C-N 3.34Å; A236-F238 PolarHBondContact O-N 3.22Å; F238-A240 VanDerWaalsContact C-N 3.33Å; F238-G241 PolarHBondContact O-N 2.59Å; F238-V243 HydrophobicContact CD2-CG2 4.21Å; F238-V243 HydrophobicContact CE2-CG2 4.41Å; F238-A246 HydrophobicContact CB-CB 3.86Å; F238-Y270 HydrophobicContact CB-CE1 4.12Å; F238-Y270 HydrophobicContact CD1-CE1 4.26Å; F238-Y270 AromaticContact CD2-CD1 3.77Å; F238-Y270 HydrophobicContact CD2-CD1 3.77Å; F238-Y270 AromaticContact CD2-CE1 3.22Å; F238-Y270 HydrophobicContact CD2-CE1 3.22Å; F238-Y270 HydrophobicContact CE2-CD1 4.01Å; F238-Y270 AromaticContact CE2-CE1 3.63Å; F238-Y270 HydrophobicContact CE2-CE1 3.63Å; F238-Y270 AromaticContact CG-CE1 3.58Å; F238-Y270 HydrophobicContact CG-CE1 3.58Å; F238-Y270 AromaticContact CG-CZ 3.99Å; F238-Y270 HydrophobicContact CZ-CE1 4.3Å; F238-L273 HydrophobicContact CE2-CD1 3.78Å; F238-L273 HydrophobicContact CZ-CD1 4.42Å
239	Q	92.7	Very high	95.3	Very high	87 Å²	87	31.4 Å²	31.4	41%	0.407	19%	0.188	S	C	.	.	H	α-helix	trans	-67	-34	176.5	-65.5	-65.9	-34.5	0	0	112.6	Y197 F235 A236 Y237 G241	Y197-Q239 HydrophobicContact CD1-CB 4.3Å; Y197-Q239 HydrophobicContact CD2-CB 3.63Å; Y197-Q239 HydrophobicContact CE1-CB 4.05Å; Y197-Q239 HydrophobicContact CE1-CG 4.07Å; Y197-Q239 HydrophobicContact CE2-CB 3.36Å; Y197-Q239 HydrophobicContact CE2-CG 3.81Å; Y197-Q239 HydrophobicContact CG-CB 4.1Å; F235-Q239 HydrophobicContact CD1-CG 3.67Å; F235-Q239 HydrophobicContact CE1-CG 3.37Å; F235-Q239 HydrophobicContact CE2-CG 4.46Å; F235-Q239 HydrophobicContact CG-CG 4.42Å; F235-Q239 HydrophobicContact CZ-CG 3.82Å; F235-Q239 WeakPolarHBondContact O-CG 3.33Å; F235-Q239 PolarHBondContact O-N 3.07Å; A236-Q239 PolarHBondContact O-N 3.46Å; Y237-Q239 VanDerWaalsContact C-N 3.33Å; Q239-G241 PolarHBondContact O-N 3.43Å
240	A	90.3	Very high	95.3	Very high	23 Å²	23	31.5 Å²	31.5	19%	0.19	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-3.5	171	0	0	0	0	0	113.9	I201 A236 Y237 F238 A285 I287	I201-A240 HydrophobicContact CD1-CB 3.81Å; A236-A240 WeakPolarHBondContact O-CB 3.29Å; A236-A240 PolarHBondContact O-N 2.94Å; Y237-A240 CarbonylContact O-C 3.57Å; Y237-A240 PolarHBondContact O-N 3.03Å; F238-A240 VanDerWaalsContact C-N 3.33Å; A240-A285 WeakPolarHBondContact O-CB 3.47Å; A240-I287 HydrophobicContact CB-CD1 4.11Å; A240-I287 HydrophobicContact CB-CG1 3.96Å
241	G	89.6	Confident	95.3	Very high	50 Å²	50	37.6 Å²	37.6	52%	0.515	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	85	0.4	179.9	0	0	0	0	0	115	Y237 F238 Q239 V243	Y237-G241 PolarHBondContact O-N 3.43Å; Y237-G241 VanDerWaalsContact O-N 3.15Å; F238-G241 PolarHBondContact O-N 2.59Å; Q239-G241 PolarHBondContact O-N 3.43Å; G241-V243 PolarHBondContact O-N 3.21Å; G241-V243 VanDerWaalsContact O-N 3.12Å
242	N	90.9	Very high	95.3	Very high	53 Å²	53	38 Å²	38	28%	0.283	21%	0.212	S	C	.	.			trans	-87.9	74.8	176.2	-168	-17.6	0	0	0	111.2	Y237 S244 C245 A246	Y237-N242 HydrophobicContact CD1-CB 4.02Å; Y237-N242 PolarHBondContact O-N 2.98Å; N242-S244 PolarHBondContact O-N 3.06Å; N242-C245 HydrophobicContact CB-CB 4.42Å; N242-C245 PolarHBondContact ND2-SG 3.09Å; N242-C245 PolarHBondContact O-N 2.87Å; N242-C245 WeakPolarHBondContact OD1-CB 3.43Å; N242-C245 PolarHBondContact OD1-N 3.47Å; N242-A246 PolarHBondContact O-N 3.33Å; N242-A246 VanDerWaalsContact O-N 3.13Å
243	V	92.6	Very high	95.3	Very high	26 Å²	26	36.9 Å²	36.9	16%	0.158	21%	0.207	C	C	.	.	H	α-helix	trans	-63.1	-29.1	-178.7	-174	0	0	0	0	112.2	F238 G241 L247 Y270 L273 L274	F238-V243 HydrophobicContact CD2-CG2 4.21Å; F238-V243 HydrophobicContact CE2-CG2 4.41Å; G241-V243 PolarHBondContact O-N 3.21Å; G241-V243 VanDerWaalsContact O-N 3.12Å; V243-L247 WeakPolarHBondContact O-CB 3.41Å; V243-L247 PolarHBondContact O-N 2.95Å; V243-Y270 HydrophobicContact CG1-CD1 4.09Å; V243-Y270 HydrophobicContact CG1-CG 4.18Å; V243-L273 HydrophobicContact CG1-CB 4.27Å; V243-L274 HydrophobicContact CB-CD2 4.08Å; V243-L274 HydrophobicContact CB-CG 4.34Å; V243-L274 HydrophobicContact CG1-CD1 4.28Å; V243-L274 HydrophobicContact CG1-CD2 4.19Å; V243-L274 HydrophobicContact CG1-CG 3.89Å
244	S	92.4	Very high	95.3	Very high	72 Å²	72	38.4 Å²	38.4	50%	0.503	22%	0.215	S	C	.	.	H	α-helix	trans	-67.2	-48.6	178.9	-173.7	0	0	0	0	112	N242 L247 S248	N242-S244 PolarHBondContact O-N 3.06Å; S244-L247 PolarHBondContact O-N 3.25Å; S244-S248 PolarHBondContact O-N 3.36Å
245	C	93.8	Very high	95.2	Very high	44 Å²	44	44.8 Å²	44.8	30%	0.297	25%	0.248	S	C	.	.	H	α-helix	trans	-62.8	-43.5	174.3	-75.8	0	0	0	0	111.4	Y237 N242 L247 S248 L249	Y237-C245 HydrophobicContact CD1-CB 3.98Å; Y237-C245 HydrophobicContact CD2-CB 4.04Å; Y237-C245 HydrophobicContact CE1-CB 4.33Å; Y237-C245 HydrophobicContact CE2-CB 4.34Å; Y237-C245 HydrophobicContact CG-CB 3.81Å; N242-C245 HydrophobicContact CB-CB 4.42Å; N242-C245 PolarHBondContact ND2-SG 3.09Å; N242-C245 PolarHBondContact O-N 2.87Å; N242-C245 WeakPolarHBondContact OD1-CB 3.43Å; N242-C245 PolarHBondContact OD1-N 3.47Å; C245-L247 VanDerWaalsContact C-N 3.32Å; C245-L247 PolarHBondContact O-N 3.03Å; C245-S248 PolarHBondContact O-N 2.73Å; C245-L249 WeakPolarHBondContact O-CG 3.21Å; C245-L249 PolarHBondContact O-N 2.76Å
246	A	95.9	Very high	95.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-55.5	-46.9	175.6	0	0	0	0	0	111.9	A234 F238 N242 L249 S250 Y270	A234-A246 WeakPolarHBondContact O-CB 3.48Å; F238-A246 HydrophobicContact CB-CB 3.86Å; N242-A246 PolarHBondContact O-N 3.33Å; N242-A246 VanDerWaalsContact O-N 3.13Å; A246-L249 PolarHBondContact O-N 3.45Å; A246-S250 WeakPolarHBondContact O-CB 3.46Å; A246-S250 PolarHBondContact O-N 2.59Å; A246-S250 PolarHBondContact O-OG 3.19Å; A246-Y270 HydrophobicContact CB-CD2 4.22Å; A246-Y270 HydrophobicContact CB-CE2 3.95Å
247	L	96.8	Very high	95	Very high	14 Å²	14	47 Å²	47	7%	0.073	26%	0.261	C	S	.	.	H	α-helix	trans	-61	-45	176	176.3	59.5	0	0	0	112.6	V243 S244 C245 S250 R251 V267 Y270 E271 L274	V243-L247 WeakPolarHBondContact O-CB 3.41Å; V243-L247 PolarHBondContact O-N 2.95Å; S244-L247 PolarHBondContact O-N 3.25Å; C245-L247 VanDerWaalsContact C-N 3.32Å; C245-L247 PolarHBondContact O-N 3.03Å; L247-S250 PolarHBondContact O-N 3.21Å; L247-R251 HydrophobicContact CD1-CG 4.23Å; L247-R251 WeakPolarHBondContact O-CG 3.5Å; L247-R251 PolarHBondContact O-N 3.37Å; L247-V267 HydrophobicContact CD1-CB 4.26Å; L247-V267 HydrophobicContact CD1-CG1 3.79Å; L247-V267 HydrophobicContact CD1-CG2 4.38Å; L247-Y270 HydrophobicContact CB-CD2 4.41Å; L247-E271 HydrophobicContact CD1-CG 3.88Å; L247-E271 HydrophobicContact CD2-CG 3.92Å; L247-L274 HydrophobicContact CD2-CD1 3.68Å
248	S	97.4	Very high	95.1	Very high	76 Å²	76	50.1 Å²	50.1	53%	0.531	28%	0.284	S	S	.	.	H	α-helix	trans	-59	-48.8	178.9	-171.8	0	0	0	0	111.5	S244 C245 R251 E252	S244-S248 PolarHBondContact O-N 3.36Å; C245-S248 PolarHBondContact O-N 2.73Å; S248-R251 PolarHBondContact O-N 3.1Å; S248-E252 PolarHBondContact O-N 2.93Å
249	L	97.9	Very high	95.2	Very high	16 Å²	16	55.3 Å²	55.3	8%	0.084	31%	0.314	C	S	.	.	H	α-helix	trans	-67.2	-39.5	179.9	-67.8	164.6	0	0	0	112.1	L230 L233 A234 Y237 C245 A246 R251 E252 F253	L230-L249 HydrophobicContact CD2-CD2 3.78Å; L233-L249 HydrophobicContact CB-CD1 4.28Å; L233-L249 HydrophobicContact CD2-CD1 3.84Å; L233-L249 HydrophobicContact CD2-CD2 4.02Å; L233-L249 HydrophobicContact CG-CD1 3.66Å; A234-L249 HydrophobicContact CB-CB 3.84Å; A234-L249 HydrophobicContact CB-CD1 4.5Å; Y237-L249 HydrophobicContact CD2-CD1 3.41Å; Y237-L249 VanDerWaalsContact CD2-CD1 3.41Å; Y237-L249 HydrophobicContact CE2-CD1 3.66Å; C245-L249 WeakPolarHBondContact O-CG 3.21Å; C245-L249 PolarHBondContact O-N 2.76Å; A246-L249 PolarHBondContact O-N 3.45Å; L249-R251 VanDerWaalsContact C-N 3.31Å; L249-R251 PolarHBondContact O-N 2.98Å; L249-E252 WeakPolarHBondContact O-CB 3.43Å; L249-E252 PolarHBondContact O-N 3.14Å; L249-F253 WeakPolarHBondContact O-CB 3.15Å; L249-F253 PolarHBondContact O-N 2.92Å
250	S	98.1	Very high	95.4	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.007	31%	0.306	C	S	.	.	H	α-helix	trans	-64.2	-34	175.1	-65.5	0	0	0	0	113	A246 L247 L254 M263 Y270	A246-S250 WeakPolarHBondContact O-CB 3.46Å; A246-S250 PolarHBondContact O-N 2.59Å; A246-S250 PolarHBondContact O-OG 3.19Å; L247-S250 PolarHBondContact O-N 3.21Å; S250-L254 WeakPolarHBondContact O-CG 3.19Å; S250-L254 PolarHBondContact O-N 2.88Å; S250-M263 WeakPolarHBondContact CB-SD 3.37Å; S250-M263 WeakPolarHBondContact O-CG 3.37Å; S250-M263 PolarHBondContact OG-SD 3.39Å; S250-Y270 WeakPolarHBondContact OG-CE2 3.47Å
251	R	98.1	Very high	95.7	Very high	128 Å²	128	59.8 Å²	59.8	48%	0.483	33%	0.33	S	S	.	.	H	α-helix	trans	-69.8	-41.9	172.9	-76.2	174.6	172.6	171.2	-2.3	111.5	L247 S248 L249 L254 L255 V267 E271	L247-R251 HydrophobicContact CD1-CG 4.23Å; L247-R251 WeakPolarHBondContact O-CG 3.5Å; L247-R251 PolarHBondContact O-N 3.37Å; S248-R251 PolarHBondContact O-N 3.1Å; L249-R251 VanDerWaalsContact C-N 3.31Å; L249-R251 PolarHBondContact O-N 2.98Å; R251-L254 PolarHBondContact O-N 3.14Å; R251-L255 PolarHBondContact O-N 3.36Å; R251-V267 HydrophobicContact CG-CG1 4.27Å; R251-V267 HydrophobicContact CG-CG2 4.23Å; R251-E271 IonicContact CZ-OE1 3.03Å; R251-E271 IonicContact NE-OE1 3.33Å; R251-E271 IonicContact NH2-OE1 2.81Å; R251-E271 PolarHBondContact NH2-OE1 3.22Å
252	E	97.6	Very high	96.1	Very high	33 Å²	33	63.6 Å²	63.6	15%	0.154	33%	0.329	C	S	.	.	H	α-helix	trans	-59.7	-46.1	173.7	179.9	-179.5	174.1	0	0	111.4	R212 L230 S248 L249 L254 L255 Y256	R212-E252 IonicContact CZ-OE1 2.86Å; R212-E252 IonicContact CZ-OE2 2.7Å; R212-E252 IonicContact NE-OE1 3.27Å; R212-E252 PolarHBondContact NE-OE1 3.46Å; R212-E252 IonicContact NE-OE2 3.71Å; R212-E252 VanDerWaalsContact NH2-CD 3.25Å; R212-E252 IonicContact NH2-OE1 3.24Å; R212-E252 PolarHBondContact NH2-OE1 3.45Å; R212-E252 IonicContact NH2-OE2 3.5Å; R212-E252 PolarHBondContact NH2-OE2 3.11Å; L230-E252 HydrophobicContact CD1-CG 4.01Å; L230-E252 HydrophobicContact CD2-CG 4.33Å; S248-E252 PolarHBondContact O-N 2.93Å; L249-E252 WeakPolarHBondContact O-CB 3.43Å; L249-E252 PolarHBondContact O-N 3.14Å; E252-L254 PolarHBondContact O-N 2.91Å; E252-L255 VanDerWaalsContact O-CB 3.23Å; E252-L255 WeakPolarHBondContact O-CB 3.16Å; E252-L255 PolarHBondContact O-N 2.97Å; E252-Y256 HydrophobicContact CG-CE2 3.89Å; E252-Y256 WeakPolarHBondContact O-CD2 3.45Å
253	F	98	Very high	96.4	Very high	8 Å²	8	61.1 Å²	61.1	4%	0.035	32%	0.315	C	S	.	.	H	α-helix	trans	-51.1	-43.9	175.1	176.5	-75.3	0	0	0	111.9	E227 L230 D231 L249 L255 Y256 S257 N260 M263	E227-F253 HydrophobicContact CB-CD2 4.25Å; E227-F253 HydrophobicContact CB-CE2 3.74Å; E227-F253 HydrophobicContact CB-CZ 4.37Å; E227-F253 HydrophobicContact CG-CE2 4.48Å; E227-F253 VanDerWaalsContact O-CD2 3.29Å; E227-F253 WeakPolarHBondContact O-CD2 3.27Å; E227-F253 WeakPolarHBondContact O-CE2 3.3Å; L230-F253 HydrophobicContact CB-CB 4.29Å; L230-F253 HydrophobicContact CB-CD2 4.16Å; L230-F253 HydrophobicContact CD1-CB 4.41Å; D231-F253 HydrophobicContact CB-CD2 4.25Å; D231-F253 HydrophobicContact CB-CE2 4.07Å; L249-F253 WeakPolarHBondContact O-CB 3.15Å; L249-F253 PolarHBondContact O-N 2.92Å; F253-L255 PolarHBondContact O-N 3.22Å; F253-Y256 PolarHBondContact O-N 3.49Å; F253-Y256 VanDerWaalsContact O-N 3.08Å; F253-S257 PolarHBondContact O-N 3.23Å; F253-N260 HydrophobicContact CE1-CB 3.63Å; F253-N260 HydrophobicContact CZ-CB 4.37Å; F253-N260 WeakPolarHBondContact CZ-ND2 3.47Å; F253-M263 HydrophobicContact CB-CE 4.06Å; F253-M263 HydrophobicContact CB-CG 4.19Å; F253-M263 HydrophobicContact CD1-CB 3.72Å; F253-M263 HydrophobicContact CD1-CE 3.92Å; F253-M263 HydrophobicContact CD1-CG 3.5Å; F253-M263 HydrophobicContact CD2-CE 3.75Å; F253-M263 HydrophobicContact CE1-CB 3.87Å; F253-M263 HydrophobicContact CE1-CE 4.36Å; F253-M263 HydrophobicContact CE1-CG 4.16Å; F253-M263 HydrophobicContact CE2-CE 4.17Å; F253-M263 HydrophobicContact CG-CE 3.63Å; F253-M263 HydrophobicContact CG-CG 3.98Å; F253-M263 HydrophobicContact CZ-CE 4.48Å
254	L	97.9	Very high	96.6	Very high	36 Å²	36	61.7 Å²	61.7	19%	0.188	32%	0.323	C	S	.	.	H	α-helix	trans	-70	-13.6	-179.2	-71.6	173.1	0	0	0	113.7	S250 R251 E252 Y256 S257 P258 N260 M263 A264 V267	S250-L254 WeakPolarHBondContact O-CG 3.19Å; S250-L254 PolarHBondContact O-N 2.88Å; R251-L254 PolarHBondContact O-N 3.14Å; E252-L254 PolarHBondContact O-N 2.91Å; L254-Y256 VanDerWaalsContact C-N 3.31Å; L254-S257 WeakPolarHBondContact CD2-O 3.11Å; L254-P258 VanDerWaalsContact O-CA 3.27Å; L254-P258 WeakPolarHBondContact O-CA 3.45Å; L254-P258 WeakPolarHBondContact O-CG 3.41Å; L254-N260 HydrophobicContact CD2-CB 4.31Å; L254-M263 HydrophobicContact CD1-CG 4.43Å; L254-M263 HydrophobicContact CD2-CB 3.9Å; L254-M263 HydrophobicContact CD2-CG 4.16Å; L254-M263 HydrophobicContact CG-CB 4.24Å; L254-M263 HydrophobicContact CG-CG 3.93Å; L254-A264 HydrophobicContact CD1-CB 4.44Å; L254-V267 HydrophobicContact CD1-CG2 3.84Å
255	L	96.5	Very high	96.8	Very high	136 Å²	136	67 Å²	67	71%	0.712	33%	0.332	S	S	*	.	H	α-helix	trans	-69.2	-34	169.9	-57.9	176.9	0	0	0	111.3	R251 E252 F253	R251-L255 PolarHBondContact O-N 3.36Å; E252-L255 VanDerWaalsContact O-CB 3.23Å; E252-L255 WeakPolarHBondContact O-CB 3.16Å; E252-L255 PolarHBondContact O-N 2.97Å; F253-L255 PolarHBondContact O-N 3.22Å
256	Y	94.8	Very high	96.9	Very high	77 Å²	77	66.9 Å²	66.9	30%	0.302	33%	0.329	S	S	.	.	H	α-helix	trans	-91	-34.6	179.8	-57.7	-73.1	0	0	0	112.4	Y215 L226 L230 E252 F253 L254	Y215-Y256 HydrophobicContact CD1-CD1 4.4Å; Y215-Y256 HydrophobicContact CD1-CE1 4.01Å; Y215-Y256 HydrophobicContact CD2-CE1 4.32Å; Y215-Y256 AromaticContact CE1-CD1 3.64Å; Y215-Y256 HydrophobicContact CE1-CD1 3.64Å; Y215-Y256 AromaticContact CE1-CE1 3.69Å; Y215-Y256 HydrophobicContact CE1-CE1 3.69Å; Y215-Y256 AromaticContact CE2-CD1 3.81Å; Y215-Y256 HydrophobicContact CE2-CD1 3.81Å; Y215-Y256 HydrophobicContact CE2-CE1 4.03Å; Y215-Y256 HydrophobicContact CE2-CG 4.41Å; Y215-Y256 HydrophobicContact CG-CE1 4.31Å; Y215-Y256 AromaticContact CZ-CD1 3.29Å; Y215-Y256 AromaticContact CZ-CE1 3.71Å; Y215-Y256 VanDerWaalsContact OH-CD1 3.27Å; Y215-Y256 WeakPolarHBondContact OH-CD1 3.39Å; L226-Y256 HydrophobicContact CD2-CD2 4.26Å; L226-Y256 HydrophobicContact CD2-CE1 4.08Å; L226-Y256 HydrophobicContact CD2-CE2 3.69Å; L226-Y256 HydrophobicContact CG-CE2 4.48Å; L230-Y256 HydrophobicContact CD1-CD2 4.01Å; L230-Y256 HydrophobicContact CD1-CE2 4.05Å; E252-Y256 HydrophobicContact CG-CE2 3.89Å; E252-Y256 WeakPolarHBondContact O-CD2 3.45Å; F253-Y256 PolarHBondContact O-N 3.49Å; F253-Y256 VanDerWaalsContact O-N 3.08Å; L254-Y256 VanDerWaalsContact C-N 3.31Å
257	S	95.4	Very high	97	Very high	38 Å²	38	67.6 Å²	67.6	27%	0.266	33%	0.333	S	S	.	.			trans	-128.2	73.3	178.6	-79	0	0	0	0	112.8	F253 L254 D259 N260	F253-S257 PolarHBondContact O-N 3.23Å; L254-S257 WeakPolarHBondContact CD2-O 3.11Å; S257-D259 VanDerWaalsContact C-N 3.29Å; S257-D259 PolarHBondContact O-N 3.29Å; S257-N260 WeakPolarHBondContact O-CB 3.34Å; S257-N260 PolarHBondContact O-N 3.4Å
258	P	95.9	Very high	97	Very high	90 Å²	90	71.2 Å²	71.2	58%	0.584	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-31.7	-173.7	-23.4	33.2	0	0	0	114.7	L254 N260	L254-P258 VanDerWaalsContact O-CA 3.27Å; L254-P258 WeakPolarHBondContact O-CA 3.45Å; L254-P258 WeakPolarHBondContact O-CG 3.41Å; P258-N260 VanDerWaalsContact C-N 3.26Å; P258-N260 PolarHBondContact O-N 3.42Å
259	D	95.9	Very high	96.9	Very high	153 Å²	153	72.6 Å²	72.6	82%	0.818	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	1.4	-175.7	-65.3	-45.7	0	0	0	113.7	S257 K261	S257-D259 VanDerWaalsContact C-N 3.29Å; S257-D259 PolarHBondContact O-N 3.29Å; D259-K261 PolarHBondContact O-N 3.44Å
260	N	97.3	Very high	96.8	Very high	44 Å²	44	72 Å²	72	24%	0.235	35%	0.345	C	S	.	.			trans	-72.9	97	-178	-167.8	-50.7	0	0	0	111.8	F253 L254 S257 P258 R262 M263 A264	F253-N260 HydrophobicContact CE1-CB 3.63Å; F253-N260 HydrophobicContact CZ-CB 4.37Å; F253-N260 WeakPolarHBondContact CZ-ND2 3.47Å; L254-N260 HydrophobicContact CD2-CB 4.31Å; S257-N260 WeakPolarHBondContact O-CB 3.34Å; S257-N260 PolarHBondContact O-N 3.4Å; P258-N260 VanDerWaalsContact C-N 3.26Å; P258-N260 PolarHBondContact O-N 3.42Å; N260-R262 VanDerWaalsContact C-N 3.27Å; N260-R262 PolarHBondContact O-N 3.45Å; N260-R262 WeakPolarHBondContact OD1-CB 3.29Å; N260-R262 PolarHBondContact OD1-N 3.05Å; N260-R262 VanDerWaalsContact OD1-N 3.08Å; N260-M263 HydrophobicContact CB-CB 4.26Å; N260-M263 PolarHBondContact O-N 2.84Å; N260-M263 PolarHBondContact OD1-N 3.11Å; N260-A264 PolarHBondContact O-N 3.31Å
261	K	96.7	Very high	96.6	Very high	161 Å²	161	75.1 Å²	75.1	70%	0.7	36%	0.359	S	S	*	.	H	α-helix	trans	-61.7	-30.2	-179.3	-62.7	180	-176.5	174.4	0	113.8	D259 R265	D259-K261 PolarHBondContact O-N 3.44Å; K261-R265 VanDerWaalsContact O-CG 3.27Å; K261-R265 WeakPolarHBondContact O-CG 3.41Å; K261-R265 PolarHBondContact O-N 2.95Å
262	R	97.4	Very high	96.4	Very high	130 Å²	130	76.9 Å²	76.9	49%	0.491	37%	0.366	S	S	.	.	H	α-helix	trans	-68.5	-49.4	178.4	-176.9	-169.6	65.7	-173.7	-2.7	109.4	D231 N260 A264 R265 N266	D231-R262 IonicContact OD1-CZ 3.28Å; D231-R262 IonicContact OD1-NE 2.79Å; D231-R262 IonicContact OD1-NH2 2.86Å; D231-R262 PolarHBondContact OD1-NH2 3.33Å; D231-R262 IonicContact OD2-CZ 3.04Å; D231-R262 IonicContact OD2-NH1 2.97Å; D231-R262 IonicContact OD2-NH2 2.74Å; D231-R262 PolarHBondContact OD2-NH2 3.43Å; N260-R262 VanDerWaalsContact C-N 3.27Å; N260-R262 PolarHBondContact O-N 3.45Å; N260-R262 WeakPolarHBondContact OD1-CB 3.29Å; N260-R262 PolarHBondContact OD1-N 3.05Å; N260-R262 VanDerWaalsContact OD1-N 3.08Å; R262-A264 PolarHBondContact O-N 3.23Å; R262-R265 WeakPolarHBondContact O-CB 3.41Å; R262-R265 PolarHBondContact O-N 2.71Å; R262-N266 PolarHBondContact O-N 3.29Å
263	M	97.1	Very high	96.2	Very high	0 Å²	0	78.2 Å²	78.2	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-66	-40.6	-179	-166.8	61.4	78.9	0	0	112	D231 S250 F253 L254 N260 R265 N266 V267	D231-M263 HydrophobicContact CB-CE 4.09Å; D231-M263 WeakPolarHBondContact OD1-CE 2.9Å; S250-M263 WeakPolarHBondContact CB-SD 3.37Å; S250-M263 WeakPolarHBondContact O-CG 3.37Å; S250-M263 PolarHBondContact OG-SD 3.39Å; F253-M263 HydrophobicContact CB-CE 4.06Å; F253-M263 HydrophobicContact CB-CG 4.19Å; F253-M263 HydrophobicContact CD1-CB 3.72Å; F253-M263 HydrophobicContact CD1-CE 3.92Å; F253-M263 HydrophobicContact CD1-CG 3.5Å; F253-M263 HydrophobicContact CD2-CE 3.75Å; F253-M263 HydrophobicContact CE1-CB 3.87Å; F253-M263 HydrophobicContact CE1-CE 4.36Å; F253-M263 HydrophobicContact CE1-CG 4.16Å; F253-M263 HydrophobicContact CE2-CE 4.17Å; F253-M263 HydrophobicContact CG-CE 3.63Å; F253-M263 HydrophobicContact CG-CG 3.98Å; F253-M263 HydrophobicContact CZ-CE 4.48Å; L254-M263 HydrophobicContact CD1-CG 4.43Å; L254-M263 HydrophobicContact CD2-CB 3.9Å; L254-M263 HydrophobicContact CD2-CG 4.16Å; L254-M263 HydrophobicContact CG-CB 4.24Å; L254-M263 HydrophobicContact CG-CG 3.93Å; N260-M263 HydrophobicContact CB-CB 4.26Å; N260-M263 PolarHBondContact O-N 2.84Å; N260-M263 PolarHBondContact OD1-N 3.11Å; M263-R265 VanDerWaalsContact C-N 3.26Å; M263-R265 PolarHBondContact O-N 3.19Å; M263-N266 WeakPolarHBondContact O-CB 3.43Å; M263-N266 PolarHBondContact O-N 3.37Å; M263-N266 HydrophobicContact SD-CB 4.23Å; M263-V267 PolarHBondContact O-N 3.33Å
264	A	97	Very high	95.7	Very high	39 Å²	39	80.3 Å²	80.3	32%	0.322	39%	0.385	S	S	.	.	H	α-helix	trans	-57.6	-37.9	173.9	0	0	0	0	0	112.8	L254 N260 R262 L268	L254-A264 HydrophobicContact CD1-CB 4.44Å; N260-A264 PolarHBondContact O-N 3.31Å; R262-A264 PolarHBondContact O-N 3.23Å; A264-L268 WeakPolarHBondContact O-CG 3.29Å; A264-L268 PolarHBondContact O-N 3.01Å
265	R	97.2	Very high	95.3	Very high	184 Å²	184	82.3 Å²	82.3	69%	0.694	41%	0.407	S	S	*	.	H	α-helix	trans	-68.6	-38.7	173.7	-71.4	172.4	-174.3	-177.2	2.3	112.3	K261 R262 M263 L268 K269	K261-R265 VanDerWaalsContact O-CG 3.27Å; K261-R265 WeakPolarHBondContact O-CG 3.41Å; K261-R265 PolarHBondContact O-N 2.95Å; R262-R265 WeakPolarHBondContact O-CB 3.41Å; R262-R265 PolarHBondContact O-N 2.71Å; M263-R265 VanDerWaalsContact C-N 3.26Å; M263-R265 PolarHBondContact O-N 3.19Å; R265-L268 PolarHBondContact O-N 2.82Å; R265-K269 WeakPolarHBondContact O-CB 3.45Å; R265-K269 PolarHBondContact O-N 2.91Å
266	N	96.7	Very high	94.9	Very high	41 Å²	41	82.8 Å²	82.8	22%	0.219	41%	0.405	C	S	.	.	H	α-helix	trans	-62.3	-45	176.4	-71.3	-6.8	0	0	0	111.2	R262 M263 L268 K269 Y270	R262-N266 PolarHBondContact O-N 3.29Å; M263-N266 WeakPolarHBondContact O-CB 3.43Å; M263-N266 PolarHBondContact O-N 3.37Å; M263-N266 HydrophobicContact SD-CB 4.23Å; N266-L268 PolarHBondContact O-N 3.26Å; N266-K269 WeakPolarHBondContact O-CB 3.36Å; N266-K269 PolarHBondContact O-N 3.27Å; N266-K269 VanDerWaalsContact O-N 3.12Å; N266-Y270 HydrophobicContact CB-CD2 4.48Å; N266-Y270 HydrophobicContact CB-CE2 3.9Å; N266-Y270 VanDerWaalsContact O-CD2 3.26Å; N266-Y270 WeakPolarHBondContact O-CD2 3.01Å; N266-Y270 PolarHBondContact O-N 3.45Å
267	V	97.3	Very high	93.8	Very high	14 Å²	14	81.5 Å²	81.5	9%	0.085	41%	0.408	C	S	.	.	H	α-helix	trans	-54	-52.8	174.3	168.7	0	0	0	0	111.1	L247 R251 L254 M263 K269 Y270 E271	L247-V267 HydrophobicContact CD1-CB 4.26Å; L247-V267 HydrophobicContact CD1-CG1 3.79Å; L247-V267 HydrophobicContact CD1-CG2 4.38Å; R251-V267 HydrophobicContact CG-CG1 4.27Å; R251-V267 HydrophobicContact CG-CG2 4.23Å; L254-V267 HydrophobicContact CD1-CG2 3.84Å; M263-V267 PolarHBondContact O-N 3.33Å; V267-K269 VanDerWaalsContact C-N 3.27Å; V267-K269 PolarHBondContact O-N 2.9Å; V267-Y270 PolarHBondContact O-N 3.11Å; V267-E271 HydrophobicContact CG1-CG 4.47Å; V267-E271 WeakPolarHBondContact O-CG 3.4Å; V267-E271 PolarHBondContact O-N 3.19Å
268	L	96.9	Very high	92.3	Very high	91 Å²	91	83.9 Å²	83.9	48%	0.476	42%	0.422	S	S	.	.	H	α-helix	trans	-60	-36.7	178.4	-69.4	171.7	0	0	0	112.6	A264 R265 N266 R272	A264-L268 WeakPolarHBondContact O-CG 3.29Å; A264-L268 PolarHBondContact O-N 3.01Å; R265-L268 PolarHBondContact O-N 2.82Å; N266-L268 PolarHBondContact O-N 3.26Å; L268-R272 WeakPolarHBondContact O-CG 3.42Å; L268-R272 PolarHBondContact O-N 3.05Å
269	K	95	Very high	90.3	Very high	104 Å²	104	87.4 Å²	87.4	45%	0.452	44%	0.436	S	S	.	.	H	α-helix	trans	-65.5	-48.2	176	179.1	-176.1	175.2	-173.3	0	111	R265 N266 V267 R272 L273	R265-K269 WeakPolarHBondContact O-CB 3.45Å; R265-K269 PolarHBondContact O-N 2.91Å; N266-K269 WeakPolarHBondContact O-CB 3.36Å; N266-K269 PolarHBondContact O-N 3.27Å; N266-K269 VanDerWaalsContact O-N 3.12Å; V267-K269 VanDerWaalsContact C-N 3.27Å; V267-K269 PolarHBondContact O-N 2.9Å; K269-R272 PolarHBondContact O-N 3.48Å; K269-L273 HydrophobicContact CG-CD1 4.26Å; K269-L273 WeakPolarHBondContact O-CG 3.44Å; K269-L273 PolarHBondContact O-N 3.15Å
270	Y	95	Very high	88.3	Confident	5 Å²	5	87.7 Å²	87.7	2%	0.02	43%	0.432	C	S	.	.	H	α-helix	trans	-66	-38.8	-178.9	-58.7	-30.6	0	0	0	112.1	F238 V243 A246 L247 S250 N266 V267 R272 L273 L274	F238-Y270 HydrophobicContact CB-CE1 4.12Å; F238-Y270 HydrophobicContact CD1-CE1 4.26Å; F238-Y270 AromaticContact CD2-CD1 3.77Å; F238-Y270 HydrophobicContact CD2-CD1 3.77Å; F238-Y270 AromaticContact CD2-CE1 3.22Å; F238-Y270 HydrophobicContact CD2-CE1 3.22Å; F238-Y270 HydrophobicContact CE2-CD1 4.01Å; F238-Y270 AromaticContact CE2-CE1 3.63Å; F238-Y270 HydrophobicContact CE2-CE1 3.63Å; F238-Y270 AromaticContact CG-CE1 3.58Å; F238-Y270 HydrophobicContact CG-CE1 3.58Å; F238-Y270 AromaticContact CG-CZ 3.99Å; F238-Y270 HydrophobicContact CZ-CE1 4.3Å; V243-Y270 HydrophobicContact CG1-CD1 4.09Å; V243-Y270 HydrophobicContact CG1-CG 4.18Å; A246-Y270 HydrophobicContact CB-CD2 4.22Å; A246-Y270 HydrophobicContact CB-CE2 3.95Å; L247-Y270 HydrophobicContact CB-CD2 4.41Å; S250-Y270 WeakPolarHBondContact OG-CE2 3.47Å; N266-Y270 HydrophobicContact CB-CD2 4.48Å; N266-Y270 HydrophobicContact CB-CE2 3.9Å; N266-Y270 VanDerWaalsContact O-CD2 3.26Å; N266-Y270 WeakPolarHBondContact O-CD2 3.01Å; N266-Y270 PolarHBondContact O-N 3.45Å; V267-Y270 PolarHBondContact O-N 3.11Å; Y270-R272 VanDerWaalsContact C-N 3.34Å; Y270-R272 PolarHBondContact O-N 2.88Å; Y270-L273 HydrophobicContact CD1-CD1 4.43Å; Y270-L273 PolarHBondContact O-N 3.1Å; Y270-L274 WeakPolarHBondContact O-CG 3.4Å; Y270-L274 PolarHBondContact O-N 3.06Å
271	E	95	Very high	86.1	Confident	66 Å²	66	90 Å²	90	31%	0.308	45%	0.448	S	S	.	.	H	α-helix	trans	-58.8	-43.5	173.4	-73.5	174.1	163.9	0	0	112.3	L247 R251 V267 L274 A275	L247-E271 HydrophobicContact CD1-CG 3.88Å; L247-E271 HydrophobicContact CD2-CG 3.92Å; R251-E271 IonicContact CZ-OE1 3.03Å; R251-E271 IonicContact NE-OE1 3.33Å; R251-E271 IonicContact NH2-OE1 2.81Å; R251-E271 PolarHBondContact NH2-OE1 3.22Å; V267-E271 HydrophobicContact CG1-CG 4.47Å; V267-E271 WeakPolarHBondContact O-CG 3.4Å; V267-E271 PolarHBondContact O-N 3.19Å; E271-L274 PolarHBondContact O-N 3.5Å; E271-A275 WeakPolarHBondContact O-CB 3.33Å; E271-A275 PolarHBondContact O-N 2.9Å
272	R	94.2	Very high	83.9	Confident	164 Å²	164	89 Å²	89	62%	0.619	46%	0.455	S	S	*	.	H	α-helix	trans	-63.8	-46.7	175.9	-72.3	176.3	-165.9	174	3.4	112.2	L268 K269 Y270 L274 A275 E276	L268-R272 WeakPolarHBondContact O-CG 3.42Å; L268-R272 PolarHBondContact O-N 3.05Å; K269-R272 PolarHBondContact O-N 3.48Å; Y270-R272 VanDerWaalsContact C-N 3.34Å; Y270-R272 PolarHBondContact O-N 2.88Å; R272-L274 VanDerWaalsContact C-N 3.28Å; R272-L274 PolarHBondContact O-N 3.11Å; R272-A275 PolarHBondContact O-N 2.92Å; R272-A275 VanDerWaalsContact O-N 3.13Å; R272-E276 WeakPolarHBondContact O-CG 3.36Å; R272-E276 PolarHBondContact O-N 3.24Å
273	L	91.9	Very high	81.5	Confident	62 Å²	62	86.8 Å²	86.8	33%	0.325	47%	0.465	S	S	.	.	H	α-helix	trans	-58.7	-40.9	179.4	-71.5	172.6	0	0	0	112	F238 V243 K269 Y270 S277	F238-L273 HydrophobicContact CE2-CD1 3.78Å; F238-L273 HydrophobicContact CZ-CD1 4.42Å; V243-L273 HydrophobicContact CG1-CB 4.27Å; K269-L273 HydrophobicContact CG-CD1 4.26Å; K269-L273 WeakPolarHBondContact O-CG 3.44Å; K269-L273 PolarHBondContact O-N 3.15Å; Y270-L273 HydrophobicContact CD1-CD1 4.43Å; Y270-L273 PolarHBondContact O-N 3.1Å; L273-S277 PolarHBondContact O-N 3.36Å
274	L	89.4	Confident	79.5	Confident	52 Å²	52	95.3 Å²	95.3	27%	0.272	51%	0.505	S	S	.	.	H	α-helix	trans	-70.2	-34.7	176.8	-70	170.3	0	0	0	112.6	V243 L247 Y270 E271 R272	V243-L274 HydrophobicContact CB-CD2 4.08Å; V243-L274 HydrophobicContact CB-CG 4.34Å; V243-L274 HydrophobicContact CG1-CD1 4.28Å; V243-L274 HydrophobicContact CG1-CD2 4.19Å; V243-L274 HydrophobicContact CG1-CG 3.89Å; L247-L274 HydrophobicContact CD2-CD1 3.68Å; Y270-L274 WeakPolarHBondContact O-CG 3.4Å; Y270-L274 PolarHBondContact O-N 3.06Å; E271-L274 PolarHBondContact O-N 3.5Å; R272-L274 VanDerWaalsContact C-N 3.28Å; R272-L274 PolarHBondContact O-N 3.11Å
275	A	89.4	Confident	77.6	Confident	77 Å²	77	95.7 Å²	95.7	64%	0.636	51%	0.507	S	S	*	.	H	α-helix	trans	-70.2	-34	176.3	0	0	0	0	0	112.9	E271 R272	E271-A275 WeakPolarHBondContact O-CB 3.33Å; E271-A275 PolarHBondContact O-N 2.9Å; R272-A275 PolarHBondContact O-N 2.92Å; R272-A275 VanDerWaalsContact O-N 3.13Å
276	E	86.6	Confident	76.1	Confident	146 Å²	146	92.8 Å²	92.8	68%	0.682	51%	0.51	S	S	*	.	H	α-helix	trans	-77.1	-22.8	179.3	-72.2	172.2	-178.4	0	0	112.9	R272 P278	R272-E276 WeakPolarHBondContact O-CG 3.36Å; R272-E276 PolarHBondContact O-N 3.24Å; E276-P278 VanDerWaalsContact C-CD 3.45Å
277	S	73	Confident	75.2	Confident	51 Å²	51	93.7 Å²	93.7	36%	0.357	51%	0.514	S	S	.	.			trans	-127.6	62.3	-177.6	-61.2	0	0	0	0	113.4	L273 N279 Q280	L273-S277 PolarHBondContact O-N 3.36Å; S277-N279 PolarHBondContact O-N 3.47Å; S277-N279 VanDerWaalsContact O-N 3.13Å; S277-Q280 PolarHBondContact O-N 3.17Å; S277-Q280 VanDerWaalsContact O-N 3.14Å
278	P	62.7	Low	74.2	Confident	88 Å²	88	100.6 Å²	100.6	57%	0.571	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-18.5	-174.9	24.4	-33.6	0	0	0	114.8	E276 V281	E276-P278 VanDerWaalsContact C-CD 3.45Å; P278-V281 WeakPolarHBondContact O-CG2 3.38Å
279	N	55.6	Low	73.5	Confident	164 Å²	164	98.5 Å²	98.5	88%	0.877	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	1.5	177.9	-74.5	-12.7	0	0	0	114.3	S277 V281	S277-N279 PolarHBondContact O-N 3.47Å; S277-N279 VanDerWaalsContact O-N 3.13Å; N279-V281 VanDerWaalsContact C-N 3.28Å
280	Q	53.6	Low	72.7	Confident	158 Å²	158	96.2 Å²	96.2	74%	0.738	53%	0.527	S	S	*	.			trans	-88.6	3.6	172.4	-107.9	-180	-5.4	0	0	112.9	S277	S277-Q280 PolarHBondContact O-N 3.17Å; S277-Q280 VanDerWaalsContact O-N 3.14Å
281	V	51.1	Low	71.3	Confident	93 Å²	93	102.5 Å²	102.5	56%	0.564	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	125	173.9	-166.3	0	0	0	0	107.2	P278 N279	P278-V281 WeakPolarHBondContact O-CG2 3.38Å; N279-V281 VanDerWaalsContact C-N 3.28Å
282	V	49.8	Very low	69.9	Low	139 Å²	139	103.2 Å²	103.2	84%	0.842	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	84.9	36.4	173.6	-146	0	0	0	0	117.7
283	A	47.5	Very low	67.8	Low	84 Å²	84	100.7 Å²	100.7	69%	0.694	57%	0.571	S	S	*	*			trans	-103.3	112.2	138.1	0	0	0	0	0	105.6	A285	A283-A285 PolarHBondContact O-N 2.91Å
284	E	54.3	Low	66.2	Low	180 Å²	180	105.5 Å²	105.5	84%	0.841	59%	0.591	S	S	*	*			trans	-51	110.5	162.2	-80	178	166.3	0	0	105.7	V286	E284-V286 VanDerWaalsContact C-N 3.31Å; E284-V286 PolarHBondContact O-N 2.9Å
285	A	57.2	Low	65	Low	46 Å²	46	104.2 Å²	104.2	38%	0.38	58%	0.584	S	S	.	*			trans	-61.4	103.7	175.5	0	0	0	0	0	105.4	A240 A283 I287	A240-A285 WeakPolarHBondContact O-CB 3.47Å; A283-A285 PolarHBondContact O-N 2.91Å; A285-I287 VanDerWaalsContact C-N 3.33Å; A285-I287 PolarHBondContact O-N 3.18Å
286	V	65.7	Low	64.3	Low	123 Å²	123	109.7 Å²	109.7	75%	0.745	60%	0.597	S	S	*	*			trans	-65.9	101.1	177.7	178.8	0	0	0	0	105.6	E284 Q288	E284-V286 VanDerWaalsContact C-N 3.31Å; E284-V286 PolarHBondContact O-N 2.9Å; V286-Q288 PolarHBondContact O-N 3.21Å
287	I	78.9	Confident	64.1	Low	60 Å²	60	103.7 Å²	103.7	31%	0.308	57%	0.57	S	S	.	*			trans	-66.5	108.8	178	-57.3	162.9	0	0	0	106.2	Y198 I201 A240 A285	Y198-I287 HydrophobicContact CD2-CG2 4.15Å; I201-I287 HydrophobicContact CD1-CD1 3.52Å; A240-I287 HydrophobicContact CB-CD1 4.11Å; A240-I287 HydrophobicContact CB-CG1 3.96Å; A285-I287 VanDerWaalsContact C-N 3.33Å; A285-I287 PolarHBondContact O-N 3.18Å
288	Q	76.4	Confident	64.7	Low	160 Å²	160	103.6 Å²	103.6	75%	0.748	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-78.3	133.6	178.9	-66.4	-169.3	-4.3	0	0	109.2	V286	V286-Q288 PolarHBondContact O-N 3.21Å
289	R	81.7	Confident	65.9	Low	47 Å²	47	104.7 Å²	104.7	18%	0.177	56%	0.563	C	S	.	*	P	Polyproline II helix	trans	-56.5	137.1	168.5	-176.4	174.8	173.4	-152.8	-1.1	109.1	D145 Y198 N291 E302	D145-R289 IonicContact OD1-CZ 3.83Å; D145-R289 IonicContact OD1-NE 2.76Å; D145-R289 PolarHBondContact OD1-NE 3.08Å; D145-R289 VanDerWaalsContact OD1-NE 3.11Å; D145-R289 IonicContact OD1-NH2 2.98Å; D145-R289 IonicContact OD2-CZ 2.72Å; D145-R289 IonicContact OD2-NE 3.63Å; D145-R289 PolarHBondContact OD2-NE 2.95Å; D145-R289 IonicContact OD2-NH2 3.88Å; D145-R289 PolarHBondContact OD2-NH2 2.65Å; Y198-R289 HydrophobicContact CD1-CB 4.02Å; Y198-R289 HydrophobicContact CD1-CG 3.92Å; Y198-R289 HydrophobicContact CD2-CB 4.21Å; Y198-R289 HydrophobicContact CE1-CB 3.98Å; Y198-R289 HydrophobicContact CE1-CG 3.84Å; Y198-R289 HydrophobicContact CE2-CB 4.17Å; Y198-R289 HydrophobicContact CG-CB 4.14Å; Y198-R289 HydrophobicContact CG-CG 4.5Å; R289-N291 PolarHBondContact O-N 3.39Å; R289-E302 IonicContact CZ-OE1 3.91Å; R289-E302 VanDerWaalsContact CZ-OE1 3.28Å; R289-E302 VanDerWaalsContact NH1-CD 3.29Å; R289-E302 IonicContact NH1-OE1 3.95Å; R289-E302 PolarHBondContact NH1-OE1 3.06Å; R289-E302 IonicContact NH1-OE2 2.8Å; R289-E302 PolarHBondContact NH1-OE2 2.97Å; R289-E302 IonicContact NH2-OE1 3.75Å; R289-E302 PolarHBondContact NH2-OE1 2.74Å
290	P	77.1	Confident	67.5	Low	55 Å²	55	100 Å²	100	36%	0.357	54%	0.54	S	S	.	.	P	Polyproline II helix	trans	-52.1	132.7	177.3	-26.7	33.5	0	0	0	111.8	D196 I292	D196-P290 HydrophobicContact CB-CG 4.3Å; D196-P290 VanDerWaalsContact CG-CG 3.49Å; D196-P290 WeakPolarHBondContact OD1-CG 3.36Å; P290-I292 PolarHBondContact O-N 3.1Å
291	N	66.1	Low	69.3	Low	138 Å²	138	92.8 Å²	92.8	74%	0.738	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-72.8	123	176	-99.1	-12.9	0	0	0	109.7	R289 P293	R289-N291 PolarHBondContact O-N 3.39Å; N291-P293 WeakPolarHBondContact O-CD 3.49Å
292	I	65.4	Low	71.2	Confident	81 Å²	81	89.3 Å²	89.3	42%	0.415	48%	0.484	S	S	.	.			trans	-95.7	107.7	170.8	-56.2	175.5	0	0	0	106.9	P290 H294	P290-I292 PolarHBondContact O-N 3.1Å; I292-H294 PolarHBondContact O-N 3.22Å
293	P	51.3	Low	73.1	Confident	111 Å²	111	84.2 Å²	84.2	72%	0.721	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-13.3	-169.3	-22	32.7	0	0	0	115	N291	N291-P293 WeakPolarHBondContact O-CD 3.49Å
294	H	57.3	Low	75.3	Confident	163 Å²	163	80.7 Å²	80.7	76%	0.755	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.6	-3.7	-164.6	-58.9	-59.6	0	0	0	114.7	I292	I292-H294 PolarHBondContact O-N 3.22Å
295	L	65.1	Low	77	Confident	24 Å²	24	72.1 Å²	72.1	13%	0.126	39%	0.389	C	S	.	.			trans	-123.2	73.8	-171.9	-128.6	136.3	0	0	0	111.7	T297 R298 Y301 E438 P439	L295-T297 PolarHBondContact O-N 3.12Å; L295-T297 VanDerWaalsContact O-N 3.14Å; L295-R298 HydrophobicContact CB-CB 4.25Å; L295-R298 VanDerWaalsContact CD2-CA 3.45Å; L295-R298 HydrophobicContact CD2-CB 3.77Å; L295-R298 HydrophobicContact CD2-CG 4.28Å; L295-R298 WeakPolarHBondContact O-CB 3.25Å; L295-R298 PolarHBondContact O-N 3.1Å; L295-R298 VanDerWaalsContact O-N 3.16Å; L295-Y301 HydrophobicContact CD2-CD1 4.43Å; L295-E438 HydrophobicContact CD1-CB 4.36Å; L295-E438 HydrophobicContact CD1-CG 3.69Å; L295-E438 VanDerWaalsContact CD1-OE2 3.3Å; L295-E438 WeakPolarHBondContact CD1-OE2 3.31Å; L295-P439 HydrophobicContact CD2-CG 3.83Å; L295-P439 HydrophobicContact CG-CG 4.29Å
296	Q	73.4	Confident	78.6	Confident	192 Å²	192	71.8 Å²	71.8	90%	0.897	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-26.1	177.5	-69	-177.9	-9.7	0	0	112.9
297	T	83.1	Confident	79.6	Confident	20 Å²	20	67.7 Å²	67.7	12%	0.123	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.1	14.1	-177	53.5	0	0	0	0	113.8	L295 D299 T300 Y301 I479 Y480 L509	L295-T297 PolarHBondContact O-N 3.12Å; L295-T297 VanDerWaalsContact O-N 3.14Å; T297-D299 PolarHBondContact O-N 3.14Å; T297-T300 PolarHBondContact O-N 3.03Å; T297-Y301 WeakPolarHBondContact O-CB 3.43Å; T297-Y301 PolarHBondContact O-N 2.88Å; T297-I479 HydrophobicContact CG2-CG2 3.86Å; T297-Y480 HydrophobicContact CG2-CE1 3.65Å; T297-L509 HydrophobicContact CG2-CD2 4.15Å
298	R	85.3	Confident	79.8	Confident	50 Å²	50	67.8 Å²	67.8	19%	0.189	36%	0.356	C	S	.	.	H	α-helix	trans	-53.5	-52.4	-172.4	-174.5	-172.8	67.5	-171.8	-5	113	L295 T300 Y301 E302	L295-R298 HydrophobicContact CB-CB 4.25Å; L295-R298 VanDerWaalsContact CD2-CA 3.45Å; L295-R298 HydrophobicContact CD2-CB 3.77Å; L295-R298 HydrophobicContact CD2-CG 4.28Å; L295-R298 WeakPolarHBondContact O-CB 3.25Å; L295-R298 PolarHBondContact O-N 3.1Å; L295-R298 VanDerWaalsContact O-N 3.16Å; R298-T300 VanDerWaalsContact C-N 3.33Å; R298-T300 PolarHBondContact O-N 2.91Å; R298-Y301 WeakPolarHBondContact O-CB 3.26Å; R298-Y301 PolarHBondContact O-N 3.06Å; R298-Y301 VanDerWaalsContact O-N 3.16Å; R298-E302 HydrophobicContact CG-CG 4.21Å; R298-E302 WeakPolarHBondContact CG-OE1 3.47Å; R298-E302 WeakPolarHBondContact O-CG 3.34Å; R298-E302 PolarHBondContact O-N 2.88Å
299	D	87.8	Confident	79.8	Confident	110 Å²	110	60.7 Å²	60.7	59%	0.588	33%	0.325	S	S	*	.	H	α-helix	trans	-66.2	-39.1	-171.4	-58.7	-11	0	0	0	111	T297 G303	T297-D299 PolarHBondContact O-N 3.14Å; D299-G303 PolarHBondContact O-N 3.47Å
300	T	90	Very high	79.6	Confident	65 Å²	65	62 Å²	62	40%	0.399	34%	0.342	S	S	.	.	H	α-helix	trans	-64.4	-46.1	172.6	-51.8	0	0	0	0	111.4	T297 R298 G303 L304 I479	T297-T300 PolarHBondContact O-N 3.03Å; R298-T300 VanDerWaalsContact C-N 3.33Å; R298-T300 PolarHBondContact O-N 2.91Å; T300-G303 PolarHBondContact O-N 3.38Å; T300-L304 HydrophobicContact CG2-CD1 4.22Å; T300-L304 WeakPolarHBondContact O-CB 3.49Å; T300-L304 VanDerWaalsContact O-CG 3.29Å; T300-L304 WeakPolarHBondContact O-CG 3.12Å; T300-L304 PolarHBondContact O-N 3.26Å; T300-I479 HydrophobicContact CG2-CG2 4.08Å
301	Y	90.6	Very high	79.1	Confident	8 Å²	8	63 Å²	63	3%	0.031	34%	0.341	C	S	.	.	H	α-helix	trans	-59.5	-49	178.4	162.9	-110	0	0	0	112.2	V146 L295 T297 R298 L304 C305 P439 A477 A511 G512 P514	V146-Y301 HydrophobicContact CG2-CE1 4.46Å; L295-Y301 HydrophobicContact CD2-CD1 4.43Å; T297-Y301 WeakPolarHBondContact O-CB 3.43Å; T297-Y301 PolarHBondContact O-N 2.88Å; R298-Y301 WeakPolarHBondContact O-CB 3.26Å; R298-Y301 PolarHBondContact O-N 3.06Å; R298-Y301 VanDerWaalsContact O-N 3.16Å; Y301-L304 PolarHBondContact O-N 3.21Å; Y301-C305 WeakPolarHBondContact CE2-SG 3.31Å; Y301-C305 PolarHBondContact O-N 3.36Å; Y301-C305 PolarHBondContact O-SG 2.84Å; Y301-P439 HydrophobicContact CG-CG 4.49Å; Y301-A477 HydrophobicContact CD2-CB 4.28Å; Y301-A511 HydrophobicContact CD2-CB 3.59Å; Y301-A511 HydrophobicContact CE2-CB 3.32Å; Y301-G512 PolarHBondContact OH-O 3.38Å; Y301-P514 WeakPolarHBondContact OH-CD 3.48Å
302	E	91.2	Very high	78.5	Confident	20 Å²	20	60.7 Å²	60.7	9%	0.093	33%	0.334	C	S	.	.	H	α-helix	trans	-63.6	-44	178.5	-68.9	179.9	172.6	0	0	110.6	V146 R289 R298 L304 C305 Q306	V146-E302 HydrophobicContact CB-CG 4.39Å; V146-E302 HydrophobicContact CG1-CG 4.47Å; V146-E302 HydrophobicContact CG2-CG 4.04Å; R289-E302 IonicContact CZ-OE1 3.91Å; R289-E302 VanDerWaalsContact CZ-OE1 3.28Å; R289-E302 VanDerWaalsContact NH1-CD 3.29Å; R289-E302 IonicContact NH1-OE1 3.95Å; R289-E302 PolarHBondContact NH1-OE1 3.06Å; R289-E302 IonicContact NH1-OE2 2.8Å; R289-E302 PolarHBondContact NH1-OE2 2.97Å; R289-E302 IonicContact NH2-OE1 3.75Å; R289-E302 PolarHBondContact NH2-OE1 2.74Å; R298-E302 HydrophobicContact CG-CG 4.21Å; R298-E302 WeakPolarHBondContact CG-OE1 3.47Å; R298-E302 WeakPolarHBondContact O-CG 3.34Å; R298-E302 PolarHBondContact O-N 2.88Å; E302-L304 VanDerWaalsContact C-N 3.32Å; E302-L304 PolarHBondContact O-N 2.85Å; E302-C305 PolarHBondContact O-N 3.19Å; E302-C305 VanDerWaalsContact O-N 3.14Å; E302-Q306 WeakPolarHBondContact O-CG 3.39Å; E302-Q306 PolarHBondContact O-N 2.85Å
303	G	90.6	Very high	78	Confident	31 Å²	31	63.5 Å²	63.5	32%	0.32	36%	0.355	S	S	.	.	H	α-helix	trans	-56.7	-42.6	174.1	0	0	0	0	0	113.1	D299 T300 Q306	D299-G303 PolarHBondContact O-N 3.47Å; T300-G303 PolarHBondContact O-N 3.38Å; G303-Q306 PolarHBondContact O-N 2.86Å
304	L	91.9	Very high	77.8	Confident	11 Å²	11	64.4 Å²	64.4	6%	0.058	35%	0.353	C	S	.	.	H	α-helix	trans	-65.9	-41.2	175.4	-71.7	173.6	0	0	0	112.1	T300 Y301 E302 Q306 T307 A477 F478 S484	T300-L304 HydrophobicContact CG2-CD1 4.22Å; T300-L304 WeakPolarHBondContact O-CB 3.49Å; T300-L304 VanDerWaalsContact O-CG 3.29Å; T300-L304 WeakPolarHBondContact O-CG 3.12Å; T300-L304 PolarHBondContact O-N 3.26Å; Y301-L304 PolarHBondContact O-N 3.21Å; E302-L304 VanDerWaalsContact C-N 3.32Å; E302-L304 PolarHBondContact O-N 2.85Å; L304-Q306 VanDerWaalsContact C-N 3.29Å; L304-Q306 PolarHBondContact O-N 2.92Å; L304-T307 WeakPolarHBondContact O-CB 3.33Å; L304-T307 PolarHBondContact O-N 2.92Å; L304-T307 PolarHBondContact O-OG1 2.82Å; L304-A477 HydrophobicContact CB-CB 3.93Å; L304-A477 HydrophobicContact CD1-CB 4.17Å; L304-F478 WeakPolarHBondContact CD1-O 3.3Å; L304-S484 PolarHBondContact O-OG 3.13Å
305	C	91.9	Very high	77.6	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-63.8	-35.4	176.6	-65.6	0	0	0	0	112.6	V146 Y147 Y301 E302 T307 L308 C513	V146-C305 HydrophobicContact CG1-CB 3.58Å; Y147-C305 HydrophobicContact CE1-CB 4.24Å; Y147-C305 WeakPolarHBondContact CE1-O 3.39Å; Y301-C305 WeakPolarHBondContact CE2-SG 3.31Å; Y301-C305 PolarHBondContact O-N 3.36Å; Y301-C305 PolarHBondContact O-SG 2.84Å; E302-C305 PolarHBondContact O-N 3.19Å; E302-C305 VanDerWaalsContact O-N 3.14Å; C305-T307 PolarHBondContact O-N 2.84Å; C305-L308 PolarHBondContact O-N 2.74Å; C305-C513 WeakPolarHBondContact CA-SG 3.31Å; C305-C513 HydrophobicContact CB-CB 3.75Å; C305-C513 WeakPolarHBondContact CB-SG 3.27Å; C305-C513 VanDerWaalsContact SG-CA 3.52Å; C305-C513 WeakPolarHBondContact SG-CB 3.49Å; C305-C513 CovalentContact SG-SG 2.04Å; C305-C513 PolarHBondContact SG-SG 2.79Å
306	Q	90.7	Very high	77.2	Confident	38 Å²	38	74.3 Å²	74.3	18%	0.178	39%	0.392	C	S	.	.	H	α-helix	trans	-66.3	-16.4	177.5	-67.8	161.1	21.7	0	0	113.9	V146 M148 E302 G303 L304 L308	V146-Q306 WeakPolarHBondContact O-CG 3.24Å; V146-Q306 PolarHBondContact O-NE2 3.45Å; M148-Q306 HydrophobicContact CE-CG 4.48Å; E302-Q306 WeakPolarHBondContact O-CG 3.39Å; E302-Q306 PolarHBondContact O-N 2.85Å; G303-Q306 PolarHBondContact O-N 2.86Å; L304-Q306 VanDerWaalsContact C-N 3.29Å; L304-Q306 PolarHBondContact O-N 2.92Å; Q306-L308 PolarHBondContact O-N 2.87Å
307	T	86.8	Confident	76.9	Confident	37 Å²	37	69.1 Å²	69.1	23%	0.227	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-13.3	172.3	70	0	0	0	0	112.7	L304 C305 G309 S310 S484	L304-T307 WeakPolarHBondContact O-CB 3.33Å; L304-T307 PolarHBondContact O-N 2.92Å; L304-T307 PolarHBondContact O-OG1 2.82Å; C305-T307 PolarHBondContact O-N 2.84Å; T307-G309 PolarHBondContact O-N 2.81Å; T307-S310 VanDerWaalsContact CB-O 3.27Å; T307-S310 WeakPolarHBondContact CB-O 3.33Å; T307-S310 VanDerWaalsContact O-CB 3.31Å; T307-S310 WeakPolarHBondContact O-CB 3.46Å; T307-S310 PolarHBondContact O-N 3.09Å; T307-S310 PolarHBondContact O-OG 3.25Å; T307-S310 PolarHBondContact OG1-O 2.87Å; T307-S484 PolarHBondContact OG1-OG 2.89Å
308	L	83.1	Confident	76.3	Confident	63 Å²	63	74.3 Å²	74.3	33%	0.33	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	31	-177.1	-55.7	177.7	0	0	0	113.7	Y147 L170 C305 Q306 S310 L516	Y147-L308 HydrophobicContact CD1-CD2 4.24Å; Y147-L308 HydrophobicContact CE1-CD2 3.75Å; L170-L308 HydrophobicContact CD2-CD1 3.95Å; C305-L308 PolarHBondContact O-N 2.74Å; Q306-L308 PolarHBondContact O-N 2.87Å; L308-S310 VanDerWaalsContact C-N 3.29Å; L308-L516 HydrophobicContact CD2-CD1 4.09Å
309	G	75.4	Confident	75.9	Confident	10 Å²	10	74.6 Å²	74.6	10%	0.103	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	83.1	1.6	-177	0	0	0	0	0	114.3	T307 S484 P486	T307-G309 PolarHBondContact O-N 2.81Å; G309-S484 WeakPolarHBondContact CA-OG 3.35Å; G309-S484 PolarHBondContact N-OG 2.85Å; G309-P486 WeakPolarHBondContact O-CD 3.38Å
310	S	77.1	Confident	75.7	Confident	76 Å²	76	72.2 Å²	72.2	53%	0.531	40%	0.4	S	S	.	.			trans	-77.8	127.1	171.1	66.3	0	0	0	0	110.1	T307 L308	T307-S310 VanDerWaalsContact CB-O 3.27Å; T307-S310 WeakPolarHBondContact CB-O 3.33Å; T307-S310 VanDerWaalsContact O-CB 3.31Å; T307-S310 WeakPolarHBondContact O-CB 3.46Å; T307-S310 PolarHBondContact O-N 3.09Å; T307-S310 PolarHBondContact O-OG 3.25Å; T307-S310 PolarHBondContact OG1-O 2.87Å; L308-S310 VanDerWaalsContact C-N 3.29Å
311	Q	66.8	Low	75.6	Confident	75 Å²	75	74.9 Å²	74.9	35%	0.35	40%	0.404	S	S	.	.			trans	-84.1	136.3	171.8	-65.1	-64.6	-28.4	0	0	108.7	T313 S484	Q311-T313 PolarHBondContact O-N 3.31Å; Q311-S484 PolarHBondContact NE2-O 3.03Å
312	P	54.4	Low	75.7	Confident	89 Å²	89	79.1 Å²	79.1	58%	0.578	43%	0.433	S	S	*	.			trans	-59.6	109.2	166.8	-7.9	19.2	0	0	0	107.6	L314	P312-L314 HydrophobicContact CB-CD1 3.97Å; P312-L314 HydrophobicContact CB-CG 4.07Å; P312-L314 PolarHBondContact O-N 3.02Å
313	T	53.8	Low	75.9	Confident	140 Å²	140	79.8 Å²	79.8	86%	0.859	44%	0.441	S	S	*	.			trans	-71.5	65.2	172.1	45.9	0	0	0	0	109.1	Q311	Q311-T313 PolarHBondContact O-N 3.31Å
314	L	48.1	Very low	76.1	Confident	131 Å²	131	85.4 Å²	85.4	69%	0.686	45%	0.453	S	S	*	.	S	Bend	trans	-77.4	-30.1	178.1	-77.3	164.5	0	0	0	110.4	P312	P312-L314 HydrophobicContact CB-CD1 3.97Å; P312-L314 HydrophobicContact CB-CG 4.07Å; P312-L314 PolarHBondContact O-N 3.02Å
315	Y	52.1	Low	76.3	Confident	200 Å²	200	86.8 Å²	86.8	78%	0.784	46%	0.459	S	S	*	.			trans	-149.6	137.1	176.1	-60.1	-80	0	0	0	111.3	I317	Y315-I317 PolarHBondContact O-N 3.39Å; Y315-I317 VanDerWaalsContact O-N 3.1Å
316	Q	57.2	Low	76.3	Confident	194 Å²	194	88.7 Å²	88.7	91%	0.907	47%	0.471	S	S	*	.			trans	-69	103.7	162.1	-76.5	179.4	-10.7	0	0	107.2	P318	Q316-P318 WeakPolarHBondContact O-CD 3.21Å
317	I	68.3	Low	76.3	Confident	83 Å²	83	89.8 Å²	89.8	43%	0.426	48%	0.478	S	S	.	.			trans	-76.9	107.9	172.4	-60.9	175.9	0	0	0	106.3	Y315 S319 L320 L344	Y315-I317 PolarHBondContact O-N 3.39Å; Y315-I317 VanDerWaalsContact O-N 3.1Å; I317-S319 WeakPolarHBondContact CG2-OG 3.48Å; I317-S319 PolarHBondContact O-N 2.71Å; I317-L320 HydrophobicContact CB-CB 4.49Å; I317-L320 HydrophobicContact CB-CD1 3.95Å; I317-L320 HydrophobicContact CB-CG 3.85Å; I317-L320 HydrophobicContact CD1-CD1 4Å; I317-L320 HydrophobicContact CG1-CD1 4.42Å; I317-L320 HydrophobicContact CG2-CD1 4.41Å; I317-L320 HydrophobicContact CG2-CG 3.88Å; I317-L320 PolarHBondContact O-N 3.03Å; I317-L344 HydrophobicContact CG2-CD1 4.44Å
318	P	69.8	Low	76.3	Confident	129 Å²	129	93.6 Å²	93.6	84%	0.838	51%	0.506	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.9	-172	-22.3	35.3	0	0	0	113.6	Q316	Q316-P318 WeakPolarHBondContact O-CD 3.21Å
319	S	77.5	Confident	76.7	Confident	56 Å²	56	93.1 Å²	93.1	39%	0.392	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-7	176.2	42.9	0	0	0	0	114.2	I317 Y321 L344	I317-S319 WeakPolarHBondContact CG2-OG 3.48Å; I317-S319 PolarHBondContact O-N 2.71Å; S319-Y321 VanDerWaalsContact O-CD1 3.23Å; S319-Y321 WeakPolarHBondContact O-CD1 3.26Å; S319-L344 WeakPolarHBondContact OG-CD1 3.34Å
320	L	83.3	Confident	77.4	Confident	60 Å²	60	96.3 Å²	96.3	31%	0.314	53%	0.529	S	S	.	.			trans	-88.2	121.8	166.4	-59.8	-177.4	0	0	0	108.7	I317 V341 L344	I317-L320 HydrophobicContact CB-CB 4.49Å; I317-L320 HydrophobicContact CB-CD1 3.95Å; I317-L320 HydrophobicContact CB-CG 3.85Å; I317-L320 HydrophobicContact CD1-CD1 4Å; I317-L320 HydrophobicContact CG1-CD1 4.42Å; I317-L320 HydrophobicContact CG2-CD1 4.41Å; I317-L320 HydrophobicContact CG2-CG 3.88Å; I317-L320 PolarHBondContact O-N 3.03Å; L320-V341 HydrophobicContact CD2-CB 4.38Å; L320-V341 HydrophobicContact CD2-CG1 3.84Å; L320-L344 HydrophobicContact CD2-CD2 4.07Å; L320-L344 HydrophobicContact CD2-CG 3.97Å
321	Y	87.6	Confident	78	Confident	122 Å²	122	97.8 Å²	97.8	48%	0.478	52%	0.524	S	S	.	.			trans	-146.3	158.6	-175.7	61.8	-89.2	0	0	0	111.6	S319 V341	S319-Y321 VanDerWaalsContact O-CD1 3.23Å; S319-Y321 WeakPolarHBondContact O-CD1 3.26Å; Y321-V341 HydrophobicContact CE1-CG2 4.39Å; Y321-V341 PolarHBondContact O-N 3Å; Y321-V341 VanDerWaalsContact O-N 3.14Å
322	C	93.1	Very high	79.2	Confident	96 Å²	96	94.3 Å²	94.3	65%	0.649	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	137.9	166.5	-66.7	0	0	0	0	109.7	K339	C322-K339 CarbonylContact C-O 2.88Å; C322-K339 WeakPolarHBondContact CA-O 3.1Å
323	S	95.2	Very high	81	Confident	35 Å²	35	95.6 Å²	95.6	25%	0.245	51%	0.509	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	171.6	177.8	66.6	0	0	0	0	112.5	K339	S323-K339 PolarHBondContact N-O 2.95Å; S323-K339 PolarHBondContact O-N 3.08Å
324	Y	94.9	Very high	82.6	Confident	149 Å²	149	96.6 Å²	96.6	58%	0.584	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.2	108.4	168.2	-78.4	-71.5	0	0	0	108.4	P336 I337 R338	Y324-P336 HydrophobicContact CD1-CB 4Å; Y324-P336 HydrophobicContact CD1-CG 3.85Å; Y324-P336 HydrophobicContact CG-CB 4.3Å; Y324-P336 HydrophobicContact CG-CG 4.26Å; Y324-I337 CarbonylContact C-O 3.59Å; Y324-I337 WeakPolarHBondContact CA-O 3.33Å; Y324-R338 HydrophobicContact CD1-CG 4.21Å; Y324-R338 HydrophobicContact CE1-CG 3.64Å
325	E	94.6	Very high	84.6	Confident	39 Å²	39	96.2 Å²	96.2	18%	0.182	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	126.5	-179.1	-173.2	58.6	-100.2	0	0	110.3	N327 I337 K339 Y351 L413	E325-N327 WeakPolarHBondContact OE1-CA 3.25Å; E325-N327 PolarHBondContact OE1-N 3.28Å; E325-I337 PolarHBondContact N-O 2.94Å; E325-I337 PolarHBondContact O-N 3.44Å; E325-K339 HydrophobicContact CB-CB 3.98Å; E325-K339 HydrophobicContact CB-CD 3.95Å; E325-K339 HydrophobicContact CG-CD 4.2Å; E325-K339 VanDerWaalsContact OE2-CD 3.31Å; E325-K339 WeakPolarHBondContact OE2-CD 3.39Å; E325-K339 IonicContact OE2-NZ 3.91Å; E325-K339 PolarHBondContact OE2-NZ 3.23Å; E325-Y351 HydrophobicContact CG-CE1 4.45Å; E325-L413 HydrophobicContact CB-CD1 4.13Å; E325-L413 HydrophobicContact CG-CD1 3.59Å
326	T	92.9	Very high	86.6	Confident	40 Å²	40	89.1 Å²	89.1	25%	0.245	48%	0.482	C	S	.	.			trans	-116.1	-18.8	176	62.5	0	0	0	0	111.6	S328 N329 L332 L333 P336	T326-S328 PolarHBondContact O-N 2.86Å; T326-N329 WeakPolarHBondContact O-CB 3.41Å; T326-N329 PolarHBondContact O-N 3.48Å; T326-L332 WeakPolarHBondContact O-CB 3.26Å; T326-L333 HydrophobicContact CG2-CD2 4.17Å; T326-P336 HydrophobicContact CG2-CB 3.95Å
327	N	90.3	Very high	88.5	Confident	62 Å²	62	80.7 Å²	80.7	33%	0.332	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	46	31.9	-173.5	-165.2	34.1	0	0	0	113.3	E325 N329 A412 L413 G415	E325-N327 WeakPolarHBondContact OE1-CA 3.25Å; E325-N327 PolarHBondContact OE1-N 3.28Å; N327-N329 PolarHBondContact O-N 2.96Å; N327-A412 WeakPolarHBondContact CB-O 3.45Å; N327-A412 PolarHBondContact ND2-O 3.16Å; N327-L413 WeakPolarHBondContact CB-O 3.27Å; N327-L413 PolarHBondContact ND2-O 3.45Å; N327-L413 VanDerWaalsContact ND2-O 3.17Å; N327-G415 WeakPolarHBondContact ND2-CA 3.47Å; N327-G415 PolarHBondContact ND2-N 3.14Å; N327-G415 VanDerWaalsContact ND2-N 3.11Å
328	S	87.2	Confident	89.9	Confident	117 Å²	117	82.8 Å²	82.8	82%	0.818	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	23.8	-172.6	-55.2	0	0	0	0	114.8	T326	T326-S328 PolarHBondContact O-N 2.86Å
329	N	92.3	Very high	91.2	Very high	53 Å²	53	77.4 Å²	77.4	28%	0.283	41%	0.409	S	S	.	.			trans	-90.2	129.6	-179.3	-171.2	-67.6	0	0	0	110.2	T326 N327 Y331 L332 L333 A412	T326-N329 WeakPolarHBondContact O-CB 3.41Å; T326-N329 PolarHBondContact O-N 3.48Å; N327-N329 PolarHBondContact O-N 2.96Å; N329-Y331 PolarHBondContact O-N 3.45Å; N329-Y331 VanDerWaalsContact O-N 3.12Å; N329-Y331 VanDerWaalsContact OD1-CB 3.26Å; N329-Y331 WeakPolarHBondContact OD1-CB 3.31Å; N329-Y331 PolarHBondContact OD1-N 3.05Å; N329-L332 HydrophobicContact CB-CB 4.36Å; N329-L332 HydrophobicContact CB-CD1 4.35Å; N329-L332 HydrophobicContact CB-CG 4.3Å; N329-L332 PolarHBondContact O-N 2.7Å; N329-L333 PolarHBondContact O-N 3.42Å; N329-L333 VanDerWaalsContact O-N 3.08Å; N329-A412 HydrophobicContact CB-CB 4.4Å; N329-A412 WeakPolarHBondContact ND2-CB 3.25Å
330	A	90.2	Very high	92	Very high	77 Å²	77	77.9 Å²	77.9	64%	0.636	40%	0.404	S	S	*	.	H	α-helix	trans	-55.2	-34	-178.2	0	0	0	0	0	113.7
331	Y	87.9	Confident	92.5	Very high	107 Å²	107	75.3 Å²	75.3	42%	0.42	39%	0.391	S	S	.	.	H	α-helix	trans	-68.5	-44.3	176.6	173.6	-99.6	0	0	0	112	N329 L333 L334	N329-Y331 PolarHBondContact O-N 3.45Å; N329-Y331 VanDerWaalsContact O-N 3.12Å; N329-Y331 VanDerWaalsContact OD1-CB 3.26Å; N329-Y331 WeakPolarHBondContact OD1-CB 3.31Å; N329-Y331 PolarHBondContact OD1-N 3.05Å; Y331-L333 VanDerWaalsContact C-N 3.33Å; Y331-L333 PolarHBondContact O-N 3.4Å; Y331-L334 PolarHBondContact O-N 2.93Å
332	L	93.6	Very high	92.7	Very high	1 Å²	1	70.9 Å²	70.9	1%	0.005	38%	0.376	C	S	.	.	H	α-helix	trans	-79.1	-13.4	-177	-60.9	179.6	0	0	0	113.5	T326 N329 L334 Q335 P336 I337 A412 L413	T326-L332 WeakPolarHBondContact O-CB 3.26Å; N329-L332 HydrophobicContact CB-CB 4.36Å; N329-L332 HydrophobicContact CB-CD1 4.35Å; N329-L332 HydrophobicContact CB-CG 4.3Å; N329-L332 PolarHBondContact O-N 2.7Å; L332-L334 PolarHBondContact O-N 3.07Å; L332-Q335 CarbonylContact O-C 3.58Å; L332-Q335 PolarHBondContact O-N 2.94Å; L332-P336 WeakPolarHBondContact O-CA 3.49Å; L332-I337 HydrophobicContact CD1-CD1 4.42Å; L332-I337 HydrophobicContact CD2-CD1 3.74Å; L332-I337 HydrophobicContact CD2-CG1 4.03Å; L332-A412 HydrophobicContact CD1-CB 4.1Å; L332-A412 HydrophobicContact CG-CB 4.2Å; L332-L413 HydrophobicContact CD1-CB 4.26Å; L332-L413 HydrophobicContact CD1-CD1 4.43Å
333	L	90.6	Very high	92.7	Very high	116 Å²	116	68.6 Å²	68.6	61%	0.607	36%	0.355	S	S	*	.	H	α-helix	trans	-61.5	-33.7	169	-71	176.4	0	0	0	112.2	T326 N329 Y331	T326-L333 HydrophobicContact CG2-CD2 4.17Å; N329-L333 PolarHBondContact O-N 3.42Å; N329-L333 VanDerWaalsContact O-N 3.08Å; Y331-L333 VanDerWaalsContact C-N 3.33Å; Y331-L333 PolarHBondContact O-N 3.4Å
334	L	88.9	Confident	92.5	Very high	162 Å²	162	71 Å²	71	85%	0.848	37%	0.365	S	S	*	.	H	α-helix	trans	-85.5	-27.7	179	-62.6	177.8	0	0	0	112.6	Y331 L332	Y331-L334 PolarHBondContact O-N 2.93Å; L332-L334 PolarHBondContact O-N 3.07Å
335	Q	89.8	Confident	92.2	Very high	123 Å²	123	71.1 Å²	71.1	58%	0.575	37%	0.371	S	S	*	.	S	Bend	trans	-139.5	77.2	-179.7	-169.1	179.8	-5.7	0	0	109.7	L332	L332-Q335 CarbonylContact O-C 3.58Å; L332-Q335 PolarHBondContact O-N 2.94Å
336	P	94.4	Very high	92.2	Very high	51 Å²	51	69.3 Å²	69.3	33%	0.331	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-67.5	147.5	-178.8	26.5	-34.5	0	0	0	111.2	Y324 T326 L332	Y324-P336 HydrophobicContact CD1-CB 4Å; Y324-P336 HydrophobicContact CD1-CG 3.85Å; Y324-P336 HydrophobicContact CG-CB 4.3Å; Y324-P336 HydrophobicContact CG-CG 4.26Å; T326-P336 HydrophobicContact CG2-CB 3.95Å; L332-P336 WeakPolarHBondContact O-CA 3.49Å
337	I	96.3	Very high	92.3	Very high	17 Å²	17	70.2 Å²	70.2	9%	0.087	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	134.1	-179.1	-68.7	173.5	0	0	0	109.4	Y324 E325 L332 K339 Y351 F354 R409 L413	Y324-I337 CarbonylContact C-O 3.59Å; Y324-I337 WeakPolarHBondContact CA-O 3.33Å; E325-I337 PolarHBondContact N-O 2.94Å; E325-I337 PolarHBondContact O-N 3.44Å; L332-I337 HydrophobicContact CD1-CD1 4.42Å; L332-I337 HydrophobicContact CD2-CD1 3.74Å; L332-I337 HydrophobicContact CD2-CG1 4.03Å; I337-K339 PolarHBondContact O-N 3Å; I337-Y351 HydrophobicContact CG2-CD1 3.83Å; I337-Y351 HydrophobicContact CG2-CG 4.19Å; I337-F354 HydrophobicContact CD1-CD2 4.03Å; I337-F354 HydrophobicContact CD1-CE2 3.96Å; I337-R409 HydrophobicContact CD1-CG 4.31Å; I337-L413 HydrophobicContact CB-CD1 4.25Å; I337-L413 HydrophobicContact CD1-CB 4.15Å; I337-L413 HydrophobicContact CD1-CD1 4.02Å; I337-L413 HydrophobicContact CD1-CD2 3.85Å; I337-L413 HydrophobicContact CD1-CG 4.23Å; I337-L413 HydrophobicContact CG2-CD1 4.38Å; I337-L413 HydrophobicContact CG2-CD2 4.31Å
338	R	97.4	Very high	92.6	Very high	126 Å²	126	67.2 Å²	67.2	48%	0.475	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	118.2	175.7	-69.6	174	178.6	170.6	-3	109	Y324 Y351 H352 D353	Y324-R338 HydrophobicContact CD1-CG 4.21Å; Y324-R338 HydrophobicContact CE1-CG 3.64Å; R338-Y351 CarbonylContact O-C 3.44Å; R338-Y351 VanDerWaalsContact O-CA 3.26Å; R338-Y351 WeakPolarHBondContact O-CA 3.44Å; R338-H352 HydrophobicContact CB-CB 3.92Å; R338-H352 PolarHBondContact O-N 3.32Å; R338-D353 IonicContact CZ-OD2 2.68Å; R338-D353 IonicContact NH1-OD2 3.7Å; R338-D353 PolarHBondContact NH1-OD2 3.31Å
339	K	96.8	Very high	93	Very high	17 Å²	17	61.7 Å²	61.7	7%	0.074	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	137.5	-177.1	175.9	-175.3	179.6	-179.3	0	109.9	C322 S323 E325 I337 Y347 L350 Y351	C322-K339 CarbonylContact C-O 2.88Å; C322-K339 WeakPolarHBondContact CA-O 3.1Å; S323-K339 PolarHBondContact N-O 2.95Å; S323-K339 PolarHBondContact O-N 3.08Å; E325-K339 HydrophobicContact CB-CB 3.98Å; E325-K339 HydrophobicContact CB-CD 3.95Å; E325-K339 HydrophobicContact CG-CD 4.2Å; E325-K339 VanDerWaalsContact OE2-CD 3.31Å; E325-K339 WeakPolarHBondContact OE2-CD 3.39Å; E325-K339 IonicContact OE2-NZ 3.91Å; E325-K339 PolarHBondContact OE2-NZ 3.23Å; I337-K339 PolarHBondContact O-N 3Å; K339-Y347 WeakPolarHBondContact CE-OH 3.31Å; K339-Y347 PolarHBondContact NZ-OH 3.41Å; K339-L350 CarbonylContact C-O 3.57Å; K339-L350 WeakPolarHBondContact CA-O 3.32Å; K339-Y351 HydrophobicContact CB-CD1 3.95Å; K339-Y351 HydrophobicContact CB-CE1 3.95Å; K339-Y351 HydrophobicContact CD-CE1 3.95Å; K339-Y351 HydrophobicContact CG-CD1 4.1Å; K339-Y351 HydrophobicContact CG-CE1 3.7Å
340	E	95.1	Very high	93.3	Very high	65 Å²	65	59.3 Å²	59.3	30%	0.304	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	122.3	169.5	180	-179.6	179.7	0	0	108.1	I342 A349 L350 H352	E340-I342 HydrophobicContact CG-CD1 3.79Å; E340-I342 PolarHBondContact O-N 2.68Å; E340-A349 CarbonylContact O-C 3.49Å; E340-A349 WeakPolarHBondContact O-CA 3.34Å; E340-L350 HydrophobicContact CB-CB 4.41Å; E340-L350 PolarHBondContact N-O 3.04Å; E340-L350 PolarHBondContact O-N 2.63Å; E340-H352 IonicContact OE2-CD2 3.79Å; E340-H352 IonicContact OE2-CE1 3.35Å; E340-H352 PolarHBondContact OE2-CE1 3.27Å; E340-H352 IonicContact OE2-NE2 2.66Å; E340-H352 PolarHBondContact OE2-NE2 2.91Å
341	V	94	Very high	93.6	Very high	6 Å²	6	56 Å²	56	4%	0.036	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	115.2	174.1	-176.3	0	0	0	0	108	L320 Y321 L344 Y347	L320-V341 HydrophobicContact CD2-CB 4.38Å; L320-V341 HydrophobicContact CD2-CG1 3.84Å; Y321-V341 HydrophobicContact CE1-CG2 4.39Å; Y321-V341 PolarHBondContact O-N 3Å; Y321-V341 VanDerWaalsContact O-N 3.14Å; V341-L344 HydrophobicContact CG1-CD2 3.89Å; V341-Y347 HydrophobicContact CG1-CE2 4.33Å
342	I	91.6	Very high	94.1	Very high	30 Å²	30	53.2 Å²	53.2	15%	0.154	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	-38.7	-178.1	-55.9	-62.1	0	0	0	110.5	E340 I348 L350 L483 V485	E340-I342 HydrophobicContact CG-CD1 3.79Å; E340-I342 PolarHBondContact O-N 2.68Å; I342-I348 HydrophobicContact CB-CB 4.38Å; I342-I348 HydrophobicContact CB-CG2 4.07Å; I342-I348 HydrophobicContact CG2-CG2 4.46Å; I342-I348 PolarHBondContact N-O 3.06Å; I342-L350 HydrophobicContact CD1-CB 4.11Å; I342-L350 HydrophobicContact CG1-CB 3.98Å; I342-L483 HydrophobicContact CG2-CD1 4.13Å; I342-V485 HydrophobicContact CG2-CG2 4.05Å
343	H	92.5	Very high	94.2	Very high	48 Å²	48	57.9 Å²	57.9	22%	0.222	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	149.3	-178.5	-155.4	-111.5	0	0	0	111.3	E345 P346 Y347 I348 L483	H343-E345 VanDerWaalsContact CE1-C 3.43Å; H343-E345 PolarHBondContact CE1-O 2.04Å; H343-E345 PolarHBondContact ND1-N 2.78Å; H343-E345 PolarHBondContact ND1-O 3.47Å; H343-E345 VanDerWaalsContact ND1-O 3.14Å; H343-P346 CarbonylContact C-O 3.51Å; H343-P346 WeakPolarHBondContact CB-O 3.47Å; H343-P346 PolarHBondContact ND1-O 2.81Å; H343-Y347 WeakPolarHBondContact O-CA 3.33Å; H343-I348 HydrophobicContact CB-CB 3.93Å; H343-I348 HydrophobicContact CB-CD1 3.99Å; H343-I348 HydrophobicContact CB-CG1 4.21Å; H343-I348 PolarHBondContact N-O 3.4Å; H343-I348 VanDerWaalsContact N-O 3.12Å; H343-I348 PolarHBondContact O-N 2.8Å; H343-L483 HydrophobicContact CB-CD2 3.61Å; H343-L483 WeakPolarHBondContact CD2-CD2 3.08Å
344	L	90.8	Very high	94.6	Very high	84 Å²	84	52.6 Å²	52.6	44%	0.44	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-41	-178	-61.7	176.8	0	0	0	112.3	I317 S319 L320 V341 P346 Y347	I317-L344 HydrophobicContact CG2-CD1 4.44Å; S319-L344 WeakPolarHBondContact OG-CD1 3.34Å; L320-L344 HydrophobicContact CD2-CD2 4.07Å; L320-L344 HydrophobicContact CD2-CG 3.97Å; V341-L344 HydrophobicContact CG1-CD2 3.89Å; L344-P346 CarbonylContact C-O 3.46Å; L344-P346 CarbonylContact O-C 3.56Å; L344-Y347 VanDerWaalsContact O-CA 3.31Å; L344-Y347 WeakPolarHBondContact O-CA 3.24Å; L344-Y347 PolarHBondContact O-N 3.42Å
345	E	89.6	Confident	95	Very high	152 Å²	152	45 Å²	45	71%	0.71	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-148.7	97.3	-173.5	-175.3	168.2	-154.6	0	0	110.4	H343	H343-E345 VanDerWaalsContact CE1-C 3.43Å; H343-E345 PolarHBondContact CE1-O 2.04Å; H343-E345 PolarHBondContact ND1-N 2.78Å; H343-E345 PolarHBondContact ND1-O 3.47Å; H343-E345 VanDerWaalsContact ND1-O 3.14Å
346	P	93.7	Very high	95.4	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.013	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	cis	-69.4	148.3	5.8	29.1	-35.4	0	0	0	110.5	H343 L344 I348 A481 D505 D507 T508	H343-P346 CarbonylContact C-O 3.51Å; H343-P346 WeakPolarHBondContact CB-O 3.47Å; H343-P346 PolarHBondContact ND1-O 2.81Å; L344-P346 CarbonylContact C-O 3.46Å; L344-P346 CarbonylContact O-C 3.56Å; P346-I348 HydrophobicContact CG-CD1 4.14Å; P346-I348 PolarHBondContact O-N 3.16Å; P346-A481 HydrophobicContact CG-CB 3.96Å; P346-D505 WeakPolarHBondContact CB-OD2 3.4Å; P346-D507 HydrophobicContact CB-CB 4.41Å; P346-D507 HydrophobicContact CG-CB 3.79Å; P346-T508 HydrophobicContact CB-CG2 4.08Å
347	Y	95.1	Very high	95.5	Very high	58 Å²	58	43.3 Å²	43.3	23%	0.227	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	117.9	178.8	176.8	-93.1	0	0	0	110.1	K339 V341 H343 L344 A349 F494 W495 W496	K339-Y347 WeakPolarHBondContact CE-OH 3.31Å; K339-Y347 PolarHBondContact NZ-OH 3.41Å; V341-Y347 HydrophobicContact CG1-CE2 4.33Å; H343-Y347 WeakPolarHBondContact O-CA 3.33Å; L344-Y347 VanDerWaalsContact O-CA 3.31Å; L344-Y347 WeakPolarHBondContact O-CA 3.24Å; L344-Y347 PolarHBondContact O-N 3.42Å; Y347-A349 HydrophobicContact CE1-CB 3.88Å; Y347-F494 HydrophobicContact CD1-CD1 4.21Å; Y347-F494 HydrophobicContact CD1-CE1 4.12Å; Y347-F494 AromaticContact CE1-CD1 3.91Å; Y347-F494 HydrophobicContact CE1-CD1 3.91Å; Y347-F494 AromaticContact CE1-CE1 3.99Å; Y347-F494 HydrophobicContact CE1-CE1 3.99Å; Y347-W495 WeakPolarHBondContact O-CA 3.05Å; Y347-W495 WeakPolarHBondContact O-CB 3.18Å; Y347-W496 AromaticContact CD1-CD1 3.98Å; Y347-W496 AromaticContact CD1-NE1 3.92Å
348	I	96.4	Very high	95.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	125.8	179.1	-60.2	164	0	0	0	108.3	I342 H343 P346 F478 L483 L493 F494 W495	I342-I348 HydrophobicContact CB-CB 4.38Å; I342-I348 HydrophobicContact CB-CG2 4.07Å; I342-I348 HydrophobicContact CG2-CG2 4.46Å; I342-I348 PolarHBondContact N-O 3.06Å; H343-I348 HydrophobicContact CB-CB 3.93Å; H343-I348 HydrophobicContact CB-CD1 3.99Å; H343-I348 HydrophobicContact CB-CG1 4.21Å; H343-I348 PolarHBondContact N-O 3.4Å; H343-I348 VanDerWaalsContact N-O 3.12Å; H343-I348 PolarHBondContact O-N 2.8Å; P346-I348 HydrophobicContact CG-CD1 4.14Å; P346-I348 PolarHBondContact O-N 3.16Å; I348-F478 HydrophobicContact CD1-CB 4.46Å; I348-F478 HydrophobicContact CD1-CD1 3.77Å; I348-F478 HydrophobicContact CD1-CD2 3.81Å; I348-F478 HydrophobicContact CD1-CE1 3.85Å; I348-F478 HydrophobicContact CD1-CE2 3.89Å; I348-F478 HydrophobicContact CD1-CG 3.75Å; I348-F478 HydrophobicContact CD1-CZ 3.91Å; I348-F478 HydrophobicContact CG1-CE1 4.31Å; I348-F478 HydrophobicContact CG1-CZ 4.27Å; I348-F478 HydrophobicContact CG2-CE2 4.38Å; I348-F478 HydrophobicContact CG2-CZ 4.44Å; I348-L483 HydrophobicContact CD1-CD1 4.25Å; I348-L483 HydrophobicContact CD1-CD2 4.03Å; I348-L493 HydrophobicContact CG2-CD1 3.56Å; I348-L493 HydrophobicContact CG2-CG 4.35Å; I348-F494 WeakPolarHBondContact CA-O 3.45Å; I348-W495 HydrophobicContact CG1-CB 4.01Å
349	A	96.8	Very high	95.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	139.2	179.3	0	0	0	0	0	111.6	E340 Y347 Y351 F494	E340-A349 CarbonylContact O-C 3.49Å; E340-A349 WeakPolarHBondContact O-CA 3.34Å; Y347-A349 HydrophobicContact CE1-CB 3.88Å; A349-Y351 HydrophobicContact CB-CE2 4.41Å; A349-F494 PolarHBondContact N-O 3.24Å; A349-F494 PolarHBondContact O-N 3.13Å
350	L	97.3	Very high	95.7	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.016	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	126.7	173.4	-172.2	69.6	0	0	0	109.4	K339 E340 I342 H352 Y466 V488 A491 A492 L493	K339-L350 CarbonylContact C-O 3.57Å; K339-L350 WeakPolarHBondContact CA-O 3.32Å; E340-L350 HydrophobicContact CB-CB 4.41Å; E340-L350 PolarHBondContact N-O 3.04Å; E340-L350 PolarHBondContact O-N 2.63Å; I342-L350 HydrophobicContact CD1-CB 4.11Å; I342-L350 HydrophobicContact CG1-CB 3.98Å; L350-H352 VanDerWaalsContact CD2-CE1 3.46Å; L350-H352 WeakPolarHBondContact CD2-CE1 3.04Å; L350-Y466 HydrophobicContact CD1-CE2 4.37Å; L350-V488 HydrophobicContact CD2-CB 4.31Å; L350-V488 HydrophobicContact CD2-CG2 3.9Å; L350-A491 HydrophobicContact CD1-CB 3.8Å; L350-A491 HydrophobicContact CG-CB 4.19Å; L350-A492 CarbonylContact C-O 3.51Å; L350-L493 HydrophobicContact CD1-CB 4.44Å; L350-L493 HydrophobicContact CD1-CD1 4.25Å
351	Y	98.1	Very high	95.8	Very high	8 Å²	8	41.9 Å²	41.9	3%	0.031	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	105	176.8	-60.3	-69.2	0	0	0	109.4	E325 I337 R338 K339 A349 L413 F463 A491 A492 F494	E325-Y351 HydrophobicContact CG-CE1 4.45Å; I337-Y351 HydrophobicContact CG2-CD1 3.83Å; I337-Y351 HydrophobicContact CG2-CG 4.19Å; R338-Y351 CarbonylContact O-C 3.44Å; R338-Y351 VanDerWaalsContact O-CA 3.26Å; R338-Y351 WeakPolarHBondContact O-CA 3.44Å; K339-Y351 HydrophobicContact CB-CD1 3.95Å; K339-Y351 HydrophobicContact CB-CE1 3.95Å; K339-Y351 HydrophobicContact CD-CE1 3.95Å; K339-Y351 HydrophobicContact CG-CD1 4.1Å; K339-Y351 HydrophobicContact CG-CE1 3.7Å; A349-Y351 HydrophobicContact CB-CE2 4.41Å; Y351-L413 HydrophobicContact CD1-CD1 4.06Å; Y351-L413 HydrophobicContact CD1-CD2 3.88Å; Y351-L413 HydrophobicContact CD1-CG 4.45Å; Y351-L413 HydrophobicContact CD2-CD2 3.71Å; Y351-L413 HydrophobicContact CE1-CD1 3.71Å; Y351-L413 HydrophobicContact CE1-CD2 4.03Å; Y351-L413 HydrophobicContact CE1-CG 4.16Å; Y351-L413 HydrophobicContact CE2-CD2 3.84Å; Y351-L413 HydrophobicContact CE2-CG 4.32Å; Y351-L413 HydrophobicContact CG-CD2 3.71Å; Y351-F463 AromaticContact CD2-CE2 3.94Å; Y351-F463 HydrophobicContact CD2-CE2 3.94Å; Y351-F463 HydrophobicContact CD2-CZ 4.33Å; Y351-F463 HydrophobicContact CE2-CE2 4.05Å; Y351-A491 CarbonylContact O-C 3.6Å; Y351-A491 WeakPolarHBondContact O-CA 3.43Å; Y351-A491 WeakPolarHBondContact O-CB 3.41Å; Y351-A492 PolarHBondContact N-O 2.82Å; Y351-A492 PolarHBondContact O-N 3.1Å; Y351-F494 HydrophobicContact CD2-CB 4.23Å; Y351-F494 HydrophobicContact CE2-CB 3.57Å; Y351-F494 HydrophobicContact CE2-CG 4.19Å
352	H	97.6	Very high	95.9	Very high	49 Å²	49	46 Å²	46	23%	0.227	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	147.8	-176.8	-66.4	-87	0	0	0	111.6	R338 E340 L350 F354	R338-H352 HydrophobicContact CB-CB 3.92Å; R338-H352 PolarHBondContact O-N 3.32Å; E340-H352 IonicContact OE2-CD2 3.79Å; E340-H352 IonicContact OE2-CE1 3.35Å; E340-H352 PolarHBondContact OE2-CE1 3.27Å; E340-H352 IonicContact OE2-NE2 2.66Å; E340-H352 PolarHBondContact OE2-NE2 2.91Å; L350-H352 VanDerWaalsContact CD2-CE1 3.46Å; L350-H352 WeakPolarHBondContact CD2-CE1 3.04Å; H352-F354 PolarHBondContact O-N 2.97Å; H352-F354 VanDerWaalsContact O-N 3.14Å
353	D	96.3	Very high	96.2	Very high	98 Å²	98	44.6 Å²	44.6	52%	0.524	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	52	34.6	178	-53.4	-50.8	0	0	0	113.3	R338 V355	R338-D353 IonicContact CZ-OD2 2.68Å; R338-D353 IonicContact NH1-OD2 3.7Å; R338-D353 PolarHBondContact NH1-OD2 3.31Å; D353-V355 PolarHBondContact O-N 2.84Å
354	F	97.8	Very high	96.4	Very high	5 Å²	5	45.6 Å²	45.6	2%	0.022	23%	0.228	C	C	.	.			trans	-66.3	-36.7	-174.7	-179.3	-103.2	0	0	0	112.7	I337 H352 L406 R409 I410 L413 F463 I465 N490 A492	I337-F354 HydrophobicContact CD1-CD2 4.03Å; I337-F354 HydrophobicContact CD1-CE2 3.96Å; H352-F354 PolarHBondContact O-N 2.97Å; H352-F354 VanDerWaalsContact O-N 3.14Å; F354-L406 HydrophobicContact CD1-CD1 4.5Å; F354-L406 HydrophobicContact CE1-CD1 3.68Å; F354-L406 HydrophobicContact CZ-CD1 4.37Å; F354-R409 HydrophobicContact CE2-CB 4.49Å; F354-R409 HydrophobicContact CE2-CG 3.7Å; F354-R409 HydrophobicContact CZ-CB 4.17Å; F354-R409 HydrophobicContact CZ-CG 3.84Å; F354-R409 PolarHBondContact O-NH1 3.39Å; F354-I410 HydrophobicContact CE1-CG1 3.97Å; F354-I410 HydrophobicContact CZ-CG1 3.62Å; F354-L413 HydrophobicContact CD2-CD2 3.99Å; F354-L413 HydrophobicContact CE2-CD2 3.69Å; F354-F463 AromaticContact CD1-CE1 3.81Å; F354-F463 HydrophobicContact CD1-CE1 3.81Å; F354-F463 HydrophobicContact CD1-CZ 4.03Å; F354-F463 HydrophobicContact CD2-CZ 4Å; F354-F463 AromaticContact CE1-CE1 3.4Å; F354-F463 HydrophobicContact CE1-CE1 3.4Å; F354-F463 VanDerWaalsContact CE1-CE1 3.4Å; F354-F463 AromaticContact CE1-CZ 3.72Å; F354-F463 HydrophobicContact CE1-CZ 3.72Å; F354-F463 HydrophobicContact CE2-CE1 4.24Å; F354-F463 AromaticContact CE2-CZ 3.67Å; F354-F463 HydrophobicContact CE2-CZ 3.67Å; F354-F463 HydrophobicContact CG-CE1 4.41Å; F354-F463 HydrophobicContact CG-CZ 4.19Å; F354-F463 AromaticContact CZ-CE1 3.66Å; F354-F463 HydrophobicContact CZ-CE1 3.66Å; F354-F463 AromaticContact CZ-CZ 3.53Å; F354-F463 HydrophobicContact CZ-CZ 3.53Å; F354-I465 HydrophobicContact CD1-CD1 4.04Å; F354-I465 HydrophobicContact CD1-CG1 4.23Å; F354-I465 HydrophobicContact CE1-CD1 3.87Å; F354-I465 HydrophobicContact CE1-CG1 4.4Å; F354-N490 PolarHBondContact N-O 3.34Å; F354-A492 HydrophobicContact CB-CB 3.9Å; F354-A492 HydrophobicContact CD1-CB 3.82Å; F354-A492 HydrophobicContact CG-CB 3.82Å
355	V	98	Very high	96.6	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.024	23%	0.229	C	C	.	.	S	Bend	trans	-116.3	153.9	170.4	-67.1	0	0	0	0	110.7	D353 E359 A360 L406 I465 N490	D353-V355 PolarHBondContact O-N 2.84Å; V355-E359 WeakPolarHBondContact CA-OE2 3.32Å; V355-E359 HydrophobicContact CB-CB 4.16Å; V355-A360 HydrophobicContact CG2-CB 4.15Å; V355-L406 HydrophobicContact CG1-CD1 3.74Å; V355-I465 HydrophobicContact CG1-CD1 4.36Å; V355-I465 HydrophobicContact CG1-CG2 4.12Å; V355-I465 HydrophobicContact CG2-CG2 3.78Å; V355-N490 HydrophobicContact CG2-CB 4.06Å; V355-N490 PolarHBondContact N-O 2.81Å; V355-N490 VanDerWaalsContact N-O 3.17Å; V355-N490 VanDerWaalsContact O-CB 3.26Å; V355-N490 WeakPolarHBondContact O-CB 3.32Å
356	S	97.6	Very high	96.9	Very high	48 Å²	48	41.6 Å²	41.6	34%	0.336	21%	0.206	S	C	.	.			trans	-78.8	161.1	168.3	69.4	0	0	0	0	111.5	S358 E359 A360	S356-S358 PolarHBondContact O-N 3.29Å; S356-S358 PolarHBondContact OG-OG 3.24Å; S356-E359 PolarHBondContact N-OE2 3.4Å; S356-E359 PolarHBondContact O-N 3.38Å; S356-E359 VanDerWaalsContact O-N 3.1Å; S356-E359 WeakPolarHBondContact OG-CG 3.32Å; S356-E359 PolarHBondContact OG-N 3.27Å; S356-E359 VanDerWaalsContact OG-N 3.15Å; S356-E359 PolarHBondContact OG-OE2 2.74Å; S356-A360 PolarHBondContact O-N 3.16Å
357	D	97.9	Very high	96.9	Very high	90 Å²	90	41.5 Å²	41.5	48%	0.481	21%	0.206	S	C	.	.	H	α-helix	trans	-53.3	-37.6	171	-76.6	-35.3	0	0	0	112.4	A360 Q361 K489 N490	D357-A360 PolarHBondContact O-N 3.22Å; D357-Q361 VanDerWaalsContact O-CB 3.31Å; D357-Q361 WeakPolarHBondContact O-CB 2.99Å; D357-Q361 PolarHBondContact O-N 3.25Å; D357-K489 WeakPolarHBondContact OD1-CE 3.4Å; D357-K489 IonicContact OD1-NZ 3.59Å; D357-K489 PolarHBondContact OD1-NZ 2.95Å; D357-K489 IonicContact OD2-NZ 3.69Å; D357-N490 PolarHBondContact OD1-ND2 2.87Å
358	S	97.9	Very high	96.6	Very high	70 Å²	70	42 Å²	42	49%	0.49	21%	0.21	S	C	.	.	H	α-helix	trans	-69.1	-38	179.4	74.4	0	0	0	0	112.8	S356 K362	S356-S358 PolarHBondContact O-N 3.29Å; S356-S358 PolarHBondContact OG-OG 3.24Å; S358-K362 WeakPolarHBondContact O-CB 3.42Å; S358-K362 WeakPolarHBondContact O-CG 3.42Å; S358-K362 PolarHBondContact O-N 3.42Å
359	E	97.9	Very high	96.2	Very high	26 Å²	26	46.8 Å²	46.8	12%	0.121	24%	0.241	C	C	.	.	H	α-helix	trans	-68.4	-46.9	174.7	-72.8	172.4	141	0	0	109.8	V355 S356 Q361 K362 I363 M402 R409	V355-E359 WeakPolarHBondContact CA-OE2 3.32Å; V355-E359 HydrophobicContact CB-CB 4.16Å; S356-E359 PolarHBondContact N-OE2 3.4Å; S356-E359 PolarHBondContact O-N 3.38Å; S356-E359 VanDerWaalsContact O-N 3.1Å; S356-E359 WeakPolarHBondContact OG-CG 3.32Å; S356-E359 PolarHBondContact OG-N 3.27Å; S356-E359 VanDerWaalsContact OG-N 3.15Å; S356-E359 PolarHBondContact OG-OE2 2.74Å; E359-Q361 VanDerWaalsContact C-N 3.33Å; E359-Q361 PolarHBondContact O-N 2.96Å; E359-K362 PolarHBondContact O-N 3.32Å; E359-I363 VanDerWaalsContact O-CG1 3.26Å; E359-I363 WeakPolarHBondContact O-CG1 3.26Å; E359-I363 PolarHBondContact O-N 3.36Å; E359-M402 HydrophobicContact CB-SD 4.39Å; E359-M402 HydrophobicContact CG-CG 4.1Å; E359-M402 HydrophobicContact CG-SD 4.29Å; E359-R409 IonicContact OE1-CZ 3.92Å; E359-R409 IonicContact OE1-NH1 3.92Å; E359-R409 PolarHBondContact OE1-NH1 3.36Å; E359-R409 IonicContact OE1-NH2 2.73Å; E359-R409 PolarHBondContact OE1-NH2 2.78Å; E359-R409 IonicContact OE2-CZ 3.66Å; E359-R409 IonicContact OE2-NH1 3.94Å; E359-R409 PolarHBondContact OE2-NH1 2.97Å; E359-R409 IonicContact OE2-NH2 3.43Å
360	A	97.9	Very high	95.8	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.008	27%	0.274	C	S	.	.	H	α-helix	trans	-59.2	-43.1	178	0	0	0	0	0	112.1	V355 S356 D357 R364 L467	V355-A360 HydrophobicContact CG2-CB 4.15Å; S356-A360 PolarHBondContact O-N 3.16Å; D357-A360 PolarHBondContact O-N 3.22Å; A360-R364 WeakPolarHBondContact O-CG 3.23Å; A360-R364 PolarHBondContact O-N 2.86Å; A360-L467 HydrophobicContact CB-CB 4.41Å; A360-L467 HydrophobicContact CB-CD2 4.21Å
361	Q	96.9	Very high	95.2	Very high	98 Å²	98	56.4 Å²	56.4	46%	0.458	28%	0.279	S	S	.	.	H	α-helix	trans	-62	-49.8	174.5	179.5	173.8	-5.8	0	0	112	D357 E359 I363 R364 E365	D357-Q361 VanDerWaalsContact O-CB 3.31Å; D357-Q361 WeakPolarHBondContact O-CB 2.99Å; D357-Q361 PolarHBondContact O-N 3.25Å; E359-Q361 VanDerWaalsContact C-N 3.33Å; E359-Q361 PolarHBondContact O-N 2.96Å; Q361-I363 VanDerWaalsContact C-N 3.32Å; Q361-I363 PolarHBondContact O-N 2.79Å; Q361-R364 PolarHBondContact O-N 2.88Å; Q361-R364 VanDerWaalsContact O-N 3.11Å; Q361-E365 HydrophobicContact CG-CG 4.32Å; Q361-E365 VanDerWaalsContact CG-OE1 3.25Å; Q361-E365 WeakPolarHBondContact CG-OE1 3.34Å; Q361-E365 PolarHBondContact NE2-OE1 2.92Å; Q361-E365 WeakPolarHBondContact O-CG 3.48Å; Q361-E365 PolarHBondContact O-N 3.28Å
362	K	97.2	Very high	94.4	Very high	93 Å²	93	63.1 Å²	63.1	40%	0.404	31%	0.311	S	S	.	.	H	α-helix	trans	-57.9	-42.8	178.2	-78.9	-178.3	177.1	-172.1	0	112.6	S358 E359 R364 E365 F366 M402	S358-K362 WeakPolarHBondContact O-CB 3.42Å; S358-K362 WeakPolarHBondContact O-CG 3.42Å; S358-K362 PolarHBondContact O-N 3.42Å; E359-K362 PolarHBondContact O-N 3.32Å; K362-R364 VanDerWaalsContact C-N 3.3Å; K362-R364 PolarHBondContact O-N 2.76Å; K362-E365 PolarHBondContact O-N 2.98Å; K362-F366 HydrophobicContact CB-CE2 4.08Å; K362-F366 WeakPolarHBondContact O-CD2 3.29Å; K362-F366 VanDerWaalsContact O-CG 3.23Å; K362-F366 WeakPolarHBondContact O-CG 3.5Å; K362-F366 PolarHBondContact O-N 2.86Å; K362-M402 HydrophobicContact CB-CE 4.01Å
363	I	97.8	Very high	93.3	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-59.1	-44	177.1	-66.9	166	0	0	0	110.5	E359 Q361 A367 L395 M402 L403 L406 L426 V428 L467	E359-I363 VanDerWaalsContact O-CG1 3.26Å; E359-I363 WeakPolarHBondContact O-CG1 3.26Å; E359-I363 PolarHBondContact O-N 3.36Å; Q361-I363 VanDerWaalsContact C-N 3.32Å; Q361-I363 PolarHBondContact O-N 2.79Å; I363-A367 WeakPolarHBondContact O-CB 3.38Å; I363-A367 PolarHBondContact O-N 2.91Å; I363-A367 VanDerWaalsContact O-N 3.08Å; I363-L395 HydrophobicContact CG2-CD1 4.1Å; I363-M402 HydrophobicContact CD1-CE 4.3Å; I363-M402 HydrophobicContact CD1-SD 4.49Å; I363-M402 HydrophobicContact CG1-CE 3.55Å; I363-M402 HydrophobicContact CG1-SD 4.33Å; I363-L403 HydrophobicContact CG1-CD2 4.29Å; I363-L406 HydrophobicContact CD1-CD2 4.01Å; I363-L426 HydrophobicContact CD1-CD2 4.47Å; I363-L426 HydrophobicContact CG2-CD2 4.07Å; I363-V428 HydrophobicContact CG2-CG1 4.42Å; I363-V428 HydrophobicContact CG2-CG2 3.56Å; I363-L467 HydrophobicContact CB-CD1 4.27Å; I363-L467 HydrophobicContact CB-CD2 4.28Å; I363-L467 HydrophobicContact CD1-CD2 3.91Å; I363-L467 HydrophobicContact CG2-CD1 3.59Å; I363-L467 HydrophobicContact CG2-CD2 4.17Å
364	R	95.8	Very high	91.8	Very high	69 Å²	69	60.2 Å²	60.2	26%	0.26	29%	0.291	S	S	.	.	H	α-helix	trans	-65.1	-44.8	177.1	-67.5	-172.7	-62.9	161.9	2.4	112.1	A360 Q361 K362 F366 A367 E368 L467 W521	A360-R364 WeakPolarHBondContact O-CG 3.23Å; A360-R364 PolarHBondContact O-N 2.86Å; Q361-R364 PolarHBondContact O-N 2.88Å; Q361-R364 VanDerWaalsContact O-N 3.11Å; K362-R364 VanDerWaalsContact C-N 3.3Å; K362-R364 PolarHBondContact O-N 2.76Å; R364-F366 VanDerWaalsContact C-N 3.34Å; R364-F366 PolarHBondContact O-N 3.41Å; R364-A367 PolarHBondContact O-N 3.3Å; R364-A367 VanDerWaalsContact O-N 3.16Å; R364-E368 WeakPolarHBondContact O-CB 3.17Å; R364-E368 PolarHBondContact O-N 2.94Å; R364-L467 HydrophobicContact CG-CB 4.14Å; R364-L467 HydrophobicContact CG-CD1 4.01Å; R364-W521 HydrophobicContact CB-CD2 4.45Å; R364-W521 HydrophobicContact CB-CE3 4.3Å; R364-W521 HydrophobicContact CB-CH2 4.24Å; R364-W521 HydrophobicContact CB-CZ2 4.41Å; R364-W521 HydrophobicContact CB-CZ3 4.21Å; R364-W521 VanDerWaalsContact CD-CG 3.44Å; R364-W521 HydrophobicContact CG-CB 4.29Å; R364-W521 HydrophobicContact CG-CD2 3.71Å; R364-W521 HydrophobicContact CG-CE3 3.73Å; R364-W521 HydrophobicContact CG-CG 4.01Å; R364-W521 HydrophobicContact CG-CH2 4.5Å; R364-W521 HydrophobicContact CG-CZ2 4.5Å; R364-W521 HydrophobicContact CG-CZ3 4.16Å
365	E	95.1	Very high	90.1	Very high	97 Å²	97	62.5 Å²	62.5	45%	0.453	31%	0.305	S	S	.	.	H	α-helix	trans	-61.2	-40.9	178	-72.3	172	-179.3	0	0	112.1	Q361 K362 A367 P369	Q361-E365 HydrophobicContact CG-CG 4.32Å; Q361-E365 VanDerWaalsContact CG-OE1 3.25Å; Q361-E365 WeakPolarHBondContact CG-OE1 3.34Å; Q361-E365 PolarHBondContact NE2-OE1 2.92Å; Q361-E365 WeakPolarHBondContact O-CG 3.48Å; Q361-E365 PolarHBondContact O-N 3.28Å; K362-E365 PolarHBondContact O-N 2.98Å; E365-A367 VanDerWaalsContact C-N 3.34Å; E365-P369 VanDerWaalsContact O-CD 3.28Å; E365-P369 WeakPolarHBondContact O-CD 3.41Å
366	F	94.9	Very high	87.9	Confident	54 Å²	54	63.4 Å²	63.4	24%	0.237	31%	0.311	C	S	.	.	H	α-helix	trans	-68.3	-33.7	175.3	-64.1	-34.8	0	0	0	112.8	K362 R364 L395 V399 D400 M402	K362-F366 HydrophobicContact CB-CE2 4.08Å; K362-F366 WeakPolarHBondContact O-CD2 3.29Å; K362-F366 VanDerWaalsContact O-CG 3.23Å; K362-F366 WeakPolarHBondContact O-CG 3.5Å; K362-F366 PolarHBondContact O-N 2.86Å; R364-F366 VanDerWaalsContact C-N 3.34Å; R364-F366 PolarHBondContact O-N 3.41Å; F366-L395 HydrophobicContact CB-CD1 3.95Å; F366-L395 HydrophobicContact CB-CD2 4.02Å; F366-V399 HydrophobicContact CB-CG1 4.23Å; F366-V399 HydrophobicContact CD1-CG1 4.28Å; F366-V399 HydrophobicContact CD2-CG1 4.22Å; F366-V399 HydrophobicContact CG-CG1 4Å; F366-D400 HydrophobicContact CD2-CB 4.38Å; F366-D400 HydrophobicContact CE2-CB 3.5Å; F366-D400 VanDerWaalsContact CE2-CB 3.5Å; F366-D400 HydrophobicContact CZ-CB 3.7Å; F366-D400 WeakPolarHBondContact CZ-OD2 3.5Å; F366-M402 HydrophobicContact CE2-CE 4.24Å
367	A	94.2	Very high	85.4	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-78	-35.9	-179.3	0	0	0	0	0	113.1	I363 R364 E365 P369 W370 L371 A393 L395 V428 W521	I363-A367 WeakPolarHBondContact O-CB 3.38Å; I363-A367 PolarHBondContact O-N 2.91Å; I363-A367 VanDerWaalsContact O-N 3.08Å; R364-A367 PolarHBondContact O-N 3.3Å; R364-A367 VanDerWaalsContact O-N 3.16Å; E365-A367 VanDerWaalsContact C-N 3.34Å; A367-P369 VanDerWaalsContact C-CD 3.48Å; A367-W370 CarbonylContact O-C 3.55Å; A367-W370 PolarHBondContact O-N 3.4Å; A367-L371 PolarHBondContact O-N 3.45Å; A367-A393 HydrophobicContact CB-CB 4.06Å; A367-L395 HydrophobicContact CB-CD1 4.4Å; A367-V428 HydrophobicContact CB-CB 3.58Å; A367-V428 HydrophobicContact CB-CG1 3.52Å; A367-V428 HydrophobicContact CB-CG2 3.97Å; A367-W521 HydrophobicContact CB-CZ3 4.3Å
368	E	89.8	Confident	82.5	Confident	70 Å²	70	63 Å²	63	33%	0.327	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-52.1	-44.7	-168.9	-174.8	174.7	-173.9	0	0	115	R39 R364 W370 L371	R39-E368 IonicContact CZ-OE1 3.52Å; R39-E368 IonicContact NE-OE1 3.95Å; R39-E368 PolarHBondContact NE-OE1 2.79Å; R39-E368 IonicContact NH2-OE1 3.36Å; R39-E368 PolarHBondContact NH2-OE1 3.16Å; R364-E368 WeakPolarHBondContact O-CB 3.17Å; R364-E368 PolarHBondContact O-N 2.94Å; E368-W370 PolarHBondContact O-N 3.4Å; E368-L371 PolarHBondContact O-N 3.41Å
369	P	88	Confident	80.2	Confident	100 Å²	100	62.1 Å²	62.1	65%	0.649	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-67.1	-20.7	179.6	-20.4	33.5	0	0	0	113.8	E365 A367	E365-P369 VanDerWaalsContact O-CD 3.28Å; E365-P369 WeakPolarHBondContact O-CD 3.41Å; A367-P369 VanDerWaalsContact C-CD 3.48Å
370	W	87.8	Confident	77.1	Confident	183 Å²	183	69.5 Å²	69.5	69%	0.693	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-107.8	3.8	-173.7	-51.3	97.6	0	0	0	112.9	A367 E368 Q372 A393	A367-W370 CarbonylContact O-C 3.55Å; A367-W370 PolarHBondContact O-N 3.4Å; E368-W370 PolarHBondContact O-N 3.4Å; W370-Q372 PolarHBondContact O-N 3.08Å; W370-A393 HydrophobicContact CB-CB 3.93Å
371	L	84.5	Confident	74	Confident	22 Å²	22	76.6 Å²	76.6	12%	0.115	39%	0.386	C	S	.	.			trans	-63.4	116.8	177.6	-78.3	179.3	0	0	0	110.5	A367 E368 K391 A393 N430 W521	A367-L371 PolarHBondContact O-N 3.45Å; E368-L371 PolarHBondContact O-N 3.41Å; L371-K391 HydrophobicContact CB-CB 3.93Å; L371-K391 HydrophobicContact CB-CD 4.4Å; L371-K391 HydrophobicContact CD2-CB 4.1Å; L371-K391 HydrophobicContact CG-CB 4.43Å; L371-A393 HydrophobicContact CD2-CB 4.11Å; L371-N430 HydrophobicContact CD1-CB 4.11Å; L371-W521 HydrophobicContact CD1-CH2 3.65Å; L371-W521 HydrophobicContact CD1-CZ3 4.02Å; L371-W521 HydrophobicContact CD2-CZ3 4.39Å
372	Q	81.6	Confident	71.5	Confident	148 Å²	148	79 Å²	79	69%	0.692	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.2	155.2	173.8	-65.9	-174.7	-13.6	0	0	110	W370 S374 K391 S392	W370-Q372 PolarHBondContact O-N 3.08Å; Q372-S374 PolarHBondContact O-N 2.89Å; Q372-S374 VanDerWaalsContact O-N 3.14Å; Q372-K391 CarbonylContact O-C 3.46Å; Q372-K391 WeakPolarHBondContact O-CA 3.29Å; Q372-K391 WeakPolarHBondContact O-CB 3.16Å; Q372-S392 PolarHBondContact N-O 3.07Å; Q372-S392 PolarHBondContact O-N 2.91Å
373	R	75.3	Confident	68.8	Low	82 Å²	82	78.7 Å²	78.7	31%	0.309	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.7	123	176.4	-169.1	175	-171.4	176.7	15.4	109.2	D29 V375	D29-R373 WeakPolarHBondContact OD2-CD 3.42Å; D29-R373 IonicContact OD2-CZ 2.98Å; D29-R373 VanDerWaalsContact OD2-CZ 3.29Å; D29-R373 IonicContact OD2-NE 3.76Å; D29-R373 PolarHBondContact OD2-NE 3.38Å; D29-R373 VanDerWaalsContact OD2-NE 3.12Å; D29-R373 IonicContact OD2-NH1 3.44Å; D29-R373 IonicContact OD2-NH2 3.82Å; R373-V375 PolarHBondContact O-N 3.45Å
374	S	64	Low	66.4	Low	4 Å²	4	84.7 Å²	84.7	3%	0.028	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-64.8	125.5	-176.6	-64.1	0	0	0	0	109.9	Q372 S390 S392	Q372-S374 PolarHBondContact O-N 2.89Å; Q372-S374 VanDerWaalsContact O-N 3.14Å; S374-S390 WeakPolarHBondContact CB-O 3.44Å; S374-S390 WeakPolarHBondContact CB-OG 3.45Å; S374-S390 PolarHBondContact N-O 2.86Å; S374-S390 PolarHBondContact OG-O 2.7Å; S374-S390 PolarHBondContact OG-OG 2.9Å; S374-S392 WeakPolarHBondContact OG-CB 3.18Å; S374-S392 PolarHBondContact OG-N 3.04Å; S374-S392 PolarHBondContact OG-OG 3.16Å
375	V	60.9	Low	64.3	Low	53 Å²	53	83.1 Å²	83.1	32%	0.321	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-102.6	149.5	172.9	-66.7	0	0	0	0	109.9	R373 Q382 Q384	R373-V375 PolarHBondContact O-N 3.45Å; V375-Q382 HydrophobicContact CB-CB 4.27Å; V375-Q382 HydrophobicContact CG2-CB 4.18Å; V375-Q382 HydrophobicContact CG2-CG 4.25Å; V375-Q384 HydrophobicContact CG1-CG 4.37Å
376	V	51.8	Low	62.2	Low	24 Å²	24	85.2 Å²	85.2	15%	0.145	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	140.2	172	-172.5	0	0	0	0	108.8	S378 V385 Y387 R388 Y437	V376-S378 PolarHBondContact O-N 3.26Å; V376-V385 HydrophobicContact CB-CG2 4.18Å; V376-V385 HydrophobicContact CG2-CG2 4.26Å; V376-Y387 HydrophobicContact CB-CE2 4.03Å; V376-Y387 WeakPolarHBondContact CB-OH 3.41Å; V376-Y387 HydrophobicContact CG1-CE2 4.11Å; V376-Y387 WeakPolarHBondContact CG1-OH 3.46Å; V376-Y387 HydrophobicContact CG2-CE2 3.63Å; V376-R388 HydrophobicContact CG2-CB 4.45Å; V376-Y437 HydrophobicContact CG2-CE2 4.24Å
377	A	45.5	Very low	60.4	Low	57 Å²	57	86 Å²	86	47%	0.471	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	102.8	177.4	0	0	0	0	0	109.3	P450	A377-P450 HydrophobicContact CB-CG 4.11Å
378	S	37.5	Very low	58.7	Low	72 Å²	72	86.6 Å²	86.6	50%	0.503	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	94.8	171.4	-178.4	0	0	0	0	109	V376 E380 K381	V376-S378 PolarHBondContact O-N 3.26Å; S378-E380 PolarHBondContact O-N 3.19Å; S378-K381 PolarHBondContact N-O 2.95Å
379	G	50.4	Low	57.7	Low	52 Å²	52	83.9 Å²	83.9	54%	0.536	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	-127.3	-175.8	0	0	0	0	0	112.6
380	E	32.8	Very low	57.3	Low	180 Å²	180	79.2 Å²	79.2	84%	0.841	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-9.1	-178.2	-65.5	-168.5	152.7	0	0	114.6	S378	S378-E380 PolarHBondContact O-N 3.19Å
381	K	32.9	Very low	57	Low	150 Å²	150	71.1 Å²	71.1	65%	0.652	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.7	-178.4	-68.3	-175.9	179.5	179.4	0	111.5	S378 L383	S378-K381 PolarHBondContact N-O 2.95Å; K381-L383 HydrophobicContact CB-CG 4.21Å; K381-L383 PolarHBondContact O-N 2.77Å
382	Q	43.4	Very low	57.2	Low	148 Å²	148	70.8 Å²	70.8	69%	0.692	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	112.4	161.7	-69.2	-173.6	-12.5	0	0	107.4	V375	V375-Q382 HydrophobicContact CB-CB 4.27Å; V375-Q382 HydrophobicContact CG2-CB 4.18Å; V375-Q382 HydrophobicContact CG2-CG 4.25Å
383	L	40.6	Very low	57.7	Low	87 Å²	87	63.9 Å²	63.9	46%	0.455	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	140.8	176.6	-68.1	172.2	0	0	0	109.1	K381 V385	K381-L383 HydrophobicContact CB-CG 4.21Å; K381-L383 PolarHBondContact O-N 2.77Å; L383-V385 HydrophobicContact CB-CG1 3.96Å; L383-V385 PolarHBondContact O-N 3.3Å
384	Q	47.6	Very low	58.6	Low	127 Å²	127	65.6 Å²	65.6	59%	0.593	34%	0.34	S	S	*	.			trans	-70.3	119.2	161.5	-62.6	-177.7	8.7	0	0	106.2	V375	V375-Q384 HydrophobicContact CG1-CG 4.37Å
385	V	51	Low	60	Low	35 Å²	35	65.5 Å²	65.5	21%	0.212	34%	0.34	C	S	.	.			trans	-129.6	139.9	-171.8	-81.5	0	0	0	0	109.4	V376 L383 Y387 R388	V376-V385 HydrophobicContact CB-CG2 4.18Å; V376-V385 HydrophobicContact CG2-CG2 4.26Å; L383-V385 HydrophobicContact CB-CG1 3.96Å; L383-V385 PolarHBondContact O-N 3.3Å; V385-Y387 HydrophobicContact CB-CD1 3.55Å; V385-Y387 HydrophobicContact CB-CE1 3.43Å; V385-Y387 VanDerWaalsContact CB-CE1 3.43Å; V385-Y387 HydrophobicContact CB-CG 4.41Å; V385-Y387 HydrophobicContact CG1-CD1 4.38Å; V385-Y387 HydrophobicContact CG1-CE1 3.93Å; V385-Y387 HydrophobicContact CG2-CD1 3.66Å; V385-Y387 HydrophobicContact CG2-CD2 4.46Å; V385-Y387 HydrophobicContact CG2-CE1 3.22Å; V385-Y387 HydrophobicContact CG2-CE2 4.12Å; V385-Y387 HydrophobicContact CG2-CG 4.25Å; V385-Y387 VanDerWaalsContact CG2-CZ 3.47Å; V385-Y387 PolarHBondContact O-N 2.97Å; V385-Y387 VanDerWaalsContact O-N 3.1Å; V385-R388 PolarHBondContact O-N 2.83Å
386	E	51	Low	61.6	Low	142 Å²	142	67.6 Å²	67.6	66%	0.664	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-15.4	-170.4	-64.7	-174.7	156	0	0	113.9	R138 R388	R138-E386 IonicContact CZ-OE1 3.57Å; R138-E386 IonicContact NH1-OE1 3.57Å; R138-E386 PolarHBondContact NH1-OE1 3Å; R138-E386 IonicContact NH1-OE2 3.62Å; E386-R388 VanDerWaalsContact C-N 3.35Å; E386-R388 PolarHBondContact O-N 2.82Å
387	Y	57.9	Low	63.5	Low	69 Å²	69	68.3 Å²	68.3	27%	0.271	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-2.1	-177.5	66.5	-105.2	0	0	0	116.5	V376 V385 E438	V376-Y387 HydrophobicContact CB-CE2 4.03Å; V376-Y387 WeakPolarHBondContact CB-OH 3.41Å; V376-Y387 HydrophobicContact CG1-CE2 4.11Å; V376-Y387 WeakPolarHBondContact CG1-OH 3.46Å; V376-Y387 HydrophobicContact CG2-CE2 3.63Å; V385-Y387 HydrophobicContact CB-CD1 3.55Å; V385-Y387 HydrophobicContact CB-CE1 3.43Å; V385-Y387 VanDerWaalsContact CB-CE1 3.43Å; V385-Y387 HydrophobicContact CB-CG 4.41Å; V385-Y387 HydrophobicContact CG1-CD1 4.38Å; V385-Y387 HydrophobicContact CG1-CE1 3.93Å; V385-Y387 HydrophobicContact CG2-CD1 3.66Å; V385-Y387 HydrophobicContact CG2-CD2 4.46Å; V385-Y387 HydrophobicContact CG2-CE1 3.22Å; V385-Y387 HydrophobicContact CG2-CE2 4.12Å; V385-Y387 HydrophobicContact CG2-CG 4.25Å; V385-Y387 VanDerWaalsContact CG2-CZ 3.47Å; V385-Y387 PolarHBondContact O-N 2.97Å; V385-Y387 VanDerWaalsContact O-N 3.1Å; Y387-E438 VanDerWaalsContact CB-OE1 3.27Å; Y387-E438 WeakPolarHBondContact CB-OE1 3.35Å; Y387-E438 WeakPolarHBondContact CB-OE2 3.43Å; Y387-E438 HydrophobicContact CD2-CB 4.26Å; Y387-E438 WeakPolarHBondContact O-CG 3.45Å; Y387-E438 PolarHBondContact O-N 3.09Å
388	R	58.6	Low	65.8	Low	14 Å²	14	71.7 Å²	71.7	5%	0.053	36%	0.363	C	S	.	.	B	Isolated β-bridge	trans	-135.5	116.1	174.2	-173.6	-179.9	-173	179.4	1	110.9	V376 V385 E386 S390 Y437	V376-R388 HydrophobicContact CG2-CB 4.45Å; V385-R388 PolarHBondContact O-N 2.83Å; E386-R388 VanDerWaalsContact C-N 3.35Å; E386-R388 PolarHBondContact O-N 2.82Å; R388-S390 WeakPolarHBondContact CG-OG 3.4Å; R388-S390 PolarHBondContact NE-OG 2.76Å; R388-S390 VanDerWaalsContact NE-OG 3.07Å; R388-Y437 HydrophobicContact CB-CD2 3.7Å; R388-Y437 HydrophobicContact CB-CE2 3.94Å; R388-Y437 HydrophobicContact CG-CD2 3.42Å; R388-Y437 VanDerWaalsContact CG-CD2 3.42Å; R388-Y437 HydrophobicContact CG-CE2 3.77Å; R388-Y437 HydrophobicContact CG-CG 4.27Å
389	I	69.4	Low	68.4	Low	13 Å²	13	71.7 Å²	71.7	7%	0.067	36%	0.359	C	S	.	.			trans	-116.3	86.1	179.1	-60.1	171.4	0	0	0	108.5	F31 G435 H436	F31-I389 HydrophobicContact CD2-CG2 4.26Å; F31-I389 HydrophobicContact CE2-CG2 4.16Å; I389-G435 VanDerWaalsContact O-CA 3.24Å; I389-G435 WeakPolarHBondContact O-CA 3.38Å; I389-H436 PolarHBondContact N-O 2.78Å
390	S	78.1	Confident	70.6	Confident	1 Å²	1	71.1 Å²	71.1	1%	0.007	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	161.3	176.8	57.3	0	0	0	0	110.2	S32 S374 R388 N430	S32-S390 CarbonylContact O-C 3.56Å; S32-S390 WeakPolarHBondContact O-CA 3.5Å; S374-S390 WeakPolarHBondContact CB-O 3.44Å; S374-S390 WeakPolarHBondContact CB-OG 3.45Å; S374-S390 PolarHBondContact N-O 2.86Å; S374-S390 PolarHBondContact OG-O 2.7Å; S374-S390 PolarHBondContact OG-OG 2.9Å; R388-S390 WeakPolarHBondContact CG-OG 3.4Å; R388-S390 PolarHBondContact NE-OG 2.76Å; R388-S390 VanDerWaalsContact NE-OG 3.07Å; S390-N430 CarbonylContact C-O 3.53Å; S390-N430 VanDerWaalsContact CA-O 3.24Å; S390-N430 WeakPolarHBondContact CA-O 3.46Å; S390-N430 VanDerWaalsContact CB-O 3.27Å; S390-N430 WeakPolarHBondContact CB-O 3.04Å
391	K	82.1	Confident	73.6	Confident	13 Å²	13	67.2 Å²	67.2	6%	0.057	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	146.2	161.2	-62.4	-173.4	-174.5	-179.6	0	110	D29 S32 A33 S36 L371 Q372 V429 N430	D29-K391 WeakPolarHBondContact O-CE 3.23Å; D29-K391 PolarHBondContact O-NZ 2.72Å; D29-K391 WeakPolarHBondContact OD1-CE 3.26Å; D29-K391 IonicContact OD1-NZ 3.05Å; S32-K391 WeakPolarHBondContact OG-CE 3.28Å; A33-K391 HydrophobicContact CB-CB 4.18Å; A33-K391 HydrophobicContact CB-CD 3.65Å; A33-K391 HydrophobicContact CB-CG 3.78Å; S36-K391 PolarHBondContact OG-NZ 2.95Å; L371-K391 HydrophobicContact CB-CB 3.93Å; L371-K391 HydrophobicContact CB-CD 4.4Å; L371-K391 HydrophobicContact CD2-CB 4.1Å; L371-K391 HydrophobicContact CG-CB 4.43Å; Q372-K391 CarbonylContact O-C 3.46Å; Q372-K391 WeakPolarHBondContact O-CA 3.29Å; Q372-K391 WeakPolarHBondContact O-CB 3.16Å; K391-V429 CarbonylContact O-C 3.57Å; K391-V429 WeakPolarHBondContact O-CA 3.4Å; K391-N430 PolarHBondContact N-O 3.4Å; K391-N430 PolarHBondContact O-N 3.43Å
392	S	88.7	Confident	76.7	Confident	16 Å²	16	61 Å²	61	11%	0.112	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	153.8	177.5	54	0	0	0	0	112.6	Q372 S374 V428	Q372-S392 PolarHBondContact N-O 3.07Å; Q372-S392 PolarHBondContact O-N 2.91Å; S374-S392 WeakPolarHBondContact OG-CB 3.18Å; S374-S392 PolarHBondContact OG-N 3.04Å; S374-S392 PolarHBondContact OG-OG 3.16Å; S392-V428 CarbonylContact C-O 3.58Å; S392-V428 WeakPolarHBondContact CA-O 3.36Å
393	A	92.3	Very high	79.2	Confident	3 Å²	3	54.1 Å²	54.1	3%	0.025	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	155.3	175.3	0	0	0	0	0	109.3	A367 W370 L371 Q427 V428	A367-A393 HydrophobicContact CB-CB 4.06Å; W370-A393 HydrophobicContact CB-CB 3.93Å; L371-A393 HydrophobicContact CD2-CB 4.11Å; A393-Q427 CarbonylContact O-C 3.58Å; A393-Q427 WeakPolarHBondContact O-CA 3.3Å; A393-V428 PolarHBondContact N-O 3.09Å; A393-V428 PolarHBondContact O-N 3.31Å
394	W	93.1	Very high	81.8	Confident	117 Å²	117	52.5 Å²	52.5	44%	0.443	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	120.4	178.7	-65.6	86.8	0	0	0	110.2	E424 Y425 Q427 W526	W394-E424 WeakPolarHBondContact CH2-OE2 3.36Å; W394-E424 HydrophobicContact CZ3-CB 4.05Å; W394-E424 WeakPolarHBondContact CZ3-OE2 3.43Å; W394-Y425 WeakPolarHBondContact CZ3-O 3.48Å; W394-Q427 HydrophobicContact CD2-CB 4.16Å; W394-Q427 HydrophobicContact CD2-CG 4.38Å; W394-Q427 HydrophobicContact CE3-CB 3.83Å; W394-Q427 HydrophobicContact CH2-CB 4.2Å; W394-Q427 HydrophobicContact CZ2-CB 4.45Å; W394-Q427 HydrophobicContact CZ2-CG 4.38Å; W394-Q427 HydrophobicContact CZ3-CB 3.85Å; W394-W526 AromaticContact CH2-CE3 3.95Å; W394-W526 HydrophobicContact CH2-CE3 3.95Å; W394-W526 AromaticContact CH2-CZ3 3.51Å; W394-W526 HydrophobicContact CH2-CZ3 3.51Å; W394-W526 HydrophobicContact CZ2-CZ3 4.2Å; W394-W526 HydrophobicContact CZ3-CE3 4.29Å; W394-W526 HydrophobicContact CZ3-CZ3 4.17Å
395	L	95	Very high	84.1	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	117.5	180	-58.9	-176.2	0	0	0	110.4	I363 F366 A367 L403 Y425 L426 V428	I363-L395 HydrophobicContact CG2-CD1 4.1Å; F366-L395 HydrophobicContact CB-CD1 3.95Å; F366-L395 HydrophobicContact CB-CD2 4.02Å; A367-L395 HydrophobicContact CB-CD1 4.4Å; L395-L403 HydrophobicContact CB-CD1 3.9Å; L395-Y425 WeakPolarHBondContact O-CB 3.39Å; L395-L426 HydrophobicContact CB-CB 4.42Å; L395-L426 PolarHBondContact N-O 3Å; L395-L426 PolarHBondContact O-N 3.01Å; L395-V428 HydrophobicContact CD1-CG2 3.71Å; L395-V428 HydrophobicContact CG-CG2 4.06Å
396	K	94.3	Very high	86.3	Confident	98 Å²	98	48.1 Å²	48.1	43%	0.426	25%	0.251	S	S	.	.			trans	-80.6	152.2	172.2	-61.4	-175.3	-178.2	176.4	0	110.5	T398 V399 L403 Y425	K396-T398 PolarHBondContact O-N 2.64Å; K396-V399 WeakPolarHBondContact O-CB 3.42Å; K396-V399 VanDerWaalsContact O-CG2 3.27Å; K396-V399 WeakPolarHBondContact O-CG2 3.25Å; K396-V399 PolarHBondContact O-N 3.12Å; K396-L403 WeakPolarHBondContact O-CD1 3.2Å; K396-Y425 HydrophobicContact CB-CD1 4.15Å; K396-Y425 HydrophobicContact CB-CE1 4.15Å; K396-Y425 HydrophobicContact CD-CE2 4.22Å; K396-Y425 HydrophobicContact CG-CD1 3.98Å; K396-Y425 HydrophobicContact CG-CD2 3.96Å; K396-Y425 HydrophobicContact CG-CE1 3.95Å; K396-Y425 HydrophobicContact CG-CE2 3.95Å; K396-Y425 HydrophobicContact CG-CG 3.99Å
397	D	91.3	Very high	88.5	Confident	38 Å²	38	41.7 Å²	41.7	20%	0.203	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.2	176.5	-63.4	11.2	0	0	0	113.4	V399 V404 N407	D397-V399 PolarHBondContact O-N 2.83Å; D397-V404 HydrophobicContact CB-CG2 4.1Å; D397-N407 PolarHBondContact OD1-ND2 3.22Å; D397-N407 PolarHBondContact OD2-ND2 3.23Å
398	T	93.3	Very high	90.3	Very high	129 Å²	129	44 Å²	44	79%	0.791	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-9.2	177.8	57.7	0	0	0	0	114.1	K396	K396-T398 PolarHBondContact O-N 2.64Å
399	V	93	Very high	92.1	Very high	71 Å²	71	45 Å²	45	43%	0.43	24%	0.238	S	C	.	.	S	Bend	trans	-71.1	-45	-178.8	173.1	0	0	0	0	110.9	F366 K396 D397 L403	F366-V399 HydrophobicContact CB-CG1 4.23Å; F366-V399 HydrophobicContact CD1-CG1 4.28Å; F366-V399 HydrophobicContact CD2-CG1 4.22Å; F366-V399 HydrophobicContact CG-CG1 4Å; K396-V399 WeakPolarHBondContact O-CB 3.42Å; K396-V399 VanDerWaalsContact O-CG2 3.27Å; K396-V399 WeakPolarHBondContact O-CG2 3.25Å; K396-V399 PolarHBondContact O-N 3.12Å; D397-V399 PolarHBondContact O-N 2.83Å; V399-L403 HydrophobicContact CB-CD1 3.98Å
400	D	95.8	Very high	93.4	Very high	40 Å²	40	44.3 Å²	44.3	21%	0.214	24%	0.235	C	C	.	.			trans	-157.6	139.7	-179.6	-170.2	-78.2	0	0	0	111.1	F366 M402 L403	F366-D400 HydrophobicContact CD2-CB 4.38Å; F366-D400 HydrophobicContact CE2-CB 3.5Å; F366-D400 VanDerWaalsContact CE2-CB 3.5Å; F366-D400 HydrophobicContact CZ-CB 3.7Å; F366-D400 WeakPolarHBondContact CZ-OD2 3.5Å; D400-M402 PolarHBondContact O-N 2.87Å; D400-M402 VanDerWaalsContact O-N 3.08Å; D400-M402 WeakPolarHBondContact OD1-CB 3.18Å; D400-M402 PolarHBondContact OD1-N 3.25Å; D400-L403 WeakPolarHBondContact O-CB 2.96Å; D400-L403 PolarHBondContact O-N 2.88Å
401	P	96.7	Very high	94.3	Very high	99 Å²	99	45.7 Å²	45.7	64%	0.643	25%	0.246	S	C	*	.	H	α-helix	trans	-56	-23.4	176.7	-26	35	0	0	0	115.2	L403 V404 T405	P401-L403 VanDerWaalsContact C-N 3.26Å; P401-L403 PolarHBondContact O-N 2.95Å; P401-V404 WeakPolarHBondContact O-CB 3.32Å; P401-V404 PolarHBondContact O-N 3.12Å; P401-T405 PolarHBondContact O-N 2.87Å; P401-T405 VanDerWaalsContact O-N 3.1Å; P401-T405 PolarHBondContact O-OG1 3.47Å
402	M	97	Very high	94.9	Very high	20 Å²	20	45.5 Å²	45.5	10%	0.099	25%	0.247	C	C	.	.	H	α-helix	trans	-59.7	-37.1	173.3	179.9	-81.3	-69.4	0	0	111.5	E359 K362 I363 F366 D400 V404 T405 L406	E359-M402 HydrophobicContact CB-SD 4.39Å; E359-M402 HydrophobicContact CG-CG 4.1Å; E359-M402 HydrophobicContact CG-SD 4.29Å; K362-M402 HydrophobicContact CB-CE 4.01Å; I363-M402 HydrophobicContact CD1-CE 4.3Å; I363-M402 HydrophobicContact CD1-SD 4.49Å; I363-M402 HydrophobicContact CG1-CE 3.55Å; I363-M402 HydrophobicContact CG1-SD 4.33Å; F366-M402 HydrophobicContact CE2-CE 4.24Å; D400-M402 PolarHBondContact O-N 2.87Å; D400-M402 VanDerWaalsContact O-N 3.08Å; D400-M402 WeakPolarHBondContact OD1-CB 3.18Å; D400-M402 PolarHBondContact OD1-N 3.25Å; M402-V404 VanDerWaalsContact C-N 3.32Å; M402-V404 PolarHBondContact O-N 2.98Å; M402-T405 WeakPolarHBondContact O-CB 3.31Å; M402-T405 PolarHBondContact O-N 3.19Å; M402-L406 WeakPolarHBondContact O-CB 3.37Å; M402-L406 PolarHBondContact O-N 2.83Å
403	L	96.4	Very high	95.3	Very high	3 Å²	3	45 Å²	45	2%	0.016	24%	0.243	C	C	.	.	H	α-helix	trans	-67.4	-34	178.1	-63.2	177.3	0	0	0	112.2	I363 L395 K396 V399 D400 P401 L406 N407 L426	I363-L403 HydrophobicContact CG1-CD2 4.29Å; L395-L403 HydrophobicContact CB-CD1 3.9Å; K396-L403 WeakPolarHBondContact O-CD1 3.2Å; V399-L403 HydrophobicContact CB-CD1 3.98Å; D400-L403 WeakPolarHBondContact O-CB 2.96Å; D400-L403 PolarHBondContact O-N 2.88Å; P401-L403 VanDerWaalsContact C-N 3.26Å; P401-L403 PolarHBondContact O-N 2.95Å; L403-L406 HydrophobicContact CD2-CD2 4.48Å; L403-L406 WeakPolarHBondContact O-CB 3.45Å; L403-L406 PolarHBondContact O-N 3.14Å; L403-N407 PolarHBondContact O-N 2.86Å; L403-L426 HydrophobicContact CD2-CD2 3.97Å
404	V	96.1	Very high	95.5	Very high	53 Å²	53	45.7 Å²	45.7	32%	0.321	25%	0.247	S	C	.	.	H	α-helix	trans	-64.9	-43.8	172.4	-179.5	0	0	0	0	110.3	D397 P401 M402 L406 N407 H408	D397-V404 HydrophobicContact CB-CG2 4.1Å; P401-V404 WeakPolarHBondContact O-CB 3.32Å; P401-V404 PolarHBondContact O-N 3.12Å; M402-V404 VanDerWaalsContact C-N 3.32Å; M402-V404 PolarHBondContact O-N 2.98Å; V404-L406 VanDerWaalsContact C-N 3.33Å; V404-L406 PolarHBondContact O-N 3.44Å; V404-N407 PolarHBondContact O-N 3.07Å; V404-H408 PolarHBondContact O-N 2.97Å
405	T	95.3	Very high	95.6	Very high	68 Å²	68	41.1 Å²	41.1	42%	0.417	24%	0.237	S	C	.	.	H	α-helix	trans	-62.9	-41	176.9	-55.4	0	0	0	0	111.4	P401 M402 H408 R409	P401-T405 PolarHBondContact O-N 2.87Å; P401-T405 VanDerWaalsContact O-N 3.1Å; P401-T405 PolarHBondContact O-OG1 3.47Å; M402-T405 WeakPolarHBondContact O-CB 3.31Å; M402-T405 PolarHBondContact O-N 3.19Å; T405-H408 PolarHBondContact O-N 3.4Å; T405-R409 PolarHBondContact O-N 2.72Å
406	L	96.9	Very high	95.6	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	24%	0.237	C	C	.	.	H	α-helix	trans	-60	-48.7	173.9	-177.4	66.8	0	0	0	111.1	F354 V355 I363 M402 L403 V404 H408 R409 I410 L426 I465	F354-L406 HydrophobicContact CD1-CD1 4.5Å; F354-L406 HydrophobicContact CE1-CD1 3.68Å; F354-L406 HydrophobicContact CZ-CD1 4.37Å; V355-L406 HydrophobicContact CG1-CD1 3.74Å; I363-L406 HydrophobicContact CD1-CD2 4.01Å; M402-L406 WeakPolarHBondContact O-CB 3.37Å; M402-L406 PolarHBondContact O-N 2.83Å; L403-L406 HydrophobicContact CD2-CD2 4.48Å; L403-L406 WeakPolarHBondContact O-CB 3.45Å; L403-L406 PolarHBondContact O-N 3.14Å; V404-L406 VanDerWaalsContact C-N 3.33Å; V404-L406 PolarHBondContact O-N 3.44Å; L406-H408 VanDerWaalsContact C-N 3.33Å; L406-H408 PolarHBondContact O-N 3.03Å; L406-R409 WeakPolarHBondContact O-CB 3.34Å; L406-R409 PolarHBondContact O-N 2.94Å; L406-R409 VanDerWaalsContact O-N 3.09Å; L406-I410 HydrophobicContact CG-CD1 4.22Å; L406-I410 WeakPolarHBondContact O-CG1 3.21Å; L406-I410 PolarHBondContact O-N 3.08Å; L406-L426 HydrophobicContact CD2-CD2 3.99Å; L406-I465 HydrophobicContact CD1-CD1 4.06Å; L406-I465 HydrophobicContact CD2-CD1 4.18Å
407	N	96.8	Very high	95.7	Very high	7 Å²	7	37.2 Å²	37.2	4%	0.037	22%	0.22	C	C	.	.	H	α-helix	trans	-59.1	-42.4	176.4	-77.8	-24.3	0	0	0	111.7	D397 L403 V404 R409 I410 A411 V418 K525	D397-N407 PolarHBondContact OD1-ND2 3.22Å; D397-N407 PolarHBondContact OD2-ND2 3.23Å; L403-N407 PolarHBondContact O-N 2.86Å; V404-N407 PolarHBondContact O-N 3.07Å; N407-R409 VanDerWaalsContact C-N 3.32Å; N407-R409 PolarHBondContact O-N 3.36Å; N407-I410 PolarHBondContact O-N 3.24Å; N407-A411 WeakPolarHBondContact O-CB 3.4Å; N407-A411 PolarHBondContact O-N 3.16Å; N407-V418 HydrophobicContact CB-CG2 3.91Å; N407-V418 WeakPolarHBondContact O-CG2 3.34Å; N407-K525 VanDerWaalsContact OD1-CE 3.22Å; N407-K525 WeakPolarHBondContact OD1-CE 3.12Å; N407-K525 PolarHBondContact OD1-NZ 3.22Å
408	H	95.6	Very high	95.9	Very high	119 Å²	119	35.5 Å²	35.5	55%	0.551	21%	0.211	S	C	*	.	H	α-helix	trans	-61.5	-39.3	174.4	-70	170.2	0	0	0	112.5	V404 T405 L406 A411 A412	V404-H408 PolarHBondContact O-N 2.97Å; T405-H408 PolarHBondContact O-N 3.4Å; L406-H408 VanDerWaalsContact C-N 3.33Å; L406-H408 PolarHBondContact O-N 3.03Å; H408-A411 PolarHBondContact O-N 2.87Å; H408-A412 WeakPolarHBondContact O-CB 3.37Å; H408-A412 PolarHBondContact O-N 3.41Å
409	R	96.6	Very high	95.8	Very high	33 Å²	33	36.1 Å²	36.1	13%	0.125	20%	0.199	C	C	.	.	H	α-helix	trans	-64	-44.5	175.7	-166	-174.7	-60	156.3	8.7	111.6	I337 F354 E359 T405 L406 N407 A412 L413	I337-R409 HydrophobicContact CD1-CG 4.31Å; F354-R409 HydrophobicContact CE2-CB 4.49Å; F354-R409 HydrophobicContact CE2-CG 3.7Å; F354-R409 HydrophobicContact CZ-CB 4.17Å; F354-R409 HydrophobicContact CZ-CG 3.84Å; F354-R409 PolarHBondContact O-NH1 3.39Å; E359-R409 IonicContact OE1-CZ 3.92Å; E359-R409 IonicContact OE1-NH1 3.92Å; E359-R409 PolarHBondContact OE1-NH1 3.36Å; E359-R409 IonicContact OE1-NH2 2.73Å; E359-R409 PolarHBondContact OE1-NH2 2.78Å; E359-R409 IonicContact OE2-CZ 3.66Å; E359-R409 IonicContact OE2-NH1 3.94Å; E359-R409 PolarHBondContact OE2-NH1 2.97Å; E359-R409 IonicContact OE2-NH2 3.43Å; T405-R409 PolarHBondContact O-N 2.72Å; L406-R409 WeakPolarHBondContact O-CB 3.34Å; L406-R409 PolarHBondContact O-N 2.94Å; L406-R409 VanDerWaalsContact O-N 3.09Å; N407-R409 VanDerWaalsContact C-N 3.32Å; N407-R409 PolarHBondContact O-N 3.36Å; R409-A412 PolarHBondContact O-N 3.16Å; R409-L413 WeakPolarHBondContact O-CB 3.27Å; R409-L413 PolarHBondContact O-N 3.14Å
410	I	97.4	Very high	95.7	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.4	-46.1	175.8	-61.7	170.9	0	0	0	110.2	F354 L406 N407 L413 T414 V418 F463 K525	F354-I410 HydrophobicContact CE1-CG1 3.97Å; F354-I410 HydrophobicContact CZ-CG1 3.62Å; L406-I410 HydrophobicContact CG-CD1 4.22Å; L406-I410 WeakPolarHBondContact O-CG1 3.21Å; L406-I410 PolarHBondContact O-N 3.08Å; N407-I410 PolarHBondContact O-N 3.24Å; I410-L413 PolarHBondContact O-N 3.1Å; I410-T414 HydrophobicContact CG2-CG2 4.18Å; I410-T414 WeakPolarHBondContact O-CB 3.24Å; I410-T414 WeakPolarHBondContact O-CG2 3.49Å; I410-T414 PolarHBondContact O-N 3.36Å; I410-T414 PolarHBondContact O-OG1 2.93Å; I410-V418 HydrophobicContact CG2-CG1 3.96Å; I410-F463 HydrophobicContact CD1-CD1 3.96Å; I410-F463 HydrophobicContact CD1-CE1 4.19Å; I410-F463 HydrophobicContact CG1-CD1 3.96Å; I410-F463 HydrophobicContact CG1-CE1 3.8Å; I410-F463 HydrophobicContact CG1-CZ 4.28Å; I410-F463 HydrophobicContact CG2-CB 4.39Å; I410-F463 HydrophobicContact CG2-CD1 4.19Å; I410-F463 HydrophobicContact CG2-CD2 4.07Å; I410-F463 HydrophobicContact CG2-CE2 4.44Å; I410-F463 HydrophobicContact CG2-CG 3.96Å; I410-K525 HydrophobicContact CD1-CB 4.19Å; I410-K525 HydrophobicContact CD1-CG 4.1Å
411	A	96.4	Very high	95.4	Very high	29 Å²	29	37.6 Å²	37.6	24%	0.24	21%	0.212	C	C	.	.	H	α-helix	trans	-63.3	-43.3	178.6	0	0	0	0	0	112.3	N407 H408 L413 G415 L416 V418	N407-A411 WeakPolarHBondContact O-CB 3.4Å; N407-A411 PolarHBondContact O-N 3.16Å; H408-A411 PolarHBondContact O-N 2.87Å; A411-L413 VanDerWaalsContact C-N 3.33Å; A411-L413 PolarHBondContact O-N 2.9Å; A411-G415 VanDerWaalsContact O-CA 3.31Å; A411-G415 WeakPolarHBondContact O-CA 3.23Å; A411-G415 PolarHBondContact O-N 3.12Å; A411-L416 WeakPolarHBondContact CA-O 3.47Å; A411-L416 WeakPolarHBondContact CB-O 3.34Å; A411-V418 HydrophobicContact CB-CG1 4.48Å; A411-V418 HydrophobicContact CB-CG2 3.94Å
412	A	95.9	Very high	95.3	Very high	10 Å²	10	36.9 Å²	36.9	8%	0.083	20%	0.197	C	C	.	.	H	α-helix	trans	-60.9	-43.4	177.1	0	0	0	0	0	111.6	N327 N329 L332 H408 R409	N327-A412 WeakPolarHBondContact CB-O 3.45Å; N327-A412 PolarHBondContact ND2-O 3.16Å; N329-A412 HydrophobicContact CB-CB 4.4Å; N329-A412 WeakPolarHBondContact ND2-CB 3.25Å; L332-A412 HydrophobicContact CD1-CB 4.1Å; L332-A412 HydrophobicContact CG-CB 4.2Å; H408-A412 WeakPolarHBondContact O-CB 3.37Å; H408-A412 PolarHBondContact O-N 3.41Å; R409-A412 PolarHBondContact O-N 3.16Å
413	L	96.8	Very high	95.2	Very high	4 Å²	4	36.1 Å²	36.1	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-71.6	-46.4	-178.5	177.8	58.7	0	0	0	113.1	E325 N327 L332 I337 Y351 F354 R409 I410 A411 F463	E325-L413 HydrophobicContact CB-CD1 4.13Å; E325-L413 HydrophobicContact CG-CD1 3.59Å; N327-L413 WeakPolarHBondContact CB-O 3.27Å; N327-L413 PolarHBondContact ND2-O 3.45Å; N327-L413 VanDerWaalsContact ND2-O 3.17Å; L332-L413 HydrophobicContact CD1-CB 4.26Å; L332-L413 HydrophobicContact CD1-CD1 4.43Å; I337-L413 HydrophobicContact CB-CD1 4.25Å; I337-L413 HydrophobicContact CD1-CB 4.15Å; I337-L413 HydrophobicContact CD1-CD1 4.02Å; I337-L413 HydrophobicContact CD1-CD2 3.85Å; I337-L413 HydrophobicContact CD1-CG 4.23Å; I337-L413 HydrophobicContact CG2-CD1 4.38Å; I337-L413 HydrophobicContact CG2-CD2 4.31Å; Y351-L413 HydrophobicContact CD1-CD1 4.06Å; Y351-L413 HydrophobicContact CD1-CD2 3.88Å; Y351-L413 HydrophobicContact CD1-CG 4.45Å; Y351-L413 HydrophobicContact CD2-CD2 3.71Å; Y351-L413 HydrophobicContact CE1-CD1 3.71Å; Y351-L413 HydrophobicContact CE1-CD2 4.03Å; Y351-L413 HydrophobicContact CE1-CG 4.16Å; Y351-L413 HydrophobicContact CE2-CD2 3.84Å; Y351-L413 HydrophobicContact CE2-CG 4.32Å; Y351-L413 HydrophobicContact CG-CD2 3.71Å; F354-L413 HydrophobicContact CD2-CD2 3.99Å; F354-L413 HydrophobicContact CE2-CD2 3.69Å; R409-L413 WeakPolarHBondContact O-CB 3.27Å; R409-L413 PolarHBondContact O-N 3.14Å; I410-L413 PolarHBondContact O-N 3.1Å; A411-L413 VanDerWaalsContact C-N 3.33Å; A411-L413 PolarHBondContact O-N 2.9Å; L413-F463 HydrophobicContact CD2-CE2 3.8Å; L413-F463 HydrophobicContact CD2-CZ 3.95Å
414	T	95.6	Very high	95.1	Very high	18 Å²	18	36.6 Å²	36.6	11%	0.11	20%	0.197	C	C	.	.	H	α-helix	trans	-85.6	-21.4	-174.8	59.8	0	0	0	0	113.4	I410 L416 F463 F494	I410-T414 HydrophobicContact CG2-CG2 4.18Å; I410-T414 WeakPolarHBondContact O-CB 3.24Å; I410-T414 WeakPolarHBondContact O-CG2 3.49Å; I410-T414 PolarHBondContact O-N 3.36Å; I410-T414 PolarHBondContact O-OG1 2.93Å; T414-L416 PolarHBondContact O-N 3.48Å; T414-L416 PolarHBondContact OG1-N 3.42Å; T414-F463 HydrophobicContact CG2-CD2 3.77Å; T414-F463 HydrophobicContact CG2-CE2 4.06Å; T414-F494 HydrophobicContact CG2-CD2 4.09Å; T414-F494 HydrophobicContact CG2-CE2 3.89Å
415	G	95.2	Very high	95	Very high	22 Å²	22	38.5 Å²	38.5	23%	0.227	20%	0.198	C	C	.	.			trans	76.2	-0.4	-172.3	0	0	0	0	0	114.2	N327 A411 R535	N327-G415 WeakPolarHBondContact ND2-CA 3.47Å; N327-G415 PolarHBondContact ND2-N 3.14Å; N327-G415 VanDerWaalsContact ND2-N 3.11Å; A411-G415 VanDerWaalsContact O-CA 3.31Å; A411-G415 WeakPolarHBondContact O-CA 3.23Å; A411-G415 PolarHBondContact O-N 3.12Å; G415-R535 WeakPolarHBondContact O-CD 3.17Å; G415-R535 PolarHBondContact O-NH1 3.29Å
416	L	96	Very high	95.1	Very high	4 Å²	4	35.5 Å²	35.5	2%	0.021	18%	0.18	C	C	.	.	S	Bend	trans	-90.8	155.5	-176.7	-58.9	173	0	0	0	112.1	A411 T414 A461 W496 I527 Q532 R536	A411-L416 WeakPolarHBondContact CA-O 3.47Å; A411-L416 WeakPolarHBondContact CB-O 3.34Å; T414-L416 PolarHBondContact O-N 3.48Å; T414-L416 PolarHBondContact OG1-N 3.42Å; L416-A461 HydrophobicContact CD1-CB 4.1Å; L416-W496 HydrophobicContact CD1-CH2 3.72Å; L416-W496 HydrophobicContact CD1-CZ3 3.63Å; L416-W496 HydrophobicContact CD2-CH2 3.96Å; L416-W496 HydrophobicContact CD2-CZ3 4.15Å; L416-W496 HydrophobicContact CG-CH2 4.13Å; L416-W496 HydrophobicContact CG-CZ3 4.4Å; L416-I527 HydrophobicContact CB-CD1 4.28Å; L416-I527 HydrophobicContact CB-CG2 4.11Å; L416-I527 HydrophobicContact CD1-CB 4.42Å; L416-I527 HydrophobicContact CD1-CD1 3.65Å; L416-I527 HydrophobicContact CD1-CG2 4.01Å; L416-Q532 HydrophobicContact CD2-CB 4.34Å; L416-Q532 HydrophobicContact CD2-CG 4.22Å; L416-R536 HydrophobicContact CD2-CB 4.49Å
417	D	95.4	Very high	95.1	Very high	14 Å²	14	35.8 Å²	35.8	8%	0.075	18%	0.181	C	C	.	.			trans	-80.2	117.1	168.4	-161.2	-22.4	0	0	0	109.8	R419 Y422 Q532	D417-R419 WeakPolarHBondContact OD1-CB 3.46Å; D417-R419 WeakPolarHBondContact OD1-CG 3.37Å; D417-R419 IonicContact OD1-CZ 3.5Å; D417-R419 PolarHBondContact OD1-N 2.83Å; D417-R419 VanDerWaalsContact OD1-N 3.08Å; D417-R419 IonicContact OD1-NE 3.91Å; D417-R419 PolarHBondContact OD1-NE 3.17Å; D417-R419 IonicContact OD1-NH2 2.71Å; D417-R419 IonicContact OD2-CZ 3.91Å; D417-R419 IonicContact OD2-NE 2.71Å; D417-R419 PolarHBondContact OD2-NE 2.97Å; D417-R419 IonicContact OD2-NH2 3.24Å; D417-R419 PolarHBondContact OD2-NH2 3.44Å; D417-Y422 HydrophobicContact CB-CD2 4.19Å; D417-Y422 WeakPolarHBondContact OD2-CD2 2.93Å; D417-Q532 PolarHBondContact O-NE2 2.97Å
418	V	95.6	Very high	95	Very high	2 Å²	2	35.5 Å²	35.5	1%	0.012	18%	0.18	C	C	.	.			trans	-111.7	14.3	-177.8	-50.2	0	0	0	0	113.3	N407 I410 A411 A423 K525 I527	N407-V418 HydrophobicContact CB-CG2 3.91Å; N407-V418 WeakPolarHBondContact O-CG2 3.34Å; I410-V418 HydrophobicContact CG2-CG1 3.96Å; A411-V418 HydrophobicContact CB-CG1 4.48Å; A411-V418 HydrophobicContact CB-CG2 3.94Å; V418-A423 HydrophobicContact CB-CB 4.08Å; V418-A423 WeakPolarHBondContact O-CB 3.38Å; V418-K525 WeakPolarHBondContact O-CE 3.44Å; V418-K525 PolarHBondContact O-NZ 2.91Å; V418-K525 VanDerWaalsContact O-NZ 3.13Å; V418-I527 HydrophobicContact CG1-CD1 3.71Å; V418-I527 HydrophobicContact CG1-CG1 3.98Å
419	R	92.4	Very high	94.9	Very high	142 Å²	142	29.8 Å²	29.8	54%	0.536	15%	0.153	S	C	.	.	S	Bend	trans	-83.7	147.2	175.4	-61.3	174	-63.6	164	4	110	D417 Y422 A423	D417-R419 WeakPolarHBondContact OD1-CB 3.46Å; D417-R419 WeakPolarHBondContact OD1-CG 3.37Å; D417-R419 IonicContact OD1-CZ 3.5Å; D417-R419 PolarHBondContact OD1-N 2.83Å; D417-R419 VanDerWaalsContact OD1-N 3.08Å; D417-R419 IonicContact OD1-NE 3.91Å; D417-R419 PolarHBondContact OD1-NE 3.17Å; D417-R419 IonicContact OD1-NH2 2.71Å; D417-R419 IonicContact OD2-CZ 3.91Å; D417-R419 IonicContact OD2-NE 2.71Å; D417-R419 PolarHBondContact OD2-NE 2.97Å; D417-R419 IonicContact OD2-NH2 3.24Å; D417-R419 PolarHBondContact OD2-NH2 3.44Å; R419-Y422 WeakPolarHBondContact O-CA 3.41Å; R419-Y422 WeakPolarHBondContact O-CB 3.32Å; R419-Y422 PolarHBondContact O-N 3.33Å; R419-A423 PolarHBondContact O-N 2.98Å
420	P	89.4	Confident	94.7	Very high	59 Å²	59	28.2 Å²	28.2	38%	0.383	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	139.2	170.5	-24	34.4	0	0	0	111.5	Y425	P420-Y425 HydrophobicContact CG-CE1 3.91Å
421	P	90.4	Very high	94.1	Very high	83 Å²	83	28.7 Å²	28.7	54%	0.539	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	cis	-90.3	7.2	4	37.4	-36.2	0	0	0	114.8	A423 S456	P421-A423 VanDerWaalsContact C-N 3.29Å; P421-A423 PolarHBondContact O-N 3.02Å; P421-S456 VanDerWaalsContact O-CB 3.32Å; P421-S456 WeakPolarHBondContact O-CB 3.39Å
422	Y	93.3	Very high	93.2	Very high	83 Å²	83	27.3 Å²	27.3	33%	0.325	14%	0.138	S	C	.	.	S	Bend	trans	-78.6	-9.9	-173.4	-47	-56.5	0	0	0	114.1	D417 R419 H528 Y530	D417-Y422 HydrophobicContact CB-CD2 4.19Å; D417-Y422 WeakPolarHBondContact OD2-CD2 2.93Å; R419-Y422 WeakPolarHBondContact O-CA 3.41Å; R419-Y422 WeakPolarHBondContact O-CB 3.32Å; R419-Y422 PolarHBondContact O-N 3.33Å; Y422-H528 WeakPolarHBondContact O-CB 3.11Å; Y422-H528 PolarHBondContact O-N 3.08Å; Y422-Y530 WeakPolarHBondContact CD1-O 3.43Å
423	A	94.9	Very high	92.2	Very high	4 Å²	4	29.1 Å²	29.1	3%	0.033	15%	0.146	C	C	.	.	B	Isolated β-bridge	trans	-145.7	156	166.4	0	0	0	0	0	110.7	V418 R419 P421 W526 I527	V418-A423 HydrophobicContact CB-CB 4.08Å; V418-A423 WeakPolarHBondContact O-CB 3.38Å; R419-A423 PolarHBondContact O-N 2.98Å; P421-A423 VanDerWaalsContact C-N 3.29Å; P421-A423 PolarHBondContact O-N 3.02Å; A423-W526 CarbonylContact C-O 3.4Å; A423-W526 VanDerWaalsContact CA-O 3.29Å; A423-W526 WeakPolarHBondContact CA-O 3.18Å; A423-W526 VanDerWaalsContact CB-O 3.3Å; A423-W526 WeakPolarHBondContact CB-O 3.25Å; A423-I527 HydrophobicContact CB-CG1 4.29Å
424	E	94.6	Very high	90.9	Very high	14 Å²	14	29 Å²	29	7%	0.065	15%	0.146	C	C	.	.			trans	-73	163.8	176.6	-56.4	-171	-157.4	0	0	111.4	W394 M454 R459 K525 W526 H528	W394-E424 WeakPolarHBondContact CH2-OE2 3.36Å; W394-E424 HydrophobicContact CZ3-CB 4.05Å; W394-E424 WeakPolarHBondContact CZ3-OE2 3.43Å; E424-M454 HydrophobicContact CG-CE 4.08Å; E424-R459 VanDerWaalsContact CD-NH2 3.27Å; E424-R459 IonicContact OE1-CZ 3.5Å; E424-R459 IonicContact OE1-NE 2.74Å; E424-R459 PolarHBondContact OE1-NE 3.48Å; E424-R459 IonicContact OE1-NH2 3.21Å; E424-R459 PolarHBondContact OE1-NH2 3.12Å; E424-R459 IonicContact OE2-CZ 3.92Å; E424-R459 IonicContact OE2-NH2 2.9Å; E424-R459 PolarHBondContact OE2-NH2 2.9Å; E424-K525 WeakPolarHBondContact O-CD 3.5Å; E424-K525 WeakPolarHBondContact O-CE 3.16Å; E424-K525 PolarHBondContact O-NZ 3.07Å; E424-W526 HydrophobicContact CB-CB 4.4Å; E424-W526 HydrophobicContact CG-CB 4.16Å; E424-W526 PolarHBondContact N-O 3.41Å; E424-W526 VanDerWaalsContact OE2-CE3 3.24Å; E424-H528 VanDerWaalsContact CG-NE2 3.27Å; E424-H528 WeakPolarHBondContact CG-NE2 3.25Å; E424-H528 IonicContact OE1-CE1 3.71Å; E424-H528 IonicContact OE1-NE2 3.29Å
425	Y	95.1	Very high	90.1	Very high	92 Å²	92	28.2 Å²	28.2	36%	0.361	14%	0.141	S	C	.	.			trans	-64.2	157.5	168.8	-64.7	-53.4	0	0	0	110.4	W394 L395 K396 P420 Q427	W394-Y425 WeakPolarHBondContact CZ3-O 3.48Å; L395-Y425 WeakPolarHBondContact O-CB 3.39Å; K396-Y425 HydrophobicContact CB-CD1 4.15Å; K396-Y425 HydrophobicContact CB-CE1 4.15Å; K396-Y425 HydrophobicContact CD-CE2 4.22Å; K396-Y425 HydrophobicContact CG-CD1 3.98Å; K396-Y425 HydrophobicContact CG-CD2 3.96Å; K396-Y425 HydrophobicContact CG-CE1 3.95Å; K396-Y425 HydrophobicContact CG-CE2 3.95Å; K396-Y425 HydrophobicContact CG-CG 3.99Å; P420-Y425 HydrophobicContact CG-CE1 3.91Å; Y425-Q427 PolarHBondContact O-N 2.93Å; Y425-Q427 VanDerWaalsContact O-N 3.09Å
426	L	97	Very high	89.2	Confident	5 Å²	5	27.5 Å²	27.5	3%	0.026	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	114.2	-178.6	-171	72.8	0	0	0	109.2	I363 L395 L403 L406 V428 A523 K525	I363-L426 HydrophobicContact CD1-CD2 4.47Å; I363-L426 HydrophobicContact CG2-CD2 4.07Å; L395-L426 HydrophobicContact CB-CB 4.42Å; L395-L426 PolarHBondContact N-O 3Å; L395-L426 PolarHBondContact O-N 3.01Å; L403-L426 HydrophobicContact CD2-CD2 3.97Å; L406-L426 HydrophobicContact CD2-CD2 3.99Å; L426-V428 HydrophobicContact CD2-CG2 4.35Å; L426-V428 HydrophobicContact CG-CG2 4.44Å; L426-A523 HydrophobicContact CD1-CB 3.79Å; L426-A523 HydrophobicContact CD2-CB 4.1Å; L426-A523 HydrophobicContact CG-CB 3.98Å; L426-K525 HydrophobicContact CD1-CB 4.29Å
427	Q	95.9	Very high	88.2	Confident	8 Å²	8	28.9 Å²	28.9	4%	0.037	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	116.8	174.6	-179.8	-177.3	94.7	0	0	108.9	A393 W394 Y425 V429 A523 N524 W526	A393-Q427 CarbonylContact O-C 3.58Å; A393-Q427 WeakPolarHBondContact O-CA 3.3Å; W394-Q427 HydrophobicContact CD2-CB 4.16Å; W394-Q427 HydrophobicContact CD2-CG 4.38Å; W394-Q427 HydrophobicContact CE3-CB 3.83Å; W394-Q427 HydrophobicContact CH2-CB 4.2Å; W394-Q427 HydrophobicContact CZ2-CB 4.45Å; W394-Q427 HydrophobicContact CZ2-CG 4.38Å; W394-Q427 HydrophobicContact CZ3-CB 3.85Å; Y425-Q427 PolarHBondContact O-N 2.93Å; Y425-Q427 VanDerWaalsContact O-N 3.09Å; Q427-V429 HydrophobicContact CG-CG2 3.95Å; Q427-A523 CarbonylContact O-C 3.59Å; Q427-A523 VanDerWaalsContact O-CA 3.25Å; Q427-A523 WeakPolarHBondContact O-CA 3.38Å; Q427-N524 HydrophobicContact CB-CB 4.35Å; Q427-N524 PolarHBondContact N-O 2.94Å; Q427-N524 PolarHBondContact O-N 3.25Å; Q427-W526 HydrophobicContact CB-CZ3 4.24Å; Q427-W526 VanDerWaalsContact OE1-CH2 3.23Å
428	V	96.4	Very high	87.5	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	133.6	174.9	-175.7	0	0	0	0	109	I363 A367 S392 A393 L395 L426 L467 W521 V522 A523	I363-V428 HydrophobicContact CG2-CG1 4.42Å; I363-V428 HydrophobicContact CG2-CG2 3.56Å; A367-V428 HydrophobicContact CB-CB 3.58Å; A367-V428 HydrophobicContact CB-CG1 3.52Å; A367-V428 HydrophobicContact CB-CG2 3.97Å; S392-V428 CarbonylContact C-O 3.58Å; S392-V428 WeakPolarHBondContact CA-O 3.36Å; A393-V428 PolarHBondContact N-O 3.09Å; A393-V428 PolarHBondContact O-N 3.31Å; L395-V428 HydrophobicContact CD1-CG2 3.71Å; L395-V428 HydrophobicContact CG-CG2 4.06Å; L426-V428 HydrophobicContact CD2-CG2 4.35Å; L426-V428 HydrophobicContact CG-CG2 4.44Å; V428-L467 HydrophobicContact CG1-CD1 3.89Å; V428-W521 HydrophobicContact CG1-CE3 3.7Å; V428-W521 HydrophobicContact CG1-CZ3 3.85Å; V428-V522 CarbonylContact C-O 3.42Å; V428-V522 WeakPolarHBondContact CA-O 3.41Å; V428-A523 HydrophobicContact CG2-CB 4.44Å
429	V	92.8	Very high	87.2	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	134	-175.3	-172.3	0	0	0	0	109.8	K391 Q427 Y431 W521 V522	K391-V429 CarbonylContact O-C 3.57Å; K391-V429 WeakPolarHBondContact O-CA 3.4Å; Q427-V429 HydrophobicContact CG-CG2 3.95Å; V429-Y431 HydrophobicContact CG1-CE2 4.12Å; V429-W521 VanDerWaalsContact O-CA 3.31Å; V429-W521 WeakPolarHBondContact O-CA 3.44Å; V429-V522 HydrophobicContact CB-CG2 3.8Å; V429-V522 HydrophobicContact CG2-CG2 4.24Å; V429-V522 PolarHBondContact N-O 3.24Å; V429-V522 PolarHBondContact O-N 2.71Å
430	N	91.9	Very high	87.1	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	131.1	170.3	-179.2	-129.9	0	0	0	110	A33 L34 T35 L371 S390 K391 D519 K520 W521	A33-N430 VanDerWaalsContact CB-OD1 3.24Å; A33-N430 WeakPolarHBondContact CB-OD1 3.26Å; L34-N430 PolarHBondContact N-OD1 3.15Å; T35-N430 PolarHBondContact N-OD1 3.35Å; T35-N430 PolarHBondContact OG1-OD1 2.99Å; L371-N430 HydrophobicContact CD1-CB 4.11Å; S390-N430 CarbonylContact C-O 3.53Å; S390-N430 VanDerWaalsContact CA-O 3.24Å; S390-N430 WeakPolarHBondContact CA-O 3.46Å; S390-N430 VanDerWaalsContact CB-O 3.27Å; S390-N430 WeakPolarHBondContact CB-O 3.04Å; K391-N430 PolarHBondContact N-O 3.4Å; K391-N430 PolarHBondContact O-N 3.43Å; N430-D519 PolarHBondContact ND2-OD1 3.36Å; N430-K520 PolarHBondContact ND2-O 3.2Å; N430-W521 HydrophobicContact CB-CD2 3.84Å; N430-W521 HydrophobicContact CB-CE3 3.86Å; N430-W521 HydrophobicContact CB-CH2 4.1Å; N430-W521 HydrophobicContact CB-CZ2 4.05Å; N430-W521 HydrophobicContact CB-CZ3 3.97Å; N430-W521 VanDerWaalsContact ND2-CE2 3.29Å; N430-W521 PolarHBondContact ND2-NE1 3.42Å
431	Y	86.1	Confident	87.2	Confident	9 Å²	9	25.8 Å²	25.8	4%	0.035	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	140.3	179.6	-64.9	-94.4	0	0	0	110.9	L34 V429 K520 V522	L34-Y431 PolarHBondContact N-O 2.98Å; V429-Y431 HydrophobicContact CG1-CE2 4.12Å; Y431-K520 HydrophobicContact CD2-CB 3.81Å; Y431-K520 HydrophobicContact CD2-CD 3.67Å; Y431-K520 HydrophobicContact CD2-CG 3.64Å; Y431-K520 WeakPolarHBondContact CD2-O 3.45Å; Y431-K520 HydrophobicContact CE2-CD 3.79Å; Y431-K520 HydrophobicContact CE2-CG 4Å; Y431-K520 HydrophobicContact CG-CB 4.34Å; Y431-K520 HydrophobicContact CG-CD 4.26Å; Y431-K520 HydrophobicContact CG-CG 4.48Å; Y431-K520 PolarHBondContact N-O 3.47Å; Y431-K520 VanDerWaalsContact N-O 3.09Å; Y431-V522 HydrophobicContact CE2-CG1 4.33Å; Y431-V522 HydrophobicContact CE2-CG2 3.85Å
432	G	75.8	Confident	87.4	Confident	1 Å²	1	22.1 Å²	22.1	1%	0.01	10%	0.1	C	C	.	.			trans	-85	-163.7	177.7	0	0	0	0	0	114.4	F31 S32 G434 G435	F31-G432 VanDerWaalsContact O-CA 3.26Å; F31-G432 WeakPolarHBondContact O-CA 3.42Å; S32-G432 VanDerWaalsContact O-CA 3.31Å; S32-G432 WeakPolarHBondContact O-CA 3.46Å; S32-G432 PolarHBondContact O-N 2.86Å; G432-G434 PolarHBondContact O-N 2.86Å; G432-G435 WeakPolarHBondContact O-CA 3.47Å; G432-G435 PolarHBondContact O-N 3.17Å
433	I	75.2	Confident	87.4	Confident	48 Å²	48	18.9 Å²	18.9	25%	0.246	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	122.4	173.4	-55.8	174.4	0	0	0	108.3	F31 L34 V37 A136 A139 G435	F31-I433 PolarHBondContact O-N 3.46Å; L34-I433 HydrophobicContact CD2-CG1 3.82Å; V37-I433 HydrophobicContact CG2-CD1 4.06Å; V37-I433 HydrophobicContact CG2-CG1 4.22Å; A136-I433 HydrophobicContact CB-CD1 4.35Å; A139-I433 HydrophobicContact CB-CB 4.16Å; A139-I433 HydrophobicContact CB-CG2 3.77Å; A139-I433 WeakPolarHBondContact CB-O 3.45Å; I433-G435 PolarHBondContact O-N 2.93Å
434	G	70.9	Confident	87.2	Confident	2 Å²	2	19.2 Å²	19.2	2%	0.021	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	27.9	-172.3	0	0	0	0	0	112.8	R142 G432 H436	R142-G434 PolarHBondContact NE-O 3.34Å; G432-G434 PolarHBondContact O-N 2.86Å; G434-H436 PolarHBondContact O-N 2.75Å; G434-H436 PolarHBondContact O-ND1 2.84Å
435	G	77.5	Confident	86.8	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.119	C	C	.	.			trans	-64.1	130.1	-178.6	0	0	0	0	0	109.7	I389 G432 I433 P514 V515	I389-G435 VanDerWaalsContact O-CA 3.24Å; I389-G435 WeakPolarHBondContact O-CA 3.38Å; G432-G435 WeakPolarHBondContact O-CA 3.47Å; G432-G435 PolarHBondContact O-N 3.17Å; I433-G435 PolarHBondContact O-N 2.93Å; G435-P514 WeakPolarHBondContact O-CA 3.39Å; G435-V515 PolarHBondContact O-N 2.75Å
436	H	76.1	Confident	86.4	Confident	8 Å²	8	21.3 Å²	21.3	4%	0.037	12%	0.116	C	C	.	.			trans	-146.3	172.9	-174.4	70.6	-74.1	0	0	0	109.2	R142 I389 G434 G512 P514	R142-H436 WeakPolarHBondContact CD-CE1 3.47Å; R142-H436 WeakPolarHBondContact CD-ND1 3.35Å; R142-H436 PolarHBondContact NE-CE1 3.25Å; R142-H436 PolarHBondContact NE-ND1 3.15Å; R142-H436 VanDerWaalsContact NE-ND1 3.16Å; I389-H436 PolarHBondContact N-O 2.78Å; G434-H436 PolarHBondContact O-N 2.75Å; G434-H436 PolarHBondContact O-ND1 2.84Å; H436-G512 WeakPolarHBondContact CA-O 3.32Å; H436-G512 VanDerWaalsContact CB-O 3.26Å; H436-G512 WeakPolarHBondContact CB-O 3.5Å; H436-P514 HydrophobicContact CB-CB 4.19Å; H436-P514 HydrophobicContact CB-CG 3.97Å
437	Y	75.8	Confident	85.7	Confident	32 Å²	32	27 Å²	27	13%	0.125	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	119.8	166.5	-166.1	-154.3	0	0	0	108.3	V376 R388 H440 A511 G512	V376-Y437 HydrophobicContact CG2-CE2 4.24Å; R388-Y437 HydrophobicContact CB-CD2 3.7Å; R388-Y437 HydrophobicContact CB-CE2 3.94Å; R388-Y437 HydrophobicContact CG-CD2 3.42Å; R388-Y437 VanDerWaalsContact CG-CD2 3.42Å; R388-Y437 HydrophobicContact CG-CE2 3.77Å; R388-Y437 HydrophobicContact CG-CG 4.27Å; Y437-H440 AromaticContact CD1-CE1 3Å; Y437-H440 WeakPolarHBondContact CD1-CE1 3.39Å; Y437-H440 AromaticContact CD1-ND1 3.36Å; Y437-H440 WeakPolarHBondContact CD1-ND1 3.35Å; Y437-H440 AromaticContact CD1-NE2 3.48Å; Y437-H440 WeakPolarHBondContact CD1-NE2 3.34Å; Y437-H440 AromaticContact CE1-CD2 3.4Å; Y437-H440 VanDerWaalsContact CE1-CD2 3.4Å; Y437-H440 WeakPolarHBondContact CE1-CD2 3.36Å; Y437-H440 AromaticContact CE1-CE1 3.06Å; Y437-H440 WeakPolarHBondContact CE1-CE1 3.49Å; Y437-H440 AromaticContact CE1-CG 3.56Å; Y437-H440 AromaticContact CE1-ND1 3.32Å; Y437-H440 VanDerWaalsContact CE1-ND1 3.32Å; Y437-H440 WeakPolarHBondContact CE1-ND1 3.49Å; Y437-H440 AromaticContact CE1-NE2 3.04Å; Y437-H440 WeakPolarHBondContact CE1-NE2 3.16Å; Y437-H440 AromaticContact CG-CE1 3.96Å; Y437-H440 AromaticContact CG-ND1 3.96Å; Y437-H440 AromaticContact CZ-CD2 3.87Å; Y437-H440 AromaticContact CZ-CG 3.8Å; Y437-H440 AromaticContact CZ-ND1 3.85Å; Y437-H440 AromaticContact CZ-NE2 3.98Å; Y437-A511 WeakPolarHBondContact O-CA 3.15Å; Y437-A511 VanDerWaalsContact O-CB 3.32Å; Y437-A511 WeakPolarHBondContact O-CB 3.45Å; Y437-G512 PolarHBondContact N-O 3.34Å; Y437-G512 PolarHBondContact O-N 2.96Å
438	E	80.7	Confident	85.2	Confident	40 Å²	40	31 Å²	31	19%	0.187	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	160.8	179.9	-83.3	-169.7	-165.9	0	0	112.9	L295 Y387 H440	L295-E438 HydrophobicContact CD1-CB 4.36Å; L295-E438 HydrophobicContact CD1-CG 3.69Å; L295-E438 VanDerWaalsContact CD1-OE2 3.3Å; L295-E438 WeakPolarHBondContact CD1-OE2 3.31Å; Y387-E438 VanDerWaalsContact CB-OE1 3.27Å; Y387-E438 WeakPolarHBondContact CB-OE1 3.35Å; Y387-E438 WeakPolarHBondContact CB-OE2 3.43Å; Y387-E438 HydrophobicContact CD2-CB 4.26Å; Y387-E438 WeakPolarHBondContact O-CG 3.45Å; Y387-E438 PolarHBondContact O-N 3.09Å; E438-H440 PolarHBondContact O-N 2.86Å; E438-H440 PolarHBondContact O-ND1 2.82Å
439	P	88.3	Confident	84.5	Confident	29 Å²	29	32 Å²	32	19%	0.188	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-47.5	121.8	176	-30.9	38.3	0	0	0	113.2	L295 Y301 I479 L509 H510 A511	L295-P439 HydrophobicContact CD2-CG 3.83Å; L295-P439 HydrophobicContact CG-CG 4.29Å; Y301-P439 HydrophobicContact CG-CG 4.49Å; P439-I479 HydrophobicContact CB-CD1 3.37Å; P439-I479 HydrophobicContact CG-CD1 3.34Å; P439-L509 HydrophobicContact CB-CD1 4.23Å; P439-L509 HydrophobicContact CB-CD2 4.43Å; P439-L509 HydrophobicContact CB-CG 4.33Å; P439-H510 WeakPolarHBondContact CA-O 3.46Å; P439-A511 HydrophobicContact CG-CB 4.25Å
440	H	90.3	Very high	83.9	Confident	27 Å²	27	34 Å²	34	13%	0.125	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	165.1	-180	66.7	-69	0	0	0	111.6	Y437 E438 D442 H510	Y437-H440 AromaticContact CD1-CE1 3Å; Y437-H440 WeakPolarHBondContact CD1-CE1 3.39Å; Y437-H440 AromaticContact CD1-ND1 3.36Å; Y437-H440 WeakPolarHBondContact CD1-ND1 3.35Å; Y437-H440 AromaticContact CD1-NE2 3.48Å; Y437-H440 WeakPolarHBondContact CD1-NE2 3.34Å; Y437-H440 AromaticContact CE1-CD2 3.4Å; Y437-H440 VanDerWaalsContact CE1-CD2 3.4Å; Y437-H440 WeakPolarHBondContact CE1-CD2 3.36Å; Y437-H440 AromaticContact CE1-CE1 3.06Å; Y437-H440 WeakPolarHBondContact CE1-CE1 3.49Å; Y437-H440 AromaticContact CE1-CG 3.56Å; Y437-H440 AromaticContact CE1-ND1 3.32Å; Y437-H440 VanDerWaalsContact CE1-ND1 3.32Å; Y437-H440 WeakPolarHBondContact CE1-ND1 3.49Å; Y437-H440 AromaticContact CE1-NE2 3.04Å; Y437-H440 WeakPolarHBondContact CE1-NE2 3.16Å; Y437-H440 AromaticContact CG-CE1 3.96Å; Y437-H440 AromaticContact CG-ND1 3.96Å; Y437-H440 AromaticContact CZ-CD2 3.87Å; Y437-H440 AromaticContact CZ-CG 3.8Å; Y437-H440 AromaticContact CZ-ND1 3.85Å; Y437-H440 AromaticContact CZ-NE2 3.98Å; E438-H440 PolarHBondContact O-N 2.86Å; E438-H440 PolarHBondContact O-ND1 2.82Å; H440-D442 IonicContact CD2-OD1 2.95Å; H440-D442 IonicContact NE2-OD1 3.11Å; H440-H510 AromaticContact CE1-CD2 3.72Å; H440-H510 AromaticContact CE1-CE1 3.87Å; H440-H510 AromaticContact CE1-NE2 3.42Å; H440-H510 PolarHBondContact CE1-NE2 2.83Å; H440-H510 PolarHBondContact CE1-O 3.24Å; H440-H510 PolarHBondContact N-O 3.44Å; H440-H510 PolarHBondContact ND1-O 3.39Å; H440-H510 VanDerWaalsContact ND1-O 3.12Å; H440-H510 AromaticContact NE2-CD2 3.97Å; H440-H510 AromaticContact NE2-CE1 3.43Å; H440-H510 PolarHBondContact NE2-CE1 2.97Å; H440-H510 AromaticContact NE2-NE2 3.19Å; H440-H510 PolarHBondContact NE2-NE2 2.69Å; H440-H510 VanDerWaalsContact NE2-NE2 3.19Å; H440-H510 PolarHBondContact O-N 2.77Å; H440-H510 PolarHBondContact O-ND1 2.95Å
441	F	92.5	Very high	83.5	Confident	57 Å²	57	35 Å²	35	25%	0.25	21%	0.207	C	C	.	.			trans	-101.9	143.1	167.6	-65.9	-72.6	0	0	0	109.7	H443 T445 S506 L509	F441-H443 AromaticContact CD1-CE1 3.24Å; F441-H443 WeakPolarHBondContact CD1-CE1 3.43Å; F441-H443 AromaticContact CD1-ND1 3.98Å; F441-H443 AromaticContact CD1-NE2 3.78Å; F441-H443 AromaticContact CE1-CE1 3.86Å; F441-H443 AromaticContact CG-CE1 3.69Å; F441-H443 AromaticContact CG-NE2 3.82Å; F441-T445 HydrophobicContact CB-CG2 3.98Å; F441-T445 HydrophobicContact CD2-CG2 3.44Å; F441-T445 VanDerWaalsContact CD2-CG2 3.44Å; F441-T445 HydrophobicContact CE2-CG2 4.14Å; F441-T445 HydrophobicContact CG-CG2 3.9Å; F441-S506 VanDerWaalsContact CE1-O 3.24Å; F441-S506 WeakPolarHBondContact CE1-O 3.47Å; F441-L509 HydrophobicContact CD1-CB 4.29Å; F441-L509 HydrophobicContact CD1-CD1 4.41Å; F441-L509 HydrophobicContact CD2-CD1 3.93Å; F441-L509 HydrophobicContact CE1-CB 3.57Å; F441-L509 HydrophobicContact CE1-CD1 4.15Å; F441-L509 HydrophobicContact CE1-CG 4.46Å; F441-L509 HydrophobicContact CE2-CB 4.44Å; F441-L509 HydrophobicContact CE2-CD1 3.65Å; F441-L509 HydrophobicContact CG-CD1 4.34Å; F441-L509 HydrophobicContact CZ-CB 3.67Å; F441-L509 HydrophobicContact CZ-CD1 3.77Å; F441-L509 HydrophobicContact CZ-CG 4.23Å
442	D	93.8	Very high	83.3	Confident	5 Å²	5	39.1 Å²	39.1	3%	0.027	22%	0.224	C	C	.	.	S	Bend	trans	-79.6	-28.6	168.8	-88.5	-24.2	0	0	0	111.9	H440 R459 T462 H510 W526	H440-D442 IonicContact CD2-OD1 2.95Å; H440-D442 IonicContact NE2-OD1 3.11Å; D442-R459 WeakPolarHBondContact O-CD 3.48Å; D442-R459 PolarHBondContact O-NH1 3.38Å; D442-R459 IonicContact OD1-NH1 3.55Å; D442-T462 WeakPolarHBondContact OD2-CB 3.06Å; D442-T462 VanDerWaalsContact OD2-CG2 3.32Å; D442-T462 WeakPolarHBondContact OD2-CG2 3.36Å; D442-T462 PolarHBondContact OD2-OG1 3.22Å; D442-H510 IonicContact OD2-CE1 3.19Å; D442-H510 IonicContact OD2-NE2 3.61Å; D442-W526 PolarHBondContact OD1-NE1 3.21Å; D442-W526 VanDerWaalsContact OD1-NE1 3.13Å; D442-W526 PolarHBondContact OD2-NE1 3.04Å
443	H	93.5	Very high	83.5	Confident	15 Å²	15	46.9 Å²	46.9	7%	0.069	25%	0.252	C	S	.	.	S	Bend	trans	-78.9	157.5	173.9	65.1	-101.6	0	0	0	112.2	F441 T445 N458 N497 L498 D505	F441-H443 AromaticContact CD1-CE1 3.24Å; F441-H443 WeakPolarHBondContact CD1-CE1 3.43Å; F441-H443 AromaticContact CD1-ND1 3.98Å; F441-H443 AromaticContact CD1-NE2 3.78Å; F441-H443 AromaticContact CE1-CE1 3.86Å; F441-H443 AromaticContact CG-CE1 3.69Å; F441-H443 AromaticContact CG-NE2 3.82Å; H443-T445 PolarHBondContact O-N 2.8Å; H443-N458 WeakPolarHBondContact CA-OD1 3.32Å; H443-N458 WeakPolarHBondContact CB-OD1 3.43Å; H443-N497 HydrophobicContact CB-CB 4.07Å; H443-N497 PolarHBondContact ND1-O 2.87Å; H443-L498 HydrophobicContact CB-CD2 3.62Å; H443-D505 PolarHBondContact CE1-O 2.82Å
444	A	90.5	Very high	83.6	Confident	11 Å²	11	49.2 Å²	49.2	9%	0.091	26%	0.263	C	S	.	.			trans	-68.9	121.9	172.3	0	0	0	0	0	111.3	S449 L451 Y452 N458	A444-S449 VanDerWaalsContact CB-CB 3.49Å; A444-L451 HydrophobicContact CB-CB 4.42Å; A444-L451 HydrophobicContact CB-CD1 4.03Å; A444-Y452 HydrophobicContact CB-CD2 4.26Å; A444-Y452 HydrophobicContact CB-CE2 3.5Å; A444-Y452 VanDerWaalsContact CB-CE2 3.5Å; A444-N458 PolarHBondContact N-ND2 3.33Å; A444-N458 PolarHBondContact N-OD1 2.99Å; A444-N458 PolarHBondContact O-ND2 3.14Å
445	T	87.4	Confident	84.1	Confident	107 Å²	107	57.6 Å²	57.6	66%	0.656	30%	0.299	S	S	*	.	S	Bend	trans	-94.5	-2.6	175.8	55.3	0	0	0	0	114	F441 H443	F441-T445 HydrophobicContact CB-CG2 3.98Å; F441-T445 HydrophobicContact CD2-CG2 3.44Å; F441-T445 VanDerWaalsContact CD2-CG2 3.44Å; F441-T445 HydrophobicContact CE2-CG2 4.14Å; F441-T445 HydrophobicContact CG-CG2 3.9Å; H443-T445 PolarHBondContact O-N 2.8Å
446	S	86.8	Confident	84.5	Confident	44 Å²	44	57.8 Å²	57.8	31%	0.308	30%	0.301	S	S	.	.	S	Bend	trans	-137.9	140.9	179.5	171.1	0	0	0	0	110.9	S448 S449 Y452	S446-S448 PolarHBondContact O-N 2.84Å; S446-S448 VanDerWaalsContact O-N 3.13Å; S446-S448 PolarHBondContact OG-N 3.01Å; S446-S448 PolarHBondContact OG-OG 2.93Å; S446-S449 WeakPolarHBondContact O-CB 3.37Å; S446-S449 PolarHBondContact O-N 3.24Å; S446-Y452 WeakPolarHBondContact O-CE2 3.13Å
447	P	82.5	Confident	85.2	Confident	123 Å²	123	57.5 Å²	57.5	80%	0.799	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.5	173.4	-23.9	33.8	0	0	0	114.1	S449	P447-S449 VanDerWaalsContact C-N 3.26Å; P447-S449 PolarHBondContact O-N 3.28Å
448	S	83.8	Confident	86	Confident	92 Å²	92	56.2 Å²	56.2	64%	0.643	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	2.5	177	62.7	0	0	0	0	113.9	S446	S446-S448 PolarHBondContact O-N 2.84Å; S446-S448 VanDerWaalsContact O-N 3.13Å; S446-S448 PolarHBondContact OG-N 3.01Å; S446-S448 PolarHBondContact OG-OG 2.93Å
449	S	83.4	Confident	86.7	Confident	22 Å²	22	55.7 Å²	55.7	15%	0.154	29%	0.291	C	S	.	.			trans	-55.3	135	-179.5	177.6	0	0	0	0	111.6	A444 S446 P447 L451 Y452	A444-S449 VanDerWaalsContact CB-CB 3.49Å; S446-S449 WeakPolarHBondContact O-CB 3.37Å; S446-S449 PolarHBondContact O-N 3.24Å; P447-S449 VanDerWaalsContact C-N 3.26Å; P447-S449 PolarHBondContact O-N 3.28Å; S449-L451 PolarHBondContact O-N 2.82Å; S449-L451 VanDerWaalsContact O-N 3.09Å; S449-L451 PolarHBondContact OG-N 3.19Å; S449-Y452 PolarHBondContact O-N 3.1Å
450	P	80.2	Confident	87.1	Confident	41 Å²	41	54.5 Å²	54.5	27%	0.266	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-56.6	-23.6	174	-26.2	35.7	0	0	0	113.9	A377 Y452 R453	A377-P450 HydrophobicContact CB-CG 4.11Å; P450-Y452 PolarHBondContact O-N 3.47Å; P450-R453 VanDerWaalsContact O-CB 3.25Å; P450-R453 WeakPolarHBondContact O-CB 3.45Å; P450-R453 PolarHBondContact O-N 2.95Å
451	L	81.9	Confident	87.4	Confident	22 Å²	22	53.2 Å²	53.2	12%	0.115	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-55.6	-40.4	177	-73	174.1	0	0	0	111.8	A444 S449 R453 M454 R459	A444-L451 HydrophobicContact CB-CB 4.42Å; A444-L451 HydrophobicContact CB-CD1 4.03Å; S449-L451 PolarHBondContact O-N 2.82Å; S449-L451 VanDerWaalsContact O-N 3.09Å; S449-L451 PolarHBondContact OG-N 3.19Å; L451-R453 PolarHBondContact O-N 3.42Å; L451-R453 VanDerWaalsContact O-N 3.13Å; L451-M454 HydrophobicContact CD2-SD 4.21Å; L451-M454 WeakPolarHBondContact O-CB 3.42Å; L451-M454 WeakPolarHBondContact O-CG 3.46Å; L451-M454 PolarHBondContact O-N 3.43Å; L451-R459 HydrophobicContact CD1-CG 4.48Å
452	Y	82.4	Confident	87.7	Confident	96 Å²	96	50.5 Å²	50.5	38%	0.376	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-66.6	-16.9	179.3	-65.9	-63	0	0	0	113.4	A444 S446 S449 P450 M454 K455 N458	A444-Y452 HydrophobicContact CB-CD2 4.26Å; A444-Y452 HydrophobicContact CB-CE2 3.5Å; A444-Y452 VanDerWaalsContact CB-CE2 3.5Å; S446-Y452 WeakPolarHBondContact O-CE2 3.13Å; S449-Y452 PolarHBondContact O-N 3.1Å; P450-Y452 PolarHBondContact O-N 3.47Å; Y452-M454 PolarHBondContact O-N 3.41Å; Y452-K455 PolarHBondContact O-N 3.23Å; Y452-N458 HydrophobicContact CE1-CB 4.12Å; Y452-N458 PolarHBondContact OH-ND2 2.86Å
453	R	80.6	Confident	87.9	Confident	163 Å²	163	50.3 Å²	50.3	62%	0.615	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-70.9	-19.4	174.2	-57.4	178.8	-174.3	167.3	0.3	112.7	P450 L451 K455	P450-R453 VanDerWaalsContact O-CB 3.25Å; P450-R453 WeakPolarHBondContact O-CB 3.45Å; P450-R453 PolarHBondContact O-N 2.95Å; L451-R453 PolarHBondContact O-N 3.42Å; L451-R453 VanDerWaalsContact O-N 3.13Å; R453-K455 PolarHBondContact O-N 3.26Å
454	M	77.3	Confident	88.2	Confident	97 Å²	97	50 Å²	50	48%	0.478	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-72.4	-14.8	179.4	-61.2	179.1	62.9	0	0	112.8	E424 L451 Y452 S456	E424-M454 HydrophobicContact CG-CE 4.08Å; L451-M454 HydrophobicContact CD2-SD 4.21Å; L451-M454 WeakPolarHBondContact O-CB 3.42Å; L451-M454 WeakPolarHBondContact O-CG 3.46Å; L451-M454 PolarHBondContact O-N 3.43Å; Y452-M454 PolarHBondContact O-N 3.41Å; M454-S456 WeakPolarHBondContact CB-OG 3.39Å; M454-S456 PolarHBondContact O-N 3Å; M454-S456 VanDerWaalsContact O-N 3.14Å
455	K	81.7	Confident	88.5	Confident	179 Å²	179	49.5 Å²	49.5	78%	0.778	26%	0.259	S	S	*	.	S	Bend	trans	56.2	22.1	-177	-57	-178.6	178.4	-177	0	114	Y452 R453 Y530	Y452-K455 PolarHBondContact O-N 3.23Å; R453-K455 PolarHBondContact O-N 3.26Å; K455-Y530 VanDerWaalsContact O-CD2 3.28Å; K455-Y530 WeakPolarHBondContact O-CD2 3.43Å; K455-Y530 WeakPolarHBondContact O-CE2 3.5Å
456	S	85.8	Confident	89.1	Confident	4 Å²	4	44.4 Å²	44.4	3%	0.028	23%	0.228	C	C	.	.	S	Bend	trans	-103.7	-0.8	172.3	47.6	0	0	0	0	112.4	P421 M454 H528 Y530	P421-S456 VanDerWaalsContact O-CB 3.32Å; P421-S456 WeakPolarHBondContact O-CB 3.39Å; M454-S456 WeakPolarHBondContact CB-OG 3.39Å; M454-S456 PolarHBondContact O-N 3Å; M454-S456 VanDerWaalsContact O-N 3.14Å; S456-H528 VanDerWaalsContact O-CB 3.25Å; S456-H528 WeakPolarHBondContact O-CB 3.38Å; S456-H528 PolarHBondContact OG-CE1 3.09Å; S456-H528 VanDerWaalsContact OG-CE1 3.24Å; S456-H528 PolarHBondContact OG-ND1 3.17Å; S456-H528 PolarHBondContact OG-NE2 2.99Å; S456-Y530 VanDerWaalsContact O-CB 3.25Å; S456-Y530 WeakPolarHBondContact O-CB 3.35Å; S456-Y530 VanDerWaalsContact O-CG 3.23Å; S456-Y530 PolarHBondContact O-N 3.38Å
457	G	89.4	Confident	89.6	Confident	2 Å²	2	42.3 Å²	42.3	2%	0.021	21%	0.213	C	C	.	.			trans	79.4	-171.3	-174.1	0	0	0	0	0	112.9	H528 E529	G457-H528 PolarHBondContact O-ND1 3.31Å; G457-H528 VanDerWaalsContact O-ND1 3.07Å; G457-E529 WeakPolarHBondContact CA-OE1 3.25Å
458	N	92.8	Very high	90.2	Very high	4 Å²	4	36.7 Å²	36.7	2%	0.021	18%	0.177	C	C	.	.	S	Bend	trans	-73.6	162.8	179	-155.9	-9.9	0	0	0	111.8	H443 A444 Y452 V460 L498 H528 E529	H443-N458 WeakPolarHBondContact CA-OD1 3.32Å; H443-N458 WeakPolarHBondContact CB-OD1 3.43Å; A444-N458 PolarHBondContact N-ND2 3.33Å; A444-N458 PolarHBondContact N-OD1 2.99Å; A444-N458 PolarHBondContact O-ND2 3.14Å; Y452-N458 HydrophobicContact CE1-CB 4.12Å; Y452-N458 PolarHBondContact OH-ND2 2.86Å; N458-V460 PolarHBondContact O-N 3.05Å; N458-L498 HydrophobicContact CB-CD1 4.04Å; N458-H528 CarbonylContact O-C 3.47Å; N458-H528 VanDerWaalsContact O-CA 3.3Å; N458-H528 WeakPolarHBondContact O-CA 3.32Å; N458-E529 PolarHBondContact N-OE1 2.71Å; N458-E529 PolarHBondContact O-N 3.29Å
459	R	95.4	Very high	90.5	Very high	29 Å²	29	35.1 Å²	35.1	11%	0.109	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	111.2	176.9	-70.4	163.7	170.6	-174.5	-1.8	108.8	E424 D442 L451 N497 L498 W526 I527	E424-R459 VanDerWaalsContact CD-NH2 3.27Å; E424-R459 IonicContact OE1-CZ 3.5Å; E424-R459 IonicContact OE1-NE 2.74Å; E424-R459 PolarHBondContact OE1-NE 3.48Å; E424-R459 IonicContact OE1-NH2 3.21Å; E424-R459 PolarHBondContact OE1-NH2 3.12Å; E424-R459 IonicContact OE2-CZ 3.92Å; E424-R459 IonicContact OE2-NH2 2.9Å; E424-R459 PolarHBondContact OE2-NH2 2.9Å; D442-R459 WeakPolarHBondContact O-CD 3.48Å; D442-R459 PolarHBondContact O-NH1 3.38Å; D442-R459 IonicContact OD1-NH1 3.55Å; L451-R459 HydrophobicContact CD1-CG 4.48Å; R459-N497 VanDerWaalsContact O-CB 3.27Å; R459-N497 WeakPolarHBondContact O-CB 3.24Å; R459-L498 WeakPolarHBondContact O-CG 3.04Å; R459-W526 HydrophobicContact CG-CB 4.04Å; R459-W526 HydrophobicContact CG-CG 4.48Å; R459-W526 VanDerWaalsContact CZ-CE3 3.44Å; R459-I527 CarbonylContact C-O 3.46Å; R459-I527 VanDerWaalsContact CA-O 3.31Å; R459-I527 WeakPolarHBondContact CA-O 3.14Å
460	V	96.3	Very high	90.9	Very high	5 Å²	5	35 Å²	35	3%	0.03	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-31.4	-176.8	72.6	0	0	0	0	112.8	N458 W496 N497 L498 I527 E529 Q532	N458-V460 PolarHBondContact O-N 3.05Å; V460-W496 HydrophobicContact CG2-CE3 4.35Å; V460-W496 HydrophobicContact CG2-CZ3 4.42Å; V460-N497 PolarHBondContact O-N 3.46Å; V460-L498 HydrophobicContact CB-CD1 4.2Å; V460-L498 HydrophobicContact CG2-CB 4.5Å; V460-L498 HydrophobicContact CG2-CD1 4.29Å; V460-I527 HydrophobicContact CG1-CB 4.36Å; V460-I527 HydrophobicContact CG1-CG2 4.13Å; V460-I527 WeakPolarHBondContact CG1-O 3.32Å; V460-I527 PolarHBondContact N-O 2.78Å; V460-E529 HydrophobicContact CB-CB 4.24Å; V460-Q532 HydrophobicContact CG1-CG 4.4Å
461	A	97.9	Very high	91.3	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	154.2	-177.8	0	0	0	0	0	111.6	L416 F494 W495 W496 I527	L416-A461 HydrophobicContact CD1-CB 4.1Å; A461-F494 HydrophobicContact CB-CE2 3.74Å; A461-F494 HydrophobicContact CB-CZ 4.13Å; A461-W495 WeakPolarHBondContact CA-O 3.08Å; A461-W496 HydrophobicContact CB-CE3 3.65Å; A461-W496 HydrophobicContact CB-CZ3 3.8Å; A461-I527 PolarHBondContact N-O 3.3Å; A461-I527 PolarHBondContact O-N 3.13Å
462	T	98.4	Very high	91.6	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	133.1	170.5	-61.4	0	0	0	0	109.8	D442 M464 F494 W495 N497 W526	D442-T462 WeakPolarHBondContact OD2-CB 3.06Å; D442-T462 VanDerWaalsContact OD2-CG2 3.32Å; D442-T462 WeakPolarHBondContact OD2-CG2 3.36Å; D442-T462 PolarHBondContact OD2-OG1 3.22Å; T462-M464 HydrophobicContact CG2-CB 4.46Å; T462-F494 WeakPolarHBondContact O-CA 3.4Å; T462-F494 WeakPolarHBondContact O-CD2 3.27Å; T462-W495 VanDerWaalsContact CB-CE2 3.47Å; T462-W495 HydrophobicContact CG2-CH2 3.32Å; T462-W495 HydrophobicContact CG2-CZ2 3.32Å; T462-W495 HydrophobicContact CG2-CZ3 3.97Å; T462-W495 PolarHBondContact N-O 2.89Å; T462-W495 PolarHBondContact O-N 2.87Å; T462-N497 PolarHBondContact N-ND2 2.59Å; T462-N497 PolarHBondContact OG1-ND2 3.4Å; T462-N497 PolarHBondContact OG1-OD1 3.23Å; T462-W526 VanDerWaalsContact OG1-CD1 3.28Å
463	F	98.6	Very high	92.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	103.9	172.4	-166	-80.4	0	0	0	108.2	Y351 F354 I410 L413 T414 I465 A492 F494 K525	Y351-F463 AromaticContact CD2-CE2 3.94Å; Y351-F463 HydrophobicContact CD2-CE2 3.94Å; Y351-F463 HydrophobicContact CD2-CZ 4.33Å; Y351-F463 HydrophobicContact CE2-CE2 4.05Å; F354-F463 AromaticContact CD1-CE1 3.81Å; F354-F463 HydrophobicContact CD1-CE1 3.81Å; F354-F463 HydrophobicContact CD1-CZ 4.03Å; F354-F463 HydrophobicContact CD2-CZ 4Å; F354-F463 AromaticContact CE1-CE1 3.4Å; F354-F463 HydrophobicContact CE1-CE1 3.4Å; F354-F463 VanDerWaalsContact CE1-CE1 3.4Å; F354-F463 AromaticContact CE1-CZ 3.72Å; F354-F463 HydrophobicContact CE1-CZ 3.72Å; F354-F463 HydrophobicContact CE2-CE1 4.24Å; F354-F463 AromaticContact CE2-CZ 3.67Å; F354-F463 HydrophobicContact CE2-CZ 3.67Å; F354-F463 HydrophobicContact CG-CE1 4.41Å; F354-F463 HydrophobicContact CG-CZ 4.19Å; F354-F463 AromaticContact CZ-CE1 3.66Å; F354-F463 HydrophobicContact CZ-CE1 3.66Å; F354-F463 AromaticContact CZ-CZ 3.53Å; F354-F463 HydrophobicContact CZ-CZ 3.53Å; I410-F463 HydrophobicContact CD1-CD1 3.96Å; I410-F463 HydrophobicContact CD1-CE1 4.19Å; I410-F463 HydrophobicContact CG1-CD1 3.96Å; I410-F463 HydrophobicContact CG1-CE1 3.8Å; I410-F463 HydrophobicContact CG1-CZ 4.28Å; I410-F463 HydrophobicContact CG2-CB 4.39Å; I410-F463 HydrophobicContact CG2-CD1 4.19Å; I410-F463 HydrophobicContact CG2-CD2 4.07Å; I410-F463 HydrophobicContact CG2-CE2 4.44Å; I410-F463 HydrophobicContact CG2-CG 3.96Å; L413-F463 HydrophobicContact CD2-CE2 3.8Å; L413-F463 HydrophobicContact CD2-CZ 3.95Å; T414-F463 HydrophobicContact CG2-CD2 3.77Å; T414-F463 HydrophobicContact CG2-CE2 4.06Å; F463-I465 HydrophobicContact CD1-CD1 4.48Å; F463-I465 HydrophobicContact CD1-CG1 4.05Å; F463-I465 HydrophobicContact CE1-CD1 4.23Å; F463-I465 HydrophobicContact CE1-CG1 3.88Å; F463-A492 HydrophobicContact CD1-CB 4.17Å; F463-A492 HydrophobicContact CE1-CB 3.33Å; F463-A492 HydrophobicContact CE2-CB 4.29Å; F463-A492 HydrophobicContact CZ-CB 3.39Å; F463-F494 HydrophobicContact CB-CD2 4.45Å; F463-F494 HydrophobicContact CD2-CB 4.19Å; F463-F494 AromaticContact CD2-CD2 3.82Å; F463-F494 HydrophobicContact CD2-CD2 3.82Å; F463-F494 HydrophobicContact CD2-CG 4.42Å; F463-K525 HydrophobicContact CB-CB 4.3Å; F463-K525 PolarHBondContact N-O 3.41Å; F463-K525 PolarHBondContact O-N 3.1Å
464	M	98.5	Very high	92.6	Very high	9 Å²	9	26.4 Å²	26.4	4%	0.044	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	125.6	-174.4	177	177.6	67.3	0	0	110.6	T462 Y466 T476 A492 L493 W495 V522 A523 N524	T462-M464 HydrophobicContact CG2-CB 4.46Å; M464-Y466 HydrophobicContact CE-CE1 3.91Å; M464-Y466 WeakPolarHBondContact CE-OH 3.04Å; M464-T476 HydrophobicContact CE-CG2 4.31Å; M464-T476 WeakPolarHBondContact CE-OG1 3.5Å; M464-A492 CarbonylContact O-C 3.44Å; M464-A492 WeakPolarHBondContact O-CA 3.17Å; M464-L493 HydrophobicContact CE-CB 4.11Å; M464-L493 HydrophobicContact CE-CD2 3.81Å; M464-L493 PolarHBondContact N-O 2.9Å; M464-L493 PolarHBondContact O-N 3.07Å; M464-W495 HydrophobicContact CB-CH2 4.14Å; M464-W495 HydrophobicContact CB-CZ3 4.07Å; M464-W495 HydrophobicContact CE-CH2 4.37Å; M464-W495 HydrophobicContact CE-CZ3 4.28Å; M464-V522 HydrophobicContact CG-CB 4.1Å; M464-V522 HydrophobicContact CG-CG1 4.44Å; M464-V522 HydrophobicContact SD-CB 4.22Å; M464-V522 HydrophobicContact SD-CG1 4.18Å; M464-V522 HydrophobicContact SD-CG2 4.46Å; M464-A523 CarbonylContact C-O 3.49Å; M464-A523 WeakPolarHBondContact CA-O 3.46Å; M464-N524 WeakPolarHBondContact CB-OD1 3Å; M464-N524 WeakPolarHBondContact CG-OD1 3.31Å
465	I	98.6	Very high	93.5	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	128.4	-178.7	-50	172.7	0	0	0	109.3	F354 V355 L406 F463 L467 A492 V522 A523	F354-I465 HydrophobicContact CD1-CD1 4.04Å; F354-I465 HydrophobicContact CD1-CG1 4.23Å; F354-I465 HydrophobicContact CE1-CD1 3.87Å; F354-I465 HydrophobicContact CE1-CG1 4.4Å; V355-I465 HydrophobicContact CG1-CD1 4.36Å; V355-I465 HydrophobicContact CG1-CG2 4.12Å; V355-I465 HydrophobicContact CG2-CG2 3.78Å; L406-I465 HydrophobicContact CD1-CD1 4.06Å; L406-I465 HydrophobicContact CD2-CD1 4.18Å; F463-I465 HydrophobicContact CD1-CD1 4.48Å; F463-I465 HydrophobicContact CD1-CG1 4.05Å; F463-I465 HydrophobicContact CE1-CD1 4.23Å; F463-I465 HydrophobicContact CE1-CG1 3.88Å; I465-L467 HydrophobicContact CB-CD2 4.49Å; I465-L467 HydrophobicContact CG2-CD2 4.03Å; I465-A492 HydrophobicContact CG1-CB 4.07Å; I465-V522 CarbonylContact O-C 3.59Å; I465-V522 WeakPolarHBondContact O-CA 3.4Å; I465-A523 HydrophobicContact CB-CB 4.19Å; I465-A523 PolarHBondContact N-O 3.13Å; I465-A523 PolarHBondContact O-N 2.89Å
466	Y	97.9	Very high	94.1	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	114.8	169.5	-62.8	-67.3	0	0	0	109.7	L350 M464 T476 V487 V488 N490 A491 L493 V522	L350-Y466 HydrophobicContact CD1-CE2 4.37Å; M464-Y466 HydrophobicContact CE-CE1 3.91Å; M464-Y466 WeakPolarHBondContact CE-OH 3.04Å; Y466-T476 PolarHBondContact OH-OG1 3.19Å; Y466-V487 HydrophobicContact CD1-CB 4.3Å; Y466-V487 HydrophobicContact CD1-CG1 3.74Å; Y466-V487 HydrophobicContact CD1-CG2 4.24Å; Y466-V487 HydrophobicContact CE1-CB 4.37Å; Y466-V487 HydrophobicContact CE1-CG1 4.3Å; Y466-V487 HydrophobicContact CE1-CG2 3.99Å; Y466-V487 HydrophobicContact CG-CG1 4.05Å; Y466-V488 VanDerWaalsContact CB-O 3.27Å; Y466-V488 WeakPolarHBondContact CB-O 3.47Å; Y466-V488 WeakPolarHBondContact CD2-O 3.41Å; Y466-N490 VanDerWaalsContact O-CA 3.3Å; Y466-N490 WeakPolarHBondContact O-CA 3.42Å; Y466-N490 PolarHBondContact O-N 3.11Å; Y466-A491 PolarHBondContact N-O 2.89Å; Y466-L493 HydrophobicContact CE2-CB 4.37Å; Y466-V522 HydrophobicContact CD1-CG1 3.8Å; Y466-V522 HydrophobicContact CE1-CG1 4.17Å
467	L	97.7	Very high	94.5	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.076	C	C	.	.			trans	-93.8	-5.9	-175.6	-57.9	174.5	0	0	0	113.5	A360 I363 R364 V428 I465 W521 A523	A360-L467 HydrophobicContact CB-CB 4.41Å; A360-L467 HydrophobicContact CB-CD2 4.21Å; I363-L467 HydrophobicContact CB-CD1 4.27Å; I363-L467 HydrophobicContact CB-CD2 4.28Å; I363-L467 HydrophobicContact CD1-CD2 3.91Å; I363-L467 HydrophobicContact CG2-CD1 3.59Å; I363-L467 HydrophobicContact CG2-CD2 4.17Å; R364-L467 HydrophobicContact CG-CB 4.14Å; R364-L467 HydrophobicContact CG-CD1 4.01Å; V428-L467 HydrophobicContact CG1-CD1 3.89Å; I465-L467 HydrophobicContact CB-CD2 4.49Å; I465-L467 HydrophobicContact CG2-CD2 4.03Å; L467-W521 HydrophobicContact CB-CB 3.77Å; L467-W521 HydrophobicContact CD1-CB 4.32Å; L467-W521 PolarHBondContact N-O 3.14Å; L467-A523 HydrophobicContact CD1-CB 4Å; L467-A523 HydrophobicContact CD2-CB 4.24Å; L467-A523 HydrophobicContact CG-CB 4.2Å
468	S	94.8	Very high	94.8	Very high	5 Å²	5	13.2 Å²	13.2	4%	0.035	8%	0.075	C	C	.	.	S	Bend	trans	-148.7	163.6	-178.9	60	0	0	0	0	110.9	D519 W521	S468-D519 VanDerWaalsContact CB-O 3.23Å; S468-D519 WeakPolarHBondContact CB-O 3.27Å; S468-D519 PolarHBondContact OG-O 3.4Å; S468-W521 PolarHBondContact OG-N 3.16Å
469	S	90.9	Very high	94.8	Very high	59 Å²	59	13.2 Å²	13.2	41%	0.413	8%	0.075	S	C	.	.			trans	-84.9	151.5	170.5	50.2	0	0	0	0	110.7
470	V	91	Very high	94.7	Very high	21 Å²	21	17.5 Å²	17.5	13%	0.127	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	125.5	170.4	171.6	0	0	0	0	107.2	A472 G473 V487 V515 V517 K520	V470-A472 VanDerWaalsContact CG1-O 3.29Å; V470-A472 WeakPolarHBondContact CG1-O 3.47Å; V470-G473 WeakPolarHBondContact CG1-O 3.33Å; V470-V487 HydrophobicContact CB-CB 4.05Å; V470-V487 HydrophobicContact CB-CG1 4.12Å; V470-V487 HydrophobicContact CB-CG2 4.19Å; V470-V487 HydrophobicContact CG2-CB 4.21Å; V470-V487 HydrophobicContact CG2-CG1 3.9Å; V470-V487 HydrophobicContact CG2-CG2 4.09Å; V470-V515 HydrophobicContact CG1-CG1 3.94Å; V470-V517 WeakPolarHBondContact CG1-O 2.98Å; V470-K520 HydrophobicContact CG2-CB 3.57Å; V470-K520 HydrophobicContact CG2-CG 3.94Å
471	E	89	Confident	94.5	Very high	117 Å²	117	17.9 Å²	17.9	55%	0.547	10%	0.096	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	-37.7	-177	-69.9	83.3	167.3	0	0	112	Y171 V517 G518	Y171-E471 HydrophobicContact CE2-CB 4.24Å; E471-V517 HydrophobicContact CB-CB 4.27Å; E471-V517 HydrophobicContact CB-CG1 4.06Å; E471-V517 PolarHBondContact N-O 3.23Å; E471-G518 WeakPolarHBondContact OE2-CA 3.3Å; E471-G518 PolarHBondContact OE2-N 3.39Å
472	A	89.4	Confident	94.2	Very high	10 Å²	10	23 Å²	23	8%	0.083	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	144	177	0	0	0	0	0	112.4	Y171 V470 L516 V517	Y171-A472 HydrophobicContact CD2-CB 4.18Å; Y171-A472 HydrophobicContact CG-CB 4.28Å; V470-A472 VanDerWaalsContact CG1-O 3.29Å; V470-A472 WeakPolarHBondContact CG1-O 3.47Å; A472-L516 HydrophobicContact CB-CB 3.87Å; A472-L516 HydrophobicContact CB-CD1 4.26Å; A472-L516 WeakPolarHBondContact O-CB 3.33Å; A472-L516 PolarHBondContact O-N 3.09Å; A472-V517 HydrophobicContact CB-CB 4.22Å; A472-V517 HydrophobicContact CB-CG2 4.48Å; A472-V517 PolarHBondContact N-O 3.07Å; A472-V517 PolarHBondContact O-N 3.44Å; A472-V517 VanDerWaalsContact O-N 3.08Å
473	G	91.6	Very high	93.9	Very high	13 Å²	13	23.2 Å²	23.2	13%	0.134	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	72.1	-153.8	-179	0	0	0	0	0	112.7	Y147 V470 A475	Y147-G473 WeakPolarHBondContact OH-CA 3.49Å; V470-G473 WeakPolarHBondContact CG1-O 3.33Å; G473-A475 PolarHBondContact O-N 2.96Å; G473-A475 VanDerWaalsContact O-N 3.17Å
474	G	92.8	Very high	93.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.125	C	C	.	.			trans	72.8	4.8	172.1	0	0	0	0	0	116.4	Y147 V487 C513 P514 K520	Y147-G474 PolarHBondContact OH-N 2.96Å; G474-V487 WeakPolarHBondContact O-CG2 3.31Å; G474-C513 WeakPolarHBondContact CA-O 3.27Å; G474-P514 PolarHBondContact N-O 3.29Å; G474-P514 VanDerWaalsContact N-O 3.08Å; G474-K520 WeakPolarHBondContact O-CE 3.17Å; G474-K520 PolarHBondContact O-NZ 2.7Å
475	A	94.3	Very high	93.3	Very high	1 Å²	1	23 Å²	23	1%	0.008	12%	0.123	C	C	.	.			trans	-56.9	162.3	178	0	0	0	0	0	113.1	G473 V485 C513	G473-A475 PolarHBondContact O-N 2.96Å; G473-A475 VanDerWaalsContact O-N 3.17Å; A475-V485 CarbonylContact C-O 3.58Å; A475-V485 VanDerWaalsContact CA-O 3.31Å; A475-V485 WeakPolarHBondContact CA-O 3.22Å; A475-V485 WeakPolarHBondContact CB-O 3.49Å; A475-C513 HydrophobicContact CB-CB 4.4Å; A475-C513 VanDerWaalsContact O-CB 3.32Å; A475-C513 WeakPolarHBondContact O-CB 3.3Å; A475-C513 PolarHBondContact O-N 2.95Å
476	T	95.1	Very high	93.1	Very high	4 Å²	4	25.5 Å²	25.5	3%	0.025	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	111.3	168.7	-60.4	0	0	0	0	108.7	M464 Y466 F478 S484 V485 L493 A511	M464-T476 HydrophobicContact CE-CG2 4.31Å; M464-T476 WeakPolarHBondContact CE-OG1 3.5Å; Y466-T476 PolarHBondContact OH-OG1 3.19Å; T476-F478 HydrophobicContact CG2-CD2 4.43Å; T476-F478 HydrophobicContact CG2-CE2 3.82Å; T476-F478 HydrophobicContact CG2-CZ 4.24Å; T476-S484 CarbonylContact O-C 3.41Å; T476-S484 WeakPolarHBondContact O-CA 3.16Å; T476-V485 PolarHBondContact N-O 3.22Å; T476-V485 PolarHBondContact O-N 2.86Å; T476-L493 HydrophobicContact CG2-CD2 4.17Å; T476-A511 CarbonylContact C-O 3.56Å; T476-A511 WeakPolarHBondContact CA-O 3.4Å
477	A	94.8	Very high	92.9	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	125	-178.8	0	0	0	0	0	110.3	Y301 L304 H510 A511	Y301-A477 HydrophobicContact CD2-CB 4.28Å; L304-A477 HydrophobicContact CB-CB 3.93Å; L304-A477 HydrophobicContact CD1-CB 4.17Å; A477-H510 CarbonylContact O-C 3.56Å; A477-H510 WeakPolarHBondContact O-CA 3.41Å; A477-H510 WeakPolarHBondContact O-CB 3.46Å; A477-A511 PolarHBondContact N-O 3.33Å; A477-A511 PolarHBondContact O-N 2.92Å
478	F	95	Very high	92.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	113.3	168.6	-65.8	-98.6	0	0	0	107.9	L304 I348 T476 A481 N482 L483 V485 L493 W495 H510	L304-F478 WeakPolarHBondContact CD1-O 3.3Å; I348-F478 HydrophobicContact CD1-CB 4.46Å; I348-F478 HydrophobicContact CD1-CD1 3.77Å; I348-F478 HydrophobicContact CD1-CD2 3.81Å; I348-F478 HydrophobicContact CD1-CE1 3.85Å; I348-F478 HydrophobicContact CD1-CE2 3.89Å; I348-F478 HydrophobicContact CD1-CG 3.75Å; I348-F478 HydrophobicContact CD1-CZ 3.91Å; I348-F478 HydrophobicContact CG1-CE1 4.31Å; I348-F478 HydrophobicContact CG1-CZ 4.27Å; I348-F478 HydrophobicContact CG2-CE2 4.38Å; I348-F478 HydrophobicContact CG2-CZ 4.44Å; T476-F478 HydrophobicContact CG2-CD2 4.43Å; T476-F478 HydrophobicContact CG2-CE2 3.82Å; T476-F478 HydrophobicContact CG2-CZ 4.24Å; F478-A481 HydrophobicContact CB-CB 3.87Å; F478-N482 PolarHBondContact O-N 2.98Å; F478-L483 HydrophobicContact CB-CD1 4.45Å; F478-L483 HydrophobicContact CB-CG 4.19Å; F478-L483 HydrophobicContact CD2-CD1 3.83Å; F478-L483 HydrophobicContact CD2-CG 4.47Å; F478-L483 HydrophobicContact CG-CD1 4.49Å; F478-L483 PolarHBondContact N-O 3.01Å; F478-L483 PolarHBondContact O-N 3.42Å; F478-L483 VanDerWaalsContact O-N 3.1Å; F478-V485 HydrophobicContact CD2-CG2 4.39Å; F478-V485 HydrophobicContact CE2-CG2 4.07Å; F478-L493 HydrophobicContact CE2-CD2 4Å; F478-L493 HydrophobicContact CZ-CD2 4.14Å; F478-W495 AromaticContact CE1-CD2 3.99Å; F478-W495 HydrophobicContact CE1-CD2 3.99Å; F478-W495 HydrophobicContact CE1-CE3 4.45Å; F478-W495 HydrophobicContact CE1-CG 4.04Å; F478-W495 AromaticContact CZ-CD2 3.92Å; F478-W495 HydrophobicContact CZ-CD2 3.92Å; F478-W495 AromaticContact CZ-CE3 3.92Å; F478-W495 HydrophobicContact CZ-CE3 3.92Å; F478-W495 HydrophobicContact CZ-CG 4.31Å; F478-W495 HydrophobicContact CZ-CZ3 4.35Å; F478-H510 HydrophobicContact CD1-CB 3.78Å; F478-H510 HydrophobicContact CE1-CB 3.95Å; F478-H510 HydrophobicContact CG-CB 4.19Å; F478-H510 HydrophobicContact CZ-CB 4.5Å
479	I	93.1	Very high	92.8	Very high	4 Å²	4	32 Å²	32	2%	0.021	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-51	-157.4	-63.1	173.3	0	0	0	111.3	T297 T300 P439 N482 L509	T297-I479 HydrophobicContact CG2-CG2 3.86Å; T300-I479 HydrophobicContact CG2-CG2 4.08Å; P439-I479 HydrophobicContact CB-CD1 3.37Å; P439-I479 HydrophobicContact CG-CD1 3.34Å; I479-N482 PolarHBondContact O-N 3.04Å; I479-L509 HydrophobicContact CB-CD2 4.22Å; I479-L509 HydrophobicContact CB-CG 4.49Å; I479-L509 HydrophobicContact CD1-CD2 4.01Å; I479-L509 HydrophobicContact CD1-CG 4.08Å; I479-L509 HydrophobicContact CG2-CD2 4.38Å; I479-L509 PolarHBondContact N-O 3.34Å
480	Y	93.1	Very high	93.1	Very high	119 Å²	119	29.9 Å²	29.9	47%	0.467	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-33	179.1	-60.4	-31	0	0	0	111.8	T297 N482 S506 D507 L509	T297-Y480 HydrophobicContact CG2-CE1 3.65Å; Y480-N482 PolarHBondContact O-N 2.89Å; Y480-N482 VanDerWaalsContact O-N 3.16Å; Y480-S506 WeakPolarHBondContact CD2-O 3.4Å; Y480-D507 VanDerWaalsContact CB-OD1 3.3Å; Y480-D507 WeakPolarHBondContact CB-OD1 3.3Å; Y480-L509 HydrophobicContact CD2-CB 4.05Å; Y480-L509 HydrophobicContact CD2-CD2 4.25Å; Y480-L509 HydrophobicContact CE1-CD2 4.04Å; Y480-L509 HydrophobicContact CE2-CB 4.11Å; Y480-L509 HydrophobicContact CE2-CD2 3.69Å
481	A	92.1	Very high	93.5	Very high	14 Å²	14	28.9 Å²	28.9	12%	0.116	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-8.2	167.1	0	0	0	0	0	113.8	P346 F478 L483	P346-A481 HydrophobicContact CG-CB 3.96Å; F478-A481 HydrophobicContact CB-CB 3.87Å; A481-L483 HydrophobicContact CB-CD2 4Å; A481-L483 HydrophobicContact CB-CG 4.34Å; A481-L483 PolarHBondContact O-N 2.91Å
482	N	91.6	Very high	93.9	Very high	108 Å²	108	23.3 Å²	23.3	58%	0.578	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	46.8	175.1	-167.8	39.8	0	0	0	114.4	F478 I479 Y480	F478-N482 PolarHBondContact O-N 2.98Å; I479-N482 PolarHBondContact O-N 3.04Å; Y480-N482 PolarHBondContact O-N 2.89Å; Y480-N482 VanDerWaalsContact O-N 3.16Å
483	L	91.8	Very high	94.4	Very high	4 Å²	4	22.9 Å²	22.9	2%	0.021	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	152.8	-178	77.8	86.9	0	0	0	111.4	I342 H343 I348 F478 A481 V485	I342-L483 HydrophobicContact CG2-CD1 4.13Å; H343-L483 HydrophobicContact CB-CD2 3.61Å; H343-L483 WeakPolarHBondContact CD2-CD2 3.08Å; I348-L483 HydrophobicContact CD1-CD1 4.25Å; I348-L483 HydrophobicContact CD1-CD2 4.03Å; F478-L483 HydrophobicContact CB-CD1 4.45Å; F478-L483 HydrophobicContact CB-CG 4.19Å; F478-L483 HydrophobicContact CD2-CD1 3.83Å; F478-L483 HydrophobicContact CD2-CG 4.47Å; F478-L483 HydrophobicContact CG-CD1 4.49Å; F478-L483 PolarHBondContact N-O 3.01Å; F478-L483 PolarHBondContact O-N 3.42Å; F478-L483 VanDerWaalsContact O-N 3.1Å; A481-L483 HydrophobicContact CB-CD2 4Å; A481-L483 HydrophobicContact CB-CG 4.34Å; A481-L483 PolarHBondContact O-N 2.91Å; L483-V485 HydrophobicContact CD1-CG2 3.76Å
484	S	92.8	Very high	94.7	Very high	2 Å²	2	22.5 Å²	22.5	1%	0.014	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	137.9	171.6	78.4	0	0	0	0	113.2	L304 T307 G309 Q311 T476	L304-S484 PolarHBondContact O-OG 3.13Å; T307-S484 PolarHBondContact OG1-OG 2.89Å; G309-S484 WeakPolarHBondContact CA-OG 3.35Å; G309-S484 PolarHBondContact N-OG 2.85Å; Q311-S484 PolarHBondContact NE2-O 3.03Å; T476-S484 CarbonylContact O-C 3.41Å; T476-S484 WeakPolarHBondContact O-CA 3.16Å
485	V	92.9	Very high	94.9	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.006	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	124.9	179.9	-171.3	0	0	0	0	109.3	I342 A475 T476 F478 L483 L493	I342-V485 HydrophobicContact CG2-CG2 4.05Å; A475-V485 CarbonylContact C-O 3.58Å; A475-V485 VanDerWaalsContact CA-O 3.31Å; A475-V485 WeakPolarHBondContact CA-O 3.22Å; A475-V485 WeakPolarHBondContact CB-O 3.49Å; T476-V485 PolarHBondContact N-O 3.22Å; T476-V485 PolarHBondContact O-N 2.86Å; F478-V485 HydrophobicContact CD2-CG2 4.39Å; F478-V485 HydrophobicContact CE2-CG2 4.07Å; L483-V485 HydrophobicContact CD1-CG2 3.76Å; V485-L493 HydrophobicContact CB-CD1 4.5Å; V485-L493 HydrophobicContact CB-CD2 4.22Å; V485-L493 HydrophobicContact CG1-CD1 3.97Å; V485-L493 HydrophobicContact CG1-CD2 4.33Å; V485-L493 HydrophobicContact CG2-CD1 4.26Å; V485-L493 HydrophobicContact CG2-CD2 4.27Å
486	P	92.9	Very high	95.1	Very high	53 Å²	53	25 Å²	25	34%	0.344	13%	0.125	S	C	.	.			trans	-68.3	158.8	179.3	28.3	-32.8	0	0	0	111.4	G309 V488	G309-P486 WeakPolarHBondContact O-CD 3.38Å; P486-V488 HydrophobicContact CG-CG2 4.3Å; P486-V488 PolarHBondContact O-N 2.85Å
487	V	94	Very high	95.2	Very high	21 Å²	21	24.8 Å²	24.8	13%	0.127	12%	0.124	C	C	.	.			trans	-73.9	109.2	171.9	178.6	0	0	0	0	109	Y466 V470 G474 K520	Y466-V487 HydrophobicContact CD1-CB 4.3Å; Y466-V487 HydrophobicContact CD1-CG1 3.74Å; Y466-V487 HydrophobicContact CD1-CG2 4.24Å; Y466-V487 HydrophobicContact CE1-CB 4.37Å; Y466-V487 HydrophobicContact CE1-CG1 4.3Å; Y466-V487 HydrophobicContact CE1-CG2 3.99Å; Y466-V487 HydrophobicContact CG-CG1 4.05Å; V470-V487 HydrophobicContact CB-CB 4.05Å; V470-V487 HydrophobicContact CB-CG1 4.12Å; V470-V487 HydrophobicContact CB-CG2 4.19Å; V470-V487 HydrophobicContact CG2-CB 4.21Å; V470-V487 HydrophobicContact CG2-CG1 3.9Å; V470-V487 HydrophobicContact CG2-CG2 4.09Å; G474-V487 WeakPolarHBondContact O-CG2 3.31Å; V487-K520 HydrophobicContact CG2-CD 4.33Å
488	V	94.9	Very high	95.2	Very high	42 Å²	42	24.9 Å²	24.9	26%	0.255	12%	0.124	S	C	.	.			trans	-107.1	105.6	174.9	-176.9	0	0	0	0	108.3	L350 Y466 P486 N490 A491	L350-V488 HydrophobicContact CD2-CB 4.31Å; L350-V488 HydrophobicContact CD2-CG2 3.9Å; Y466-V488 VanDerWaalsContact CB-O 3.27Å; Y466-V488 WeakPolarHBondContact CB-O 3.47Å; Y466-V488 WeakPolarHBondContact CD2-O 3.41Å; P486-V488 HydrophobicContact CG-CG2 4.3Å; P486-V488 PolarHBondContact O-N 2.85Å; V488-N490 PolarHBondContact O-N 3.33Å; V488-A491 HydrophobicContact CB-CB 3.8Å; V488-A491 HydrophobicContact CG1-CB 3.77Å; V488-A491 VanDerWaalsContact O-CB 3.25Å; V488-A491 WeakPolarHBondContact O-CB 3.49Å; V488-A491 PolarHBondContact O-N 2.72Å
489	K	96.1	Very high	95.1	Very high	80 Å²	80	27.3 Å²	27.3	35%	0.348	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50	136.8	-179	-175.1	-174.4	-178	-157	0	110.1	D357 A491	D357-K489 WeakPolarHBondContact OD1-CE 3.4Å; D357-K489 IonicContact OD1-NZ 3.59Å; D357-K489 PolarHBondContact OD1-NZ 2.95Å; D357-K489 IonicContact OD2-NZ 3.69Å; K489-A491 PolarHBondContact O-N 2.97Å; K489-A491 VanDerWaalsContact O-N 3.1Å
490	N	98	Very high	95	Very high	14 Å²	14	32.2 Å²	32.2	8%	0.075	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	-3.8	179.4	-61.2	-18.8	0	0	0	115.7	F354 V355 D357 Y466 V488	F354-N490 PolarHBondContact N-O 3.34Å; V355-N490 HydrophobicContact CG2-CB 4.06Å; V355-N490 PolarHBondContact N-O 2.81Å; V355-N490 VanDerWaalsContact N-O 3.17Å; V355-N490 VanDerWaalsContact O-CB 3.26Å; V355-N490 WeakPolarHBondContact O-CB 3.32Å; D357-N490 PolarHBondContact OD1-ND2 2.87Å; Y466-N490 VanDerWaalsContact O-CA 3.3Å; Y466-N490 WeakPolarHBondContact O-CA 3.42Å; Y466-N490 PolarHBondContact O-N 3.11Å; V488-N490 PolarHBondContact O-N 3.33Å
491	A	98.1	Very high	94.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.15	C	C	.	.			trans	-81.6	160	173.8	0	0	0	0	0	111.5	L350 Y351 Y466 V488 K489	L350-A491 HydrophobicContact CD1-CB 3.8Å; L350-A491 HydrophobicContact CG-CB 4.19Å; Y351-A491 CarbonylContact O-C 3.6Å; Y351-A491 WeakPolarHBondContact O-CA 3.43Å; Y351-A491 WeakPolarHBondContact O-CB 3.41Å; Y466-A491 PolarHBondContact N-O 2.89Å; V488-A491 HydrophobicContact CB-CB 3.8Å; V488-A491 HydrophobicContact CG1-CB 3.77Å; V488-A491 VanDerWaalsContact O-CB 3.25Å; V488-A491 WeakPolarHBondContact O-CB 3.49Å; V488-A491 PolarHBondContact O-N 2.72Å; K489-A491 PolarHBondContact O-N 2.97Å; K489-A491 VanDerWaalsContact O-N 3.1Å
492	A	98.4	Very high	94.6	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	129.2	172.2	0	0	0	0	0	111.4	L350 Y351 F354 F463 M464 I465	L350-A492 CarbonylContact C-O 3.51Å; Y351-A492 PolarHBondContact N-O 2.82Å; Y351-A492 PolarHBondContact O-N 3.1Å; F354-A492 HydrophobicContact CB-CB 3.9Å; F354-A492 HydrophobicContact CD1-CB 3.82Å; F354-A492 HydrophobicContact CG-CB 3.82Å; F463-A492 HydrophobicContact CD1-CB 4.17Å; F463-A492 HydrophobicContact CE1-CB 3.33Å; F463-A492 HydrophobicContact CE2-CB 4.29Å; F463-A492 HydrophobicContact CZ-CB 3.39Å; M464-A492 CarbonylContact O-C 3.44Å; M464-A492 WeakPolarHBondContact O-CA 3.17Å; I465-A492 HydrophobicContact CG1-CB 4.07Å
493	L	98.2	Very high	94.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	134.4	172.7	-169.9	62.6	0	0	0	109.8	I348 L350 M464 Y466 T476 F478 V485 W495	I348-L493 HydrophobicContact CG2-CD1 3.56Å; I348-L493 HydrophobicContact CG2-CG 4.35Å; L350-L493 HydrophobicContact CD1-CB 4.44Å; L350-L493 HydrophobicContact CD1-CD1 4.25Å; M464-L493 HydrophobicContact CE-CB 4.11Å; M464-L493 HydrophobicContact CE-CD2 3.81Å; M464-L493 PolarHBondContact N-O 2.9Å; M464-L493 PolarHBondContact O-N 3.07Å; Y466-L493 HydrophobicContact CE2-CB 4.37Å; T476-L493 HydrophobicContact CG2-CD2 4.17Å; F478-L493 HydrophobicContact CE2-CD2 4Å; F478-L493 HydrophobicContact CZ-CD2 4.14Å; V485-L493 HydrophobicContact CB-CD1 4.5Å; V485-L493 HydrophobicContact CB-CD2 4.22Å; V485-L493 HydrophobicContact CG1-CD1 3.97Å; V485-L493 HydrophobicContact CG1-CD2 4.33Å; V485-L493 HydrophobicContact CG2-CD1 4.26Å; V485-L493 HydrophobicContact CG2-CD2 4.27Å; L493-W495 HydrophobicContact CB-CZ3 4.2Å; L493-W495 HydrophobicContact CD2-CE3 4.18Å; L493-W495 HydrophobicContact CD2-CZ3 3.85Å; L493-W495 HydrophobicContact CG-CE3 3.93Å; L493-W495 HydrophobicContact CG-CZ3 3.86Å
494	F	98.5	Very high	94.6	Very high	5 Å²	5	32.3 Å²	32.3	2%	0.022	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	137.6	179.8	172.9	-94.7	0	0	0	111.3	Y347 I348 A349 Y351 T414 A461 T462 F463 W496	Y347-F494 HydrophobicContact CD1-CD1 4.21Å; Y347-F494 HydrophobicContact CD1-CE1 4.12Å; Y347-F494 AromaticContact CE1-CD1 3.91Å; Y347-F494 HydrophobicContact CE1-CD1 3.91Å; Y347-F494 AromaticContact CE1-CE1 3.99Å; Y347-F494 HydrophobicContact CE1-CE1 3.99Å; I348-F494 WeakPolarHBondContact CA-O 3.45Å; A349-F494 PolarHBondContact N-O 3.24Å; A349-F494 PolarHBondContact O-N 3.13Å; Y351-F494 HydrophobicContact CD2-CB 4.23Å; Y351-F494 HydrophobicContact CE2-CB 3.57Å; Y351-F494 HydrophobicContact CE2-CG 4.19Å; T414-F494 HydrophobicContact CG2-CD2 4.09Å; T414-F494 HydrophobicContact CG2-CE2 3.89Å; A461-F494 HydrophobicContact CB-CE2 3.74Å; A461-F494 HydrophobicContact CB-CZ 4.13Å; T462-F494 WeakPolarHBondContact O-CA 3.4Å; T462-F494 WeakPolarHBondContact O-CD2 3.27Å; F463-F494 HydrophobicContact CB-CD2 4.45Å; F463-F494 HydrophobicContact CD2-CB 4.19Å; F463-F494 AromaticContact CD2-CD2 3.82Å; F463-F494 HydrophobicContact CD2-CD2 3.82Å; F463-F494 HydrophobicContact CD2-CG 4.42Å; F494-W496 HydrophobicContact CE1-CD2 4.19Å; F494-W496 AromaticContact CE1-CE2 3.7Å; F494-W496 AromaticContact CE1-CZ2 3.97Å; F494-W496 HydrophobicContact CE1-CZ2 3.97Å; F494-W496 AromaticContact CE1-NE1 3.74Å; F494-W496 AromaticContact CZ-CD2 3.86Å; F494-W496 HydrophobicContact CZ-CD2 3.86Å; F494-W496 AromaticContact CZ-CE2 3.57Å; F494-W496 HydrophobicContact CZ-CE3 4.11Å; F494-W496 AromaticContact CZ-CH2 3.83Å; F494-W496 HydrophobicContact CZ-CH2 3.83Å; F494-W496 AromaticContact CZ-CZ2 3.57Å; F494-W496 HydrophobicContact CZ-CZ2 3.57Å; F494-W496 HydrophobicContact CZ-CZ3 4.09Å
495	W	98.3	Very high	94.7	Very high	1 Å²	1	32.8 Å²	32.8	0%	0.004	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	157.4	169.5	64	96.4	0	0	0	111.1	Y347 I348 A461 T462 M464 F478 L493 N497 H510	Y347-W495 WeakPolarHBondContact O-CA 3.05Å; Y347-W495 WeakPolarHBondContact O-CB 3.18Å; I348-W495 HydrophobicContact CG1-CB 4.01Å; A461-W495 WeakPolarHBondContact CA-O 3.08Å; T462-W495 VanDerWaalsContact CB-CE2 3.47Å; T462-W495 HydrophobicContact CG2-CH2 3.32Å; T462-W495 HydrophobicContact CG2-CZ2 3.32Å; T462-W495 HydrophobicContact CG2-CZ3 3.97Å; T462-W495 PolarHBondContact N-O 2.89Å; T462-W495 PolarHBondContact O-N 2.87Å; M464-W495 HydrophobicContact CB-CH2 4.14Å; M464-W495 HydrophobicContact CB-CZ3 4.07Å; M464-W495 HydrophobicContact CE-CH2 4.37Å; M464-W495 HydrophobicContact CE-CZ3 4.28Å; F478-W495 AromaticContact CE1-CD2 3.99Å; F478-W495 HydrophobicContact CE1-CD2 3.99Å; F478-W495 HydrophobicContact CE1-CE3 4.45Å; F478-W495 HydrophobicContact CE1-CG 4.04Å; F478-W495 AromaticContact CZ-CD2 3.92Å; F478-W495 HydrophobicContact CZ-CD2 3.92Å; F478-W495 AromaticContact CZ-CE3 3.92Å; F478-W495 HydrophobicContact CZ-CE3 3.92Å; F478-W495 HydrophobicContact CZ-CG 4.31Å; F478-W495 HydrophobicContact CZ-CZ3 4.35Å; L493-W495 HydrophobicContact CB-CZ3 4.2Å; L493-W495 HydrophobicContact CD2-CE3 4.18Å; L493-W495 HydrophobicContact CD2-CZ3 3.85Å; L493-W495 HydrophobicContact CG-CE3 3.93Å; L493-W495 HydrophobicContact CG-CZ3 3.86Å; W495-N497 VanDerWaalsContact CD1-OD1 3.28Å; W495-N497 PolarHBondContact NE1-OD1 3.05Å; W495-H510 AromaticContact CZ2-CE1 3.65Å; W495-H510 AromaticContact CZ2-NE2 3.55Å
496	W	97.5	Very high	94.8	Very high	53 Å²	53	35.9 Å²	35.9	20%	0.201	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	133.2	169.8	-62.4	109.6	0	0	0	108.9	Y347 L416 V460 A461 F494 T508 R536	Y347-W496 AromaticContact CD1-CD1 3.98Å; Y347-W496 AromaticContact CD1-NE1 3.92Å; L416-W496 HydrophobicContact CD1-CH2 3.72Å; L416-W496 HydrophobicContact CD1-CZ3 3.63Å; L416-W496 HydrophobicContact CD2-CH2 3.96Å; L416-W496 HydrophobicContact CD2-CZ3 4.15Å; L416-W496 HydrophobicContact CG-CH2 4.13Å; L416-W496 HydrophobicContact CG-CZ3 4.4Å; V460-W496 HydrophobicContact CG2-CE3 4.35Å; V460-W496 HydrophobicContact CG2-CZ3 4.42Å; A461-W496 HydrophobicContact CB-CE3 3.65Å; A461-W496 HydrophobicContact CB-CZ3 3.8Å; F494-W496 HydrophobicContact CE1-CD2 4.19Å; F494-W496 AromaticContact CE1-CE2 3.7Å; F494-W496 AromaticContact CE1-CZ2 3.97Å; F494-W496 HydrophobicContact CE1-CZ2 3.97Å; F494-W496 AromaticContact CE1-NE1 3.74Å; F494-W496 AromaticContact CZ-CD2 3.86Å; F494-W496 HydrophobicContact CZ-CD2 3.86Å; F494-W496 AromaticContact CZ-CE2 3.57Å; F494-W496 HydrophobicContact CZ-CE3 4.11Å; F494-W496 AromaticContact CZ-CH2 3.83Å; F494-W496 HydrophobicContact CZ-CH2 3.83Å; F494-W496 AromaticContact CZ-CZ2 3.57Å; F494-W496 HydrophobicContact CZ-CZ2 3.57Å; F494-W496 HydrophobicContact CZ-CZ3 4.09Å; W496-T508 WeakPolarHBondContact O-CG2 3.44Å; W496-R536 VanDerWaalsContact CE3-CZ 3.42Å; W496-R536 VanDerWaalsContact CE3-NE 3.33Å
497	N	97.2	Very high	94.8	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.195	C	C	.	.	S	Bend	trans	-90.8	-19.6	175.7	-66.8	-46.7	0	0	0	112.5	H443 R459 V460 T462 W495 D505	H443-N497 HydrophobicContact CB-CB 4.07Å; H443-N497 PolarHBondContact ND1-O 2.87Å; R459-N497 VanDerWaalsContact O-CB 3.27Å; R459-N497 WeakPolarHBondContact O-CB 3.24Å; V460-N497 PolarHBondContact O-N 3.46Å; T462-N497 PolarHBondContact N-ND2 2.59Å; T462-N497 PolarHBondContact OG1-ND2 3.4Å; T462-N497 PolarHBondContact OG1-OD1 3.23Å; W495-N497 VanDerWaalsContact CD1-OD1 3.28Å; W495-N497 PolarHBondContact NE1-OD1 3.05Å; N497-D505 PolarHBondContact O-N 3.42Å
498	L	94.8	Very high	94.9	Very high	1 Å²	1	35 Å²	35	1%	0.005	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-124.7	145.1	-177.5	-52.1	177.8	0	0	0	110	H443 N458 R459 V460 E503 R536	H443-L498 HydrophobicContact CB-CD2 3.62Å; N458-L498 HydrophobicContact CB-CD1 4.04Å; R459-L498 WeakPolarHBondContact O-CG 3.04Å; V460-L498 HydrophobicContact CB-CD1 4.2Å; V460-L498 HydrophobicContact CG2-CB 4.5Å; V460-L498 HydrophobicContact CG2-CD1 4.29Å; L498-E503 CarbonylContact C-O 3.55Å; L498-E503 WeakPolarHBondContact CA-O 3.37Å; L498-E503 WeakPolarHBondContact CB-O 3.4Å; L498-R536 PolarHBondContact O-NH1 3.48Å; L498-R536 PolarHBondContact O-NH2 3.14Å
499	H	92.6	Very high	94.9	Very high	51 Å²	51	33.6 Å²	33.6	24%	0.236	18%	0.18	C	C	.	.			trans	-58.5	166.8	161.1	-67.2	-72.6	0	0	0	111	S501 G502 E503 D505 R536 D544	H499-S501 WeakPolarHBondContact CB-OG 3.43Å; H499-S501 PolarHBondContact O-N 3.48Å; H499-G502 PolarHBondContact O-N 2.62Å; H499-E503 PolarHBondContact N-O 2.91Å; H499-D505 IonicContact CE1-OD2 2.83Å; H499-D505 WeakPolarHBondContact NE2-CA 3.34Å; H499-D505 IonicContact NE2-OD1 2.69Å; H499-R536 PolarHBondContact O-NH1 3.43Å; H499-D544 WeakPolarHBondContact CB-OXT 3.25Å
500	R	90.7	Very high	94.9	Very high	108 Å²	108	30.3 Å²	30.3	41%	0.408	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-21.8	175.7	-66.6	-176.9	171.3	-89.3	-0.8	112.1	G502 P537 C538 D544	R500-G502 PolarHBondContact O-N 3.4Å; R500-P537 PolarHBondContact NH1-O 2.87Å; R500-C538 PolarHBondContact O-SG 3.43Å; R500-D544 CarbonylContact C-O 3.34Å; R500-D544 WeakPolarHBondContact CA-O 3.18Å; R500-D544 WeakPolarHBondContact CB-O 3.24Å; R500-D544 VanDerWaalsContact N-C 3.31Å; R500-D544 PolarHBondContact N-O 2.98Å; R500-D544 VanDerWaalsContact N-O 3.09Å; R500-D544 PolarHBondContact N-OXT 2.93Å
501	S	88.7	Confident	94.6	Very high	56 Å²	56	29.7 Å²	29.7	39%	0.392	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-19.6	168.7	69.1	0	0	0	0	113.1	H499 E503 D544	H499-S501 WeakPolarHBondContact CB-OG 3.43Å; H499-S501 PolarHBondContact O-N 3.48Å; S501-E503 WeakPolarHBondContact OG-CB 3.47Å; S501-E503 PolarHBondContact OG-N 3.28Å; S501-D544 PolarHBondContact N-O 3.3Å
502	G	88.9	Confident	94.4	Very high	31 Å²	31	29.9 Å²	29.9	32%	0.32	17%	0.165	S	C	.	.	S	Bend	trans	90.1	-3.5	-172.7	0	0	0	0	0	113.7	H499 R500	H499-G502 PolarHBondContact O-N 2.62Å; R500-G502 PolarHBondContact O-N 3.4Å
503	E	90.4	Very high	94.1	Very high	136 Å²	136	29.9 Å²	29.9	64%	0.636	17%	0.165	S	C	*	.			trans	-67.6	145.5	172.5	-172.6	168.3	-168.3	0	0	111.3	L498 H499 S501 D505	L498-E503 CarbonylContact C-O 3.55Å; L498-E503 WeakPolarHBondContact CA-O 3.37Å; L498-E503 WeakPolarHBondContact CB-O 3.4Å; H499-E503 PolarHBondContact N-O 2.91Å; S501-E503 WeakPolarHBondContact OG-CB 3.47Å; S501-E503 PolarHBondContact OG-N 3.28Å; E503-D505 PolarHBondContact O-N 2.98Å
504	G	93.3	Very high	93.9	Very high	24 Å²	24	29.9 Å²	29.9	25%	0.247	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-66.7	126.6	176.1	0	0	0	0	0	111.7	S506	G504-S506 PolarHBondContact O-N 3.08Å
505	D	94.9	Very high	93.5	Very high	12 Å²	12	30 Å²	30	6%	0.064	17%	0.165	C	C	.	.			trans	-78.7	108.7	178.1	-178	-19.5	0	0	0	109.7	P346 H443 N497 H499 E503 D507 T508	P346-D505 WeakPolarHBondContact CB-OD2 3.4Å; H443-D505 PolarHBondContact CE1-O 2.82Å; N497-D505 PolarHBondContact O-N 3.42Å; H499-D505 IonicContact CE1-OD2 2.83Å; H499-D505 WeakPolarHBondContact NE2-CA 3.34Å; H499-D505 IonicContact NE2-OD1 2.69Å; E503-D505 PolarHBondContact O-N 2.98Å; D505-D507 PolarHBondContact O-N 2.8Å; D505-D507 WeakPolarHBondContact OD1-CB 3.4Å; D505-D507 PolarHBondContact OD1-N 3.44Å; D505-T508 HydrophobicContact CB-CG2 3.75Å; D505-T508 WeakPolarHBondContact O-CB 3.29Å; D505-T508 PolarHBondContact O-N 3.35Å; D505-T508 PolarHBondContact O-OG1 3.42Å
506	S	93.9	Very high	93.1	Very high	65 Å²	65	30.5 Å²	30.5	46%	0.455	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-63.9	-26.6	-178	66.5	0	0	0	0	113.2	F441 Y480 G504 T508 L509	F441-S506 VanDerWaalsContact CE1-O 3.24Å; F441-S506 WeakPolarHBondContact CE1-O 3.47Å; Y480-S506 WeakPolarHBondContact CD2-O 3.4Å; G504-S506 PolarHBondContact O-N 3.08Å; S506-T508 PolarHBondContact O-N 2.86Å; S506-T508 VanDerWaalsContact O-N 3.16Å; S506-L509 PolarHBondContact O-N 2.79Å
507	D	94.3	Very high	92.6	Very high	56 Å²	56	29.4 Å²	29.4	30%	0.299	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-73.4	-8.9	-178.7	-69.1	-33.3	0	0	0	113.1	P346 Y480 D505 L509	P346-D507 HydrophobicContact CB-CB 4.41Å; P346-D507 HydrophobicContact CG-CB 3.79Å; Y480-D507 VanDerWaalsContact CB-OD1 3.3Å; Y480-D507 WeakPolarHBondContact CB-OD1 3.3Å; D505-D507 PolarHBondContact O-N 2.8Å; D505-D507 WeakPolarHBondContact OD1-CB 3.4Å; D505-D507 PolarHBondContact OD1-N 3.44Å; D507-L509 PolarHBondContact O-N 2.81Å
508	T	95.9	Very high	92.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-82.6	4.8	174.2	71.7	0	0	0	0	113.6	P346 W496 D505 S506 H510	P346-T508 HydrophobicContact CB-CG2 4.08Å; W496-T508 WeakPolarHBondContact O-CG2 3.44Å; D505-T508 HydrophobicContact CB-CG2 3.75Å; D505-T508 WeakPolarHBondContact O-CB 3.29Å; D505-T508 PolarHBondContact O-N 3.35Å; D505-T508 PolarHBondContact O-OG1 3.42Å; S506-T508 PolarHBondContact O-N 2.86Å; S506-T508 VanDerWaalsContact O-N 3.16Å; T508-H510 PolarHBondContact O-N 2.87Å; T508-H510 PolarHBondContact O-ND1 2.9Å
509	L	94.9	Very high	91.8	Very high	13 Å²	13	32.4 Å²	32.4	7%	0.068	19%	0.187	C	C	.	.			trans	-57.6	110.8	171.3	-176.4	71.6	0	0	0	108.8	T297 P439 F441 I479 Y480 S506 D507	T297-L509 HydrophobicContact CG2-CD2 4.15Å; P439-L509 HydrophobicContact CB-CD1 4.23Å; P439-L509 HydrophobicContact CB-CD2 4.43Å; P439-L509 HydrophobicContact CB-CG 4.33Å; F441-L509 HydrophobicContact CD1-CB 4.29Å; F441-L509 HydrophobicContact CD1-CD1 4.41Å; F441-L509 HydrophobicContact CD2-CD1 3.93Å; F441-L509 HydrophobicContact CE1-CB 3.57Å; F441-L509 HydrophobicContact CE1-CD1 4.15Å; F441-L509 HydrophobicContact CE1-CG 4.46Å; F441-L509 HydrophobicContact CE2-CB 4.44Å; F441-L509 HydrophobicContact CE2-CD1 3.65Å; F441-L509 HydrophobicContact CG-CD1 4.34Å; F441-L509 HydrophobicContact CZ-CB 3.67Å; F441-L509 HydrophobicContact CZ-CD1 3.77Å; F441-L509 HydrophobicContact CZ-CG 4.23Å; I479-L509 HydrophobicContact CB-CD2 4.22Å; I479-L509 HydrophobicContact CB-CG 4.49Å; I479-L509 HydrophobicContact CD1-CD2 4.01Å; I479-L509 HydrophobicContact CD1-CG 4.08Å; I479-L509 HydrophobicContact CG2-CD2 4.38Å; I479-L509 PolarHBondContact N-O 3.34Å; Y480-L509 HydrophobicContact CD2-CB 4.05Å; Y480-L509 HydrophobicContact CD2-CD2 4.25Å; Y480-L509 HydrophobicContact CE1-CD2 4.04Å; Y480-L509 HydrophobicContact CE2-CB 4.11Å; Y480-L509 HydrophobicContact CE2-CD2 3.69Å; S506-L509 PolarHBondContact O-N 2.79Å; D507-L509 PolarHBondContact O-N 2.81Å
510	H	95.1	Very high	91.7	Very high	11 Å²	11	30 Å²	30	5%	0.051	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	161.5	-171.8	70.5	-77.4	0	0	0	112.7	P439 H440 D442 A477 F478 W495 T508	P439-H510 WeakPolarHBondContact CA-O 3.46Å; H440-H510 AromaticContact CE1-CD2 3.72Å; H440-H510 AromaticContact CE1-CE1 3.87Å; H440-H510 AromaticContact CE1-NE2 3.42Å; H440-H510 PolarHBondContact CE1-NE2 2.83Å; H440-H510 PolarHBondContact CE1-O 3.24Å; H440-H510 PolarHBondContact N-O 3.44Å; H440-H510 PolarHBondContact ND1-O 3.39Å; H440-H510 VanDerWaalsContact ND1-O 3.12Å; H440-H510 AromaticContact NE2-CD2 3.97Å; H440-H510 AromaticContact NE2-CE1 3.43Å; H440-H510 PolarHBondContact NE2-CE1 2.97Å; H440-H510 AromaticContact NE2-NE2 3.19Å; H440-H510 PolarHBondContact NE2-NE2 2.69Å; H440-H510 VanDerWaalsContact NE2-NE2 3.19Å; H440-H510 PolarHBondContact O-N 2.77Å; H440-H510 PolarHBondContact O-ND1 2.95Å; D442-H510 IonicContact OD2-CE1 3.19Å; D442-H510 IonicContact OD2-NE2 3.61Å; A477-H510 CarbonylContact O-C 3.56Å; A477-H510 WeakPolarHBondContact O-CA 3.41Å; A477-H510 WeakPolarHBondContact O-CB 3.46Å; F478-H510 HydrophobicContact CD1-CB 3.78Å; F478-H510 HydrophobicContact CE1-CB 3.95Å; F478-H510 HydrophobicContact CG-CB 4.19Å; F478-H510 HydrophobicContact CZ-CB 4.5Å; W495-H510 AromaticContact CZ2-CE1 3.65Å; W495-H510 AromaticContact CZ2-NE2 3.55Å; T508-H510 PolarHBondContact O-N 2.87Å; T508-H510 PolarHBondContact O-ND1 2.9Å
511	A	92.8	Very high	92	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.008	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	151.5	-177.1	0	0	0	0	0	110.5	Y301 Y437 P439 T476 A477	Y301-A511 HydrophobicContact CD2-CB 3.59Å; Y301-A511 HydrophobicContact CE2-CB 3.32Å; Y437-A511 WeakPolarHBondContact O-CA 3.15Å; Y437-A511 VanDerWaalsContact O-CB 3.32Å; Y437-A511 WeakPolarHBondContact O-CB 3.45Å; P439-A511 HydrophobicContact CG-CB 4.25Å; T476-A511 CarbonylContact C-O 3.56Å; T476-A511 WeakPolarHBondContact CA-O 3.4Å; A477-A511 PolarHBondContact N-O 3.33Å; A477-A511 PolarHBondContact O-N 2.92Å
512	G	92.7	Very high	92.4	Very high	4 Å²	4	22.4 Å²	22.4	4%	0.041	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	110.7	167.7	0	0	0	0	0	109.2	Y301 H436 Y437	Y301-G512 PolarHBondContact OH-O 3.38Å; H436-G512 WeakPolarHBondContact CA-O 3.32Å; H436-G512 VanDerWaalsContact CB-O 3.26Å; H436-G512 WeakPolarHBondContact CB-O 3.5Å; Y437-G512 PolarHBondContact N-O 3.34Å; Y437-G512 PolarHBondContact O-N 2.96Å
513	C	93.3	Very high	92.8	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.124	C	C	.	.	P	Polyproline II helix	trans	-56.1	147.5	174.8	-68.7	0	0	0	0	111	C305 G474 A475 V515	C305-C513 WeakPolarHBondContact CA-SG 3.31Å; C305-C513 HydrophobicContact CB-CB 3.75Å; C305-C513 WeakPolarHBondContact CB-SG 3.27Å; C305-C513 VanDerWaalsContact SG-CA 3.52Å; C305-C513 WeakPolarHBondContact SG-CB 3.49Å; C305-C513 CovalentContact SG-SG 2.04Å; C305-C513 PolarHBondContact SG-SG 2.79Å; G474-C513 WeakPolarHBondContact CA-O 3.27Å; A475-C513 HydrophobicContact CB-CB 4.4Å; A475-C513 VanDerWaalsContact O-CB 3.32Å; A475-C513 WeakPolarHBondContact O-CB 3.3Å; A475-C513 PolarHBondContact O-N 2.95Å; C513-V515 PolarHBondContact O-N 2.77Å
514	P	92.8	Very high	93.1	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	10%	0.097	C	C	.	.	P	Polyproline II helix	trans	-61.3	137.9	179.5	-17.6	31.4	0	0	0	110.5	R142 L143 V146 Y147 Y301 G435 H436 G474 L516	R142-P514 HydrophobicContact CG-CG 4.19Å; L143-P514 HydrophobicContact CD2-CB 3.64Å; V146-P514 HydrophobicContact CB-CG 4.13Å; V146-P514 HydrophobicContact CG1-CG 4Å; V146-P514 HydrophobicContact CG2-CG 3.89Å; Y147-P514 HydrophobicContact CE2-CB 4.16Å; Y147-P514 HydrophobicContact CE2-CG 4.38Å; Y147-P514 WeakPolarHBondContact CE2-O 3.5Å; Y147-P514 PolarHBondContact OH-O 3.35Å; Y301-P514 WeakPolarHBondContact OH-CD 3.48Å; G435-P514 WeakPolarHBondContact O-CA 3.39Å; H436-P514 HydrophobicContact CB-CB 4.19Å; H436-P514 HydrophobicContact CB-CG 3.97Å; G474-P514 PolarHBondContact N-O 3.29Å; G474-P514 VanDerWaalsContact N-O 3.08Å; P514-L516 PolarHBondContact O-N 2.83Å
515	V	91.5	Very high	93.3	Very high	6 Å²	6	14 Å²	14	4%	0.036	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	120	174.6	-177.7	0	0	0	0	108.9	G435 V470 C513 G518 K520	G435-V515 PolarHBondContact O-N 2.75Å; V470-V515 HydrophobicContact CG1-CG1 3.94Å; C513-V515 PolarHBondContact O-N 2.77Å; V515-G518 WeakPolarHBondContact CG1-O 3.38Å; V515-K520 HydrophobicContact CG2-CB 3.53Å; V515-K520 HydrophobicContact CG2-CD 3.88Å; V515-K520 HydrophobicContact CG2-CG 4.34Å
516	L	88.8	Confident	93.5	Very high	13 Å²	13	13.9 Å²	13.9	7%	0.068	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	-53.8	173.4	-79.6	164.8	0	0	0	109.7	L143 Y147 L149 F159 L308 A472 P514	L143-L516 HydrophobicContact CD2-CD2 4.03Å; Y147-L516 HydrophobicContact CD1-CD1 3.69Å; Y147-L516 HydrophobicContact CD1-CG 4.3Å; Y147-L516 HydrophobicContact CD2-CD1 3.92Å; Y147-L516 HydrophobicContact CD2-CD2 3.42Å; Y147-L516 VanDerWaalsContact CD2-CD2 3.42Å; Y147-L516 HydrophobicContact CD2-CG 3.6Å; Y147-L516 HydrophobicContact CE1-CD1 3.66Å; Y147-L516 HydrophobicContact CE1-CG 4.16Å; Y147-L516 HydrophobicContact CE2-CD1 3.89Å; Y147-L516 HydrophobicContact CE2-CD2 3.77Å; Y147-L516 HydrophobicContact CE2-CG 3.43Å; Y147-L516 VanDerWaalsContact CE2-CG 3.43Å; Y147-L516 HydrophobicContact CG-CD1 3.8Å; Y147-L516 HydrophobicContact CG-CD2 3.87Å; Y147-L516 HydrophobicContact CG-CG 4.02Å; L149-L516 HydrophobicContact CD1-CD2 3.92Å; F159-L516 HydrophobicContact CD1-CD2 3.88Å; F159-L516 HydrophobicContact CE1-CD2 4.38Å; L308-L516 HydrophobicContact CD2-CD1 4.09Å; A472-L516 HydrophobicContact CB-CB 3.87Å; A472-L516 HydrophobicContact CB-CD1 4.26Å; A472-L516 WeakPolarHBondContact O-CB 3.33Å; A472-L516 PolarHBondContact O-N 3.09Å; P514-L516 PolarHBondContact O-N 2.83Å
517	V	87.9	Confident	93.6	Very high	30 Å²	30	10.8 Å²	10.8	18%	0.182	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	132.6	-178.7	-177.1	0	0	0	0	109.7	F159 Y171 V470 E471 A472	F159-V517 HydrophobicContact CE2-CG2 4.22Å; F159-V517 HydrophobicContact CZ-CG2 4.22Å; Y171-V517 HydrophobicContact CD1-CB 4.37Å; Y171-V517 HydrophobicContact CD1-CG2 3.5Å; Y171-V517 HydrophobicContact CD2-CG2 4.49Å; Y171-V517 HydrophobicContact CE1-CB 4.22Å; Y171-V517 HydrophobicContact CE1-CG1 3.93Å; Y171-V517 HydrophobicContact CE1-CG2 3.62Å; Y171-V517 HydrophobicContact CE2-CG1 4.26Å; Y171-V517 HydrophobicContact CG-CG2 3.96Å; V470-V517 WeakPolarHBondContact CG1-O 2.98Å; E471-V517 HydrophobicContact CB-CB 4.27Å; E471-V517 HydrophobicContact CB-CG1 4.06Å; E471-V517 PolarHBondContact N-O 3.23Å; A472-V517 HydrophobicContact CB-CB 4.22Å; A472-V517 HydrophobicContact CB-CG2 4.48Å; A472-V517 PolarHBondContact N-O 3.07Å; A472-V517 PolarHBondContact O-N 3.44Å; A472-V517 VanDerWaalsContact O-N 3.08Å
518	G	86.4	Confident	93.7	Very high	18 Å²	18	8.1 Å²	8.1	19%	0.186	5%	0.048	C	C	.	.	E	Extended strand (participates in β ladder)	trans	118.8	177.3	178.9	0	0	0	0	0	113.5	L34 E471 V515	L34-G518 WeakPolarHBondContact CD1-O 3.34Å; E471-G518 WeakPolarHBondContact OE2-CA 3.3Å; E471-G518 PolarHBondContact OE2-N 3.39Å; V515-G518 WeakPolarHBondContact CG1-O 3.38Å
519	D	87.4	Confident	93.5	Very high	45 Å²	45	10.8 Å²	10.8	24%	0.241	6%	0.061	C	C	.	.			trans	-112.4	105.2	179.1	179.6	26.7	0	0	0	109.2	L34 N430 S468 W521	L34-D519 HydrophobicContact CD1-CB 4.38Å; N430-D519 PolarHBondContact ND2-OD1 3.36Å; S468-D519 VanDerWaalsContact CB-O 3.23Å; S468-D519 WeakPolarHBondContact CB-O 3.27Å; S468-D519 PolarHBondContact OG-O 3.4Å; D519-W521 VanDerWaalsContact CG-CD1 3.48Å; D519-W521 PolarHBondContact OD1-NE1 3.22Å; D519-W521 VanDerWaalsContact OD2-CD1 3.23Å; D519-W521 PolarHBondContact OD2-NE1 3.38Å
520	K	92.4	Very high	93.4	Very high	1 Å²	1	15.6 Å²	15.6	0%	0.004	8%	0.079	C	C	.	.			trans	-89.5	121.6	-178.5	-172	179.2	172.9	-179.1	0	110.6	N430 Y431 V470 G474 V487 V515 V522	N430-K520 PolarHBondContact ND2-O 3.2Å; Y431-K520 HydrophobicContact CD2-CB 3.81Å; Y431-K520 HydrophobicContact CD2-CD 3.67Å; Y431-K520 HydrophobicContact CD2-CG 3.64Å; Y431-K520 WeakPolarHBondContact CD2-O 3.45Å; Y431-K520 HydrophobicContact CE2-CD 3.79Å; Y431-K520 HydrophobicContact CE2-CG 4Å; Y431-K520 HydrophobicContact CG-CB 4.34Å; Y431-K520 HydrophobicContact CG-CD 4.26Å; Y431-K520 HydrophobicContact CG-CG 4.48Å; Y431-K520 PolarHBondContact N-O 3.47Å; Y431-K520 VanDerWaalsContact N-O 3.09Å; V470-K520 HydrophobicContact CG2-CB 3.57Å; V470-K520 HydrophobicContact CG2-CG 3.94Å; G474-K520 WeakPolarHBondContact O-CE 3.17Å; G474-K520 PolarHBondContact O-NZ 2.7Å; V487-K520 HydrophobicContact CG2-CD 4.33Å; V515-K520 HydrophobicContact CG2-CB 3.53Å; V515-K520 HydrophobicContact CG2-CD 3.88Å; V515-K520 HydrophobicContact CG2-CG 4.34Å; K520-V522 HydrophobicContact CG-CG1 4.37Å
521	W	95.4	Very high	93.2	Very high	5 Å²	5	15.9 Å²	15.9	2%	0.019	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.9	169.9	-71.9	80.1	0	0	0	110.2	T35 R364 A367 L371 V428 V429 N430 L467 S468 D519	T35-W521 HydrophobicContact CG2-CH2 4.19Å; T35-W521 HydrophobicContact CG2-CZ2 3.36Å; R364-W521 HydrophobicContact CB-CD2 4.45Å; R364-W521 HydrophobicContact CB-CE3 4.3Å; R364-W521 HydrophobicContact CB-CH2 4.24Å; R364-W521 HydrophobicContact CB-CZ2 4.41Å; R364-W521 HydrophobicContact CB-CZ3 4.21Å; R364-W521 VanDerWaalsContact CD-CG 3.44Å; R364-W521 HydrophobicContact CG-CB 4.29Å; R364-W521 HydrophobicContact CG-CD2 3.71Å; R364-W521 HydrophobicContact CG-CE3 3.73Å; R364-W521 HydrophobicContact CG-CG 4.01Å; R364-W521 HydrophobicContact CG-CH2 4.5Å; R364-W521 HydrophobicContact CG-CZ2 4.5Å; R364-W521 HydrophobicContact CG-CZ3 4.16Å; A367-W521 HydrophobicContact CB-CZ3 4.3Å; L371-W521 HydrophobicContact CD1-CH2 3.65Å; L371-W521 HydrophobicContact CD1-CZ3 4.02Å; L371-W521 HydrophobicContact CD2-CZ3 4.39Å; V428-W521 HydrophobicContact CG1-CE3 3.7Å; V428-W521 HydrophobicContact CG1-CZ3 3.85Å; V429-W521 VanDerWaalsContact O-CA 3.31Å; V429-W521 WeakPolarHBondContact O-CA 3.44Å; N430-W521 HydrophobicContact CB-CD2 3.84Å; N430-W521 HydrophobicContact CB-CE3 3.86Å; N430-W521 HydrophobicContact CB-CH2 4.1Å; N430-W521 HydrophobicContact CB-CZ2 4.05Å; N430-W521 HydrophobicContact CB-CZ3 3.97Å; N430-W521 VanDerWaalsContact ND2-CE2 3.29Å; N430-W521 PolarHBondContact ND2-NE1 3.42Å; L467-W521 HydrophobicContact CB-CB 3.77Å; L467-W521 HydrophobicContact CD1-CB 4.32Å; L467-W521 PolarHBondContact N-O 3.14Å; S468-W521 PolarHBondContact OG-N 3.16Å; D519-W521 VanDerWaalsContact CG-CD1 3.48Å; D519-W521 PolarHBondContact OD1-NE1 3.22Å; D519-W521 VanDerWaalsContact OD2-CD1 3.23Å; D519-W521 PolarHBondContact OD2-NE1 3.38Å
522	V	96.8	Very high	93.2	Very high	0 Å²	0	16 Å²	16	0%	0	9%	0.085	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	151.7	174.3	-58.6	0	0	0	0	110.9	V428 V429 Y431 M464 I465 Y466 K520	V428-V522 CarbonylContact C-O 3.42Å; V428-V522 WeakPolarHBondContact CA-O 3.41Å; V429-V522 HydrophobicContact CB-CG2 3.8Å; V429-V522 HydrophobicContact CG2-CG2 4.24Å; V429-V522 PolarHBondContact N-O 3.24Å; V429-V522 PolarHBondContact O-N 2.71Å; Y431-V522 HydrophobicContact CE2-CG1 4.33Å; Y431-V522 HydrophobicContact CE2-CG2 3.85Å; M464-V522 HydrophobicContact CG-CB 4.1Å; M464-V522 HydrophobicContact CG-CG1 4.44Å; M464-V522 HydrophobicContact SD-CB 4.22Å; M464-V522 HydrophobicContact SD-CG1 4.18Å; M464-V522 HydrophobicContact SD-CG2 4.46Å; I465-V522 CarbonylContact O-C 3.59Å; I465-V522 WeakPolarHBondContact O-CA 3.4Å; Y466-V522 HydrophobicContact CD1-CG1 3.8Å; Y466-V522 HydrophobicContact CE1-CG1 4.17Å; K520-V522 HydrophobicContact CG-CG1 4.37Å
523	A	97.7	Very high	93.1	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	117.9	170.1	0	0	0	0	0	109.8	L426 Q427 V428 M464 I465 L467	L426-A523 HydrophobicContact CD1-CB 3.79Å; L426-A523 HydrophobicContact CD2-CB 4.1Å; L426-A523 HydrophobicContact CG-CB 3.98Å; Q427-A523 CarbonylContact O-C 3.59Å; Q427-A523 VanDerWaalsContact O-CA 3.25Å; Q427-A523 WeakPolarHBondContact O-CA 3.38Å; V428-A523 HydrophobicContact CG2-CB 4.44Å; M464-A523 CarbonylContact C-O 3.49Å; M464-A523 WeakPolarHBondContact CA-O 3.46Å; I465-A523 HydrophobicContact CB-CB 4.19Å; I465-A523 PolarHBondContact N-O 3.13Å; I465-A523 PolarHBondContact O-N 2.89Å; L467-A523 HydrophobicContact CD1-CB 4Å; L467-A523 HydrophobicContact CD2-CB 4.24Å; L467-A523 HydrophobicContact CG-CB 4.2Å
524	N	97.3	Very high	92.9	Very high	14 Å²	14	30.4 Å²	30.4	8%	0.075	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	131.1	177	-67.5	-34.2	0	0	0	110.6	Q427 M464 W526	Q427-N524 HydrophobicContact CB-CB 4.35Å; Q427-N524 PolarHBondContact N-O 2.94Å; Q427-N524 PolarHBondContact O-N 3.25Å; M464-N524 WeakPolarHBondContact CB-OD1 3Å; M464-N524 WeakPolarHBondContact CG-OD1 3.31Å; N524-W526 HydrophobicContact CB-CD2 4.47Å; N524-W526 HydrophobicContact CB-CZ2 4.28Å
525	K	97.9	Very high	92.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	106.3	166.1	-175	74.4	172.1	-179.5	0	107.8	N407 I410 V418 E424 L426 F463	N407-K525 VanDerWaalsContact OD1-CE 3.22Å; N407-K525 WeakPolarHBondContact OD1-CE 3.12Å; N407-K525 PolarHBondContact OD1-NZ 3.22Å; I410-K525 HydrophobicContact CD1-CB 4.19Å; I410-K525 HydrophobicContact CD1-CG 4.1Å; V418-K525 WeakPolarHBondContact O-CE 3.44Å; V418-K525 PolarHBondContact O-NZ 2.91Å; V418-K525 VanDerWaalsContact O-NZ 3.13Å; E424-K525 WeakPolarHBondContact O-CD 3.5Å; E424-K525 WeakPolarHBondContact O-CE 3.16Å; E424-K525 PolarHBondContact O-NZ 3.07Å; L426-K525 HydrophobicContact CD1-CB 4.29Å; F463-K525 HydrophobicContact CB-CB 4.3Å; F463-K525 PolarHBondContact N-O 3.41Å; F463-K525 PolarHBondContact O-N 3.1Å
526	W	97.6	Very high	92.8	Very high	10 Å²	10	38.3 Å²	38.3	4%	0.038	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	126.5	174.8	-67.2	-56.9	0	0	0	110.3	W394 A423 E424 Q427 D442 R459 T462 N524	W394-W526 AromaticContact CH2-CE3 3.95Å; W394-W526 HydrophobicContact CH2-CE3 3.95Å; W394-W526 AromaticContact CH2-CZ3 3.51Å; W394-W526 HydrophobicContact CH2-CZ3 3.51Å; W394-W526 HydrophobicContact CZ2-CZ3 4.2Å; W394-W526 HydrophobicContact CZ3-CE3 4.29Å; W394-W526 HydrophobicContact CZ3-CZ3 4.17Å; A423-W526 CarbonylContact C-O 3.4Å; A423-W526 VanDerWaalsContact CA-O 3.29Å; A423-W526 WeakPolarHBondContact CA-O 3.18Å; A423-W526 VanDerWaalsContact CB-O 3.3Å; A423-W526 WeakPolarHBondContact CB-O 3.25Å; E424-W526 HydrophobicContact CB-CB 4.4Å; E424-W526 HydrophobicContact CG-CB 4.16Å; E424-W526 PolarHBondContact N-O 3.41Å; E424-W526 VanDerWaalsContact OE2-CE3 3.24Å; Q427-W526 HydrophobicContact CB-CZ3 4.24Å; Q427-W526 VanDerWaalsContact OE1-CH2 3.23Å; D442-W526 PolarHBondContact OD1-NE1 3.21Å; D442-W526 VanDerWaalsContact OD1-NE1 3.13Å; D442-W526 PolarHBondContact OD2-NE1 3.04Å; R459-W526 HydrophobicContact CG-CB 4.04Å; R459-W526 HydrophobicContact CG-CG 4.48Å; R459-W526 VanDerWaalsContact CZ-CE3 3.44Å; T462-W526 VanDerWaalsContact OG1-CD1 3.28Å; N524-W526 HydrophobicContact CB-CD2 4.47Å; N524-W526 HydrophobicContact CB-CZ2 4.28Å
527	I	97.5	Very high	92.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	133.6	-177.9	-53.8	168.6	0	0	0	107.4	L416 V418 A423 R459 V460 A461	L416-I527 HydrophobicContact CB-CD1 4.28Å; L416-I527 HydrophobicContact CB-CG2 4.11Å; L416-I527 HydrophobicContact CD1-CB 4.42Å; L416-I527 HydrophobicContact CD1-CD1 3.65Å; L416-I527 HydrophobicContact CD1-CG2 4.01Å; V418-I527 HydrophobicContact CG1-CD1 3.71Å; V418-I527 HydrophobicContact CG1-CG1 3.98Å; A423-I527 HydrophobicContact CB-CG1 4.29Å; R459-I527 CarbonylContact C-O 3.46Å; R459-I527 VanDerWaalsContact CA-O 3.31Å; R459-I527 WeakPolarHBondContact CA-O 3.14Å; V460-I527 HydrophobicContact CG1-CB 4.36Å; V460-I527 HydrophobicContact CG1-CG2 4.13Å; V460-I527 WeakPolarHBondContact CG1-O 3.32Å; V460-I527 PolarHBondContact N-O 2.78Å; A461-I527 PolarHBondContact N-O 3.3Å; A461-I527 PolarHBondContact O-N 3.13Å
528	H	95.4	Very high	92.5	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	158.6	-179.3	-66.2	-86.8	0	0	0	112.2	Y422 E424 S456 G457 N458 Q532	Y422-H528 WeakPolarHBondContact O-CB 3.11Å; Y422-H528 PolarHBondContact O-N 3.08Å; E424-H528 VanDerWaalsContact CG-NE2 3.27Å; E424-H528 WeakPolarHBondContact CG-NE2 3.25Å; E424-H528 IonicContact OE1-CE1 3.71Å; E424-H528 IonicContact OE1-NE2 3.29Å; S456-H528 VanDerWaalsContact O-CB 3.25Å; S456-H528 WeakPolarHBondContact O-CB 3.38Å; S456-H528 PolarHBondContact OG-CE1 3.09Å; S456-H528 VanDerWaalsContact OG-CE1 3.24Å; S456-H528 PolarHBondContact OG-ND1 3.17Å; S456-H528 PolarHBondContact OG-NE2 2.99Å; G457-H528 PolarHBondContact O-ND1 3.31Å; G457-H528 VanDerWaalsContact O-ND1 3.07Å; N458-H528 CarbonylContact O-C 3.47Å; N458-H528 VanDerWaalsContact O-CA 3.3Å; N458-H528 WeakPolarHBondContact O-CA 3.32Å; H528-Q532 WeakPolarHBondContact O-CG 3.5Å
529	E	92	Very high	92.3	Very high	55 Å²	55	45.3 Å²	45.3	26%	0.257	22%	0.223	S	C	.	.	S	Bend	trans	-67.4	-34.4	179.5	63.7	-179.6	159.4	0	0	113.7	G457 N458 V460 Q532	G457-E529 WeakPolarHBondContact CA-OE1 3.25Å; N458-E529 PolarHBondContact N-OE1 2.71Å; N458-E529 PolarHBondContact O-N 3.29Å; V460-E529 HydrophobicContact CB-CB 4.24Å; E529-Q532 WeakPolarHBondContact O-CB 3.11Å; E529-Q532 WeakPolarHBondContact O-CG 3.41Å; E529-Q532 PolarHBondContact O-N 3.13Å
530	Y	92.4	Very high	91.9	Very high	114 Å²	114	49.3 Å²	49.3	45%	0.447	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	142.4	178.5	-65.7	-3.8	0	0	0	110.5	Y422 K455 S456 Q532	Y422-Y530 WeakPolarHBondContact CD1-O 3.43Å; K455-Y530 VanDerWaalsContact O-CD2 3.28Å; K455-Y530 WeakPolarHBondContact O-CD2 3.43Å; K455-Y530 WeakPolarHBondContact O-CE2 3.5Å; S456-Y530 VanDerWaalsContact O-CB 3.25Å; S456-Y530 WeakPolarHBondContact O-CB 3.35Å; S456-Y530 VanDerWaalsContact O-CG 3.23Å; S456-Y530 PolarHBondContact O-N 3.38Å; Y530-Q532 VanDerWaalsContact C-N 3.26Å
531	G	90.6	Very high	91.3	Very high	17 Å²	17	51.2 Å²	51.2	18%	0.175	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	83	-1.2	-172.9	0	0	0	0	0	114	E533	G531-E533 WeakPolarHBondContact CA-OE2 3.32Å; G531-E533 VanDerWaalsContact N-CD 3.35Å; G531-E533 PolarHBondContact N-OE1 3.21Å; G531-E533 PolarHBondContact N-OE2 3.27Å; G531-E533 VanDerWaalsContact N-OE2 3.1Å
532	Q	94.4	Very high	90.1	Very high	4 Å²	4	56.4 Å²	56.4	2%	0.019	30%	0.303	C	S	.	.			trans	-107.2	3.4	178.7	-42.2	-51.9	-33.5	0	0	113.4	L416 D417 V460 H528 E529 Y530 F534 R535 R536	L416-Q532 HydrophobicContact CD2-CB 4.34Å; L416-Q532 HydrophobicContact CD2-CG 4.22Å; D417-Q532 PolarHBondContact O-NE2 2.97Å; V460-Q532 HydrophobicContact CG1-CG 4.4Å; H528-Q532 WeakPolarHBondContact O-CG 3.5Å; E529-Q532 WeakPolarHBondContact O-CB 3.11Å; E529-Q532 WeakPolarHBondContact O-CG 3.41Å; E529-Q532 PolarHBondContact O-N 3.13Å; Y530-Q532 VanDerWaalsContact C-N 3.26Å; Q532-F534 PolarHBondContact O-N 3.48Å; Q532-F534 VanDerWaalsContact O-N 3.13Å; Q532-R535 PolarHBondContact O-N 2.9Å; Q532-R536 PolarHBondContact O-N 3.41Å
533	E	89	Confident	88.5	Confident	104 Å²	104	64.6 Å²	64.6	49%	0.486	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-38	-169.3	-56.5	81	-179.4	0	0	112.3	G531	G531-E533 WeakPolarHBondContact CA-OE2 3.32Å; G531-E533 VanDerWaalsContact N-CD 3.35Å; G531-E533 PolarHBondContact N-OE1 3.21Å; G531-E533 PolarHBondContact N-OE2 3.27Å; G531-E533 VanDerWaalsContact N-OE2 3.1Å
534	F	90.3	Very high	86.7	Confident	202 Å²	202	68.8 Å²	68.8	89%	0.886	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-5.4	178.2	-56.5	-65.2	0	0	0	113.8	Q532	Q532-F534 PolarHBondContact O-N 3.48Å; Q532-F534 VanDerWaalsContact O-N 3.13Å
535	R	90.9	Very high	86.2	Confident	137 Å²	137	71.6 Å²	71.6	52%	0.517	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-34.5	-179.2	-64.4	174.9	172	-80.6	-2.6	111.6	G415 Q532	G415-R535 WeakPolarHBondContact O-CD 3.17Å; G415-R535 PolarHBondContact O-NH1 3.29Å; Q532-R535 PolarHBondContact O-N 2.9Å
536	R	90.4	Very high	85.5	Confident	35 Å²	35	75.3 Å²	75.3	13%	0.132	40%	0.398	C	S	.	.	S	Bend	trans	-130.4	76.9	177.3	-170.1	-175.1	-167.8	-133.1	2.2	108.7	L416 W496 L498 H499 Q532	L416-R536 HydrophobicContact CD2-CB 4.49Å; W496-R536 VanDerWaalsContact CE3-CZ 3.42Å; W496-R536 VanDerWaalsContact CE3-NE 3.33Å; L498-R536 PolarHBondContact O-NH1 3.48Å; L498-R536 PolarHBondContact O-NH2 3.14Å; H499-R536 PolarHBondContact O-NH1 3.43Å; Q532-R536 PolarHBondContact O-N 3.41Å
537	P	87.5	Confident	84.9	Confident	75 Å²	75	78.9 Å²	78.9	49%	0.487	42%	0.418	S	S	.	.	P	Polyproline II helix	trans	-63.4	146.8	179.3	26.4	-34.1	0	0	0	111	R500	R500-P537 PolarHBondContact NH1-O 2.87Å
538	C	84.1	Confident	84.1	Confident	97 Å²	97	83.6 Å²	83.6	66%	0.655	44%	0.442	S	S	*	.	P	Polyproline II helix	trans	-57.9	148.5	171.4	-62.1	0	0	0	0	110.6	R500	R500-C538 PolarHBondContact O-SG 3.43Å
539	S	81.4	Confident	83.4	Confident	36 Å²	36	88.8 Å²	88.8	25%	0.252	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-71.4	159	170.3	-172.1	0	0	0	0	110.3	S541 D544	S539-S541 PolarHBondContact OG-N 3.36Å; S539-S541 VanDerWaalsContact OG-N 3.14Å; S539-D544 WeakPolarHBondContact CB-OD2 3.45Å; S539-D544 WeakPolarHBondContact OG-CB 3.44Å; S539-D544 PolarHBondContact OG-OD2 3.03Å
540	S	80	Confident	82.9	Confident	129 Å²	129	91.1 Å²	91.1	90%	0.902	48%	0.484	S	S	*	.	S	Bend	trans	-73.9	-16.4	165.4	52.1	0	0	0	0	112.5
541	S	79.4	Confident	82.2	Confident	41 Å²	41	89.4 Å²	89.4	29%	0.287	49%	0.487	S	S	.	.	S	Bend	trans	-83.9	128.3	172	-177.9	0	0	0	0	109.8	S539 E543 D544	S539-S541 PolarHBondContact OG-N 3.36Å; S539-S541 VanDerWaalsContact OG-N 3.14Å; S541-E543 PolarHBondContact O-N 3.37Å; S541-E543 PolarHBondContact OG-N 3.23Å; S541-D544 WeakPolarHBondContact CB-OD2 3.28Å; S541-D544 PolarHBondContact O-N 3.21Å
542	P	68.6	Low	81.5	Confident	114 Å²	114	95 Å²	95	74%	0.74	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.5	174.1	-20.2	32.3	0	0	0	114.1
543	E	63.7	Low	80.5	Confident	172 Å²	172	102.6 Å²	102.6	80%	0.804	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	-9.5	-176.5	-61.9	179.9	178.2	0	0	113.2	S541	S541-E543 PolarHBondContact O-N 3.37Å; S541-E543 PolarHBondContact OG-N 3.23Å
544	D	60.2	Low	79.7	Confident	89 Å²	89	102.5 Å²	102.5	48%	0.476	56%	0.558	S	S	.	*			trans	-90.6	0	-176.2	-87.9	-10	0	0	0	114.2	H499 R500 S501 S539 S541	H499-D544 WeakPolarHBondContact CB-OXT 3.25Å; R500-D544 CarbonylContact C-O 3.34Å; R500-D544 WeakPolarHBondContact CA-O 3.18Å; R500-D544 WeakPolarHBondContact CB-O 3.24Å; R500-D544 VanDerWaalsContact N-C 3.31Å; R500-D544 PolarHBondContact N-O 2.98Å; R500-D544 VanDerWaalsContact N-O 3.09Å; R500-D544 PolarHBondContact N-OXT 2.93Å; S501-D544 PolarHBondContact N-O 3.3Å; S539-D544 WeakPolarHBondContact CB-OD2 3.45Å; S539-D544 WeakPolarHBondContact OG-CB 3.44Å; S539-D544 PolarHBondContact OG-OD2 3.03Å; S541-D544 WeakPolarHBondContact CB-OD2 3.28Å; S541-D544 PolarHBondContact O-N 3.21Å

Retrieved 544 of 544 residues in 223.4 ms (Link to these results)

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