A0A087XRY4_POEFO Loading...

ATP-dependent RNA helicase

ATP-binding RNA helicase involved in the biogenesis of 60S ribosomal subunits. RNA helicase.

AlphaFold DB , UniProt , Accession A0A087XRY4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 660 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	30.1	Very low	31.5	Very low	216 Å²	216	115.1 Å²	115.1	100%	1.064	60%	0.6	S	S	*	*				0	-21.7	0	-76.6	-57.6	-172	0	0	115.8
2	S	31.8	Very low	31.5	Very low	86 Å²	86	120 Å²	120	60%	0.601	63%	0.628	S	S	*	*			trans	-128.7	95.1	178.4	-170	0	0	0	0	113.1
3	L	34.4	Very low	32.2	Very low	58 Å²	58	120.6 Å²	120.6	30%	0.304	63%	0.632	S	S	.	*	S	Bend	trans	-114.1	-14.2	176.4	-69.4	163.6	0	0	0	113	R515 L646 A650	L3-R515 PolarHBondContact O-NH1 2.7Å; L3-L646 HydrophobicContact CD1-CB 4.37Å; L3-L646 HydrophobicContact CD1-CD2 4.29Å; L3-L646 WeakPolarHBondContact CD1-O 3.37Å; L3-A650 HydrophobicContact CD1-CB 3.96Å; L3-A650 HydrophobicContact CD2-CB 3.73Å
4	F	36	Very low	32.3	Very low	25 Å²	25	125.3 Å²	125.3	11%	0.11	65%	0.649	C	S	.	*			trans	-105.7	28.2	178.5	-70.8	-72.8	0	0	0	113.1	V6 P488 R515 L519 L646	F4-V6 PolarHBondContact O-N 3.27Å; F4-P488 HydrophobicContact CE2-CG 3.87Å; F4-P488 HydrophobicContact CZ-CG 3.93Å; F4-R515 HydrophobicContact CE1-CB 4.14Å; F4-L519 HydrophobicContact CE2-CD1 3.94Å; F4-L519 HydrophobicContact CZ-CD1 3.66Å; F4-L646 HydrophobicContact CE2-CD2 3.89Å
5	L	31.1	Very low	32.4	Very low	111 Å²	111	127.9 Å²	127.9	58%	0.581	66%	0.664	S	S	*	*			trans	-62.8	120.9	166.8	-150.7	81.7	0	0	0	108.9	R515	L5-R515 PolarHBondContact O-NH1 3.38Å
6	V	30.2	Very low	32.2	Very low	56 Å²	56	122.3 Å²	122.3	34%	0.339	65%	0.648	S	S	.	*			trans	-102.7	113.9	169.5	177.4	0	0	0	0	106.2	F4 R8 T512	F4-V6 PolarHBondContact O-N 3.27Å; V6-R8 HydrophobicContact CG1-CG 4.29Å; V6-R8 PolarHBondContact O-N 2.96Å; V6-T512 HydrophobicContact CG2-CG2 3.6Å
7	N	27.3	Very low	32.6	Very low	145 Å²	145	123.5 Å²	123.5	78%	0.775	66%	0.661	S	S	*	*			trans	-67.1	87.8	170.2	-71.1	26.9	0	0	0	108.5
8	R	30.1	Very low	33	Very low	127 Å²	127	126.4 Å²	126.4	48%	0.479	67%	0.674	S	S	.	*			trans	-73	133.8	159.9	-65.5	-177.1	176.8	-179.7	0.5	106.8	V6 L10	V6-R8 HydrophobicContact CG1-CG 4.29Å; V6-R8 PolarHBondContact O-N 2.96Å; R8-L10 HydrophobicContact CB-CD1 4.27Å; R8-L10 HydrophobicContact CB-CG 4.07Å; R8-L10 PolarHBondContact O-N 3.24Å
9	Y	32.5	Very low	33.5	Very low	243 Å²	243	123.5 Å²	123.5	95%	0.953	67%	0.665	S	S	*	*			trans	-67.1	89.3	154.4	-93.9	-91.2	0	0	0	107.6
10	L	29.6	Very low	33.8	Very low	129 Å²	129	123.8 Å²	123.8	68%	0.675	66%	0.66	S	S	*	*			trans	-109.9	144.6	153.7	-66.5	169.8	0	0	0	105.1	R8	R8-L10 HydrophobicContact CB-CD1 4.27Å; R8-L10 HydrophobicContact CB-CG 4.07Å; R8-L10 PolarHBondContact O-N 3.24Å
11	G	33.7	Very low	34.4	Very low	70 Å²	70	122.8 Å²	122.8	72%	0.722	66%	0.658	S	S	*	*			trans	-66.8	153.2	174.5	0	0	0	0	0	110.8	D13	G11-D13 PolarHBondContact O-N 3.07Å
12	D	31.3	Very low	35.5	Very low	174 Å²	174	116.5 Å²	116.5	93%	0.93	64%	0.635	S	S	*	*			trans	-66.6	103.8	-179.9	-52.5	-68.4	0	0	0	110.8
13	D	40.9	Very low	36.3	Very low	128 Å²	128	118.6 Å²	118.6	68%	0.684	64%	0.635	S	S	*	*			trans	-146.5	66.4	175.5	-112.7	-44.7	0	0	0	109.1	G11 K20	G11-D13 PolarHBondContact O-N 3.07Å; D13-K20 IonicContact OD1-NZ 3.08Å; D13-K20 PolarHBondContact OD1-NZ 2.69Å
14	E	33.8	Very low	37.3	Very low	186 Å²	186	118.7 Å²	118.7	87%	0.869	64%	0.64	S	S	*	*			trans	-123.9	133.9	158.6	-76	-169.3	158.8	0	0	110.1
15	D	32.7	Very low	38.7	Very low	164 Å²	164	123.1 Å²	123.1	88%	0.877	66%	0.662	S	S	*	*	S	Bend	trans	47.3	101.8	162.1	-59.1	-15.3	0	0	0	120.6
16	G	30	Very low	40.5	Very low	39 Å²	39	119.8 Å²	119.8	40%	0.402	65%	0.65	S	S	.	*			trans	167.8	68.8	168.6	0	0	0	0	0	115.2	I18	G16-I18 PolarHBondContact O-N 3.12Å; G16-I18 VanDerWaalsContact O-N 3.08Å
17	V	38.4	Very low	42.1	Very low	143 Å²	143	121.5 Å²	121.5	87%	0.867	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-16.2	-175	177.6	0	0	0	0	113.9
18	I	39.3	Very low	44.1	Very low	176 Å²	176	119.3 Å²	119.3	90%	0.903	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-11.5	-171.2	-64.2	175.6	0	0	0	113.8	G16	G16-I18 PolarHBondContact O-N 3.12Å; G16-I18 VanDerWaalsContact O-N 3.08Å
19	S	43.4	Very low	46.2	Very low	70 Å²	70	116.5 Å²	116.5	49%	0.49	64%	0.642	S	S	.	*	S	Bend	trans	-105.4	-11.1	-170.9	68.1	0	0	0	0	116.8	V21 S22 H23	S19-V21 VanDerWaalsContact C-N 3.27Å; S19-V21 PolarHBondContact O-N 3.17Å; S19-V21 VanDerWaalsContact O-N 3.09Å; S19-S22 PolarHBondContact O-N 3.17Å; S19-H23 PolarHBondContact O-N 2.86Å
20	K	39.4	Very low	48.4	Very low	130 Å²	130	111.7 Å²	111.7	57%	0.565	63%	0.626	S	S	*	*	H	α-helix	trans	-61.6	-25.2	-165.4	-65.3	-159.9	170.3	-159.1	0	115.1	D13 S24	D13-K20 IonicContact OD1-NZ 3.08Å; D13-K20 PolarHBondContact OD1-NZ 2.69Å; K20-S24 WeakPolarHBondContact O-CB 3.42Å; K20-S24 PolarHBondContact O-N 2.89Å; K20-S24 PolarHBondContact O-OG 2.83Å
21	V	46.9	Very low	50.4	Low	103 Å²	103	110.2 Å²	110.2	62%	0.624	62%	0.618	S	S	*	*	H	α-helix	trans	-71	-43.2	174.6	-176.8	0	0	0	0	112	S19 S24 Q25	S19-V21 VanDerWaalsContact C-N 3.27Å; S19-V21 PolarHBondContact O-N 3.17Å; S19-V21 VanDerWaalsContact O-N 3.09Å; V21-S24 PolarHBondContact O-OG 2.95Å; V21-Q25 WeakPolarHBondContact O-CG 3.35Å; V21-Q25 PolarHBondContact O-N 3.48Å
22	S	52.3	Low	52.6	Low	83 Å²	83	112.6 Å²	112.6	58%	0.58	61%	0.61	S	S	*	*	H	α-helix	trans	-68	-43.8	179.6	178.2	0	0	0	0	111.5	S19 S24 Q25 A26	S19-S22 PolarHBondContact O-N 3.17Å; S22-S24 PolarHBondContact O-N 3.45Å; S22-Q25 PolarHBondContact O-N 3.18Å; S22-A26 WeakPolarHBondContact O-CB 3.26Å; S22-A26 PolarHBondContact O-N 2.84Å
23	H	48.3	Very low	54.8	Low	131 Å²	131	110.7 Å²	110.7	61%	0.606	60%	0.596	S	S	*	*	H	α-helix	trans	-66.8	-38.1	-177.4	-162.6	56.6	0	0	0	112.8	S19 A26 L27	S19-H23 PolarHBondContact O-N 2.86Å; H23-A26 PolarHBondContact O-N 2.76Å; H23-L27 PolarHBondContact O-N 3.35Å
24	S	56.3	Low	56.6	Low	59 Å²	59	111.3 Å²	111.3	41%	0.413	59%	0.592	S	S	.	*	H	α-helix	trans	-67.3	-39	176.5	50.6	0	0	0	0	112.9	K20 V21 S22 L27 L28	K20-S24 WeakPolarHBondContact O-CB 3.42Å; K20-S24 PolarHBondContact O-N 2.89Å; K20-S24 PolarHBondContact O-OG 2.83Å; V21-S24 PolarHBondContact O-OG 2.95Å; S22-S24 PolarHBondContact O-N 3.45Å; S24-L27 PolarHBondContact O-N 3.04Å; S24-L28 PolarHBondContact O-N 3.26Å
25	Q	65.4	Low	58.9	Low	119 Å²	119	106.4 Å²	106.4	56%	0.556	58%	0.575	S	S	*	*	H	α-helix	trans	-64.7	-39.7	172.7	-70.2	175.5	-4.3	0	0	112.4	V21 S22 L27 L28 T29	V21-Q25 WeakPolarHBondContact O-CG 3.35Å; V21-Q25 PolarHBondContact O-N 3.48Å; S22-Q25 PolarHBondContact O-N 3.18Å; Q25-L27 VanDerWaalsContact C-N 3.27Å; Q25-L27 PolarHBondContact O-N 3Å; Q25-L28 PolarHBondContact O-N 2.85Å; Q25-T29 PolarHBondContact O-N 3.11Å; Q25-T29 PolarHBondContact O-OG1 2.86Å
26	A	69.2	Low	61.1	Low	41 Å²	41	105.6 Å²	105.6	34%	0.339	56%	0.563	S	S	.	*	H	α-helix	trans	-65.8	-27.9	174.1	0	0	0	0	0	113.2	S22 H23 T29 K30	S22-A26 WeakPolarHBondContact O-CB 3.26Å; S22-A26 PolarHBondContact O-N 2.84Å; H23-A26 PolarHBondContact O-N 2.76Å; A26-T29 WeakPolarHBondContact CA-OG1 3.44Å; A26-T29 PolarHBondContact O-OG1 2.81Å; A26-K30 WeakPolarHBondContact O-CG 3.08Å; A26-K30 PolarHBondContact O-N 2.86Å
27	L	62.8	Low	63.5	Low	91 Å²	91	109.6 Å²	109.6	48%	0.476	57%	0.572	S	S	.	*	H	α-helix	trans	-79.2	-42.8	176.6	-131.5	160.3	0	0	0	111.4	H23 S24 Q25 K30 L31	H23-L27 PolarHBondContact O-N 3.35Å; S24-L27 PolarHBondContact O-N 3.04Å; Q25-L27 VanDerWaalsContact C-N 3.27Å; Q25-L27 PolarHBondContact O-N 3Å; L27-K30 PolarHBondContact O-N 3.17Å; L27-L31 HydrophobicContact CD2-CD1 4.02Å; L27-L31 HydrophobicContact CD2-CG 4.37Å; L27-L31 WeakPolarHBondContact O-CG 3.49Å; L27-L31 PolarHBondContact O-N 3.36Å
28	L	70.6	Confident	65.3	Low	99 Å²	99	110.1 Å²	110.1	52%	0.518	56%	0.562	S	S	.	*	H	α-helix	trans	-59.7	-46.1	174.1	-81.3	165.7	0	0	0	112.5	S24 Q25 L31 Q32	S24-L28 PolarHBondContact O-N 3.26Å; Q25-L28 PolarHBondContact O-N 2.85Å; L28-L31 PolarHBondContact O-N 3.39Å; L28-Q32 WeakPolarHBondContact O-CG 3.45Å; L28-Q32 PolarHBondContact O-N 2.87Å
29	T	73.6	Confident	67.1	Low	69 Å²	69	106.8 Å²	106.8	42%	0.423	54%	0.543	S	S	.	.	H	α-helix	trans	-63.7	-41.5	178.1	44.9	0	0	0	0	112.3	Q25 A26 L31 Q32 Q33	Q25-T29 PolarHBondContact O-N 3.11Å; Q25-T29 PolarHBondContact O-OG1 2.86Å; A26-T29 WeakPolarHBondContact CA-OG1 3.44Å; A26-T29 PolarHBondContact O-OG1 2.81Å; T29-L31 VanDerWaalsContact C-N 3.34Å; T29-L31 PolarHBondContact O-N 2.8Å; T29-Q32 PolarHBondContact O-N 2.97Å; T29-Q33 WeakPolarHBondContact O-CG 3.27Å; T29-Q33 PolarHBondContact O-N 3.26Å
30	K	77.5	Confident	68.5	Low	142 Å²	142	113 Å²	113	62%	0.617	56%	0.556	S	S	*	*	H	α-helix	trans	-63	-35.7	172.7	-77	177.4	178.8	176.5	0	113	A26 L27 K34	A26-K30 WeakPolarHBondContact O-CG 3.08Å; A26-K30 PolarHBondContact O-N 2.86Å; L27-K30 PolarHBondContact O-N 3.17Å; K30-K34 PolarHBondContact O-N 3.35Å
31	L	72.3	Confident	70.2	Confident	98 Å²	98	112.7 Å²	112.7	51%	0.513	56%	0.556	S	S	.	*	H	α-helix	trans	-67.9	-46.6	174.1	-75.5	165.6	0	0	0	111.6	L27 L28 T29 Q33 K34 V35	L27-L31 HydrophobicContact CD2-CD1 4.02Å; L27-L31 HydrophobicContact CD2-CG 4.37Å; L27-L31 WeakPolarHBondContact O-CG 3.49Å; L27-L31 PolarHBondContact O-N 3.36Å; L28-L31 PolarHBondContact O-N 3.39Å; T29-L31 VanDerWaalsContact C-N 3.34Å; T29-L31 PolarHBondContact O-N 2.8Å; L31-Q33 VanDerWaalsContact C-N 3.33Å; L31-Q33 PolarHBondContact O-N 2.98Å; L31-K34 PolarHBondContact O-N 2.63Å; L31-K34 VanDerWaalsContact O-N 3.16Å; L31-V35 WeakPolarHBondContact O-CG2 3.44Å; L31-V35 PolarHBondContact O-N 2.61Å
32	Q	79.4	Confident	71.4	Confident	120 Å²	120	110.6 Å²	110.6	56%	0.561	55%	0.546	S	S	*	.	H	α-helix	trans	-60.3	-39.6	176.5	-71.7	173.7	-7.3	0	0	112.4	L28 T29 V35 K36	L28-Q32 WeakPolarHBondContact O-CG 3.45Å; L28-Q32 PolarHBondContact O-N 2.87Å; T29-Q32 PolarHBondContact O-N 2.97Å; Q32-V35 PolarHBondContact O-N 3.48Å; Q32-K36 PolarHBondContact O-N 3.12Å
33	Q	78.8	Confident	72.4	Confident	134 Å²	134	111.3 Å²	111.3	63%	0.626	54%	0.543	S	S	*	.	H	α-helix	trans	-61	-46	172.9	-75.9	178.2	-13.5	0	0	111.9	T29 L31 V35 K36 Q37	T29-Q33 WeakPolarHBondContact O-CG 3.27Å; T29-Q33 PolarHBondContact O-N 3.26Å; L31-Q33 VanDerWaalsContact C-N 3.33Å; L31-Q33 PolarHBondContact O-N 2.98Å; Q33-V35 VanDerWaalsContact C-N 3.32Å; Q33-V35 PolarHBondContact O-N 2.95Å; Q33-K36 PolarHBondContact O-N 3.09Å; Q33-Q37 WeakPolarHBondContact O-CB 3.44Å; Q33-Q37 PolarHBondContact O-N 2.84Å
34	K	77.1	Confident	73.4	Confident	141 Å²	141	107.2 Å²	107.2	61%	0.613	53%	0.532	S	S	*	.	H	α-helix	trans	-62.7	-34.9	176	-76.2	-175.7	177.1	-177.4	0	113	K30 L31 K38	K30-K34 PolarHBondContact O-N 3.35Å; L31-K34 PolarHBondContact O-N 2.63Å; L31-K34 VanDerWaalsContact O-N 3.16Å; K34-K38 PolarHBondContact O-N 2.83Å
35	V	82.8	Confident	74	Confident	82 Å²	82	111.2 Å²	111.2	50%	0.497	54%	0.542	S	S	.	.	H	α-helix	trans	-66.4	-49.7	174.2	173.3	0	0	0	0	110.8	L31 Q32 Q33 Q37 K38 Q39	L31-V35 WeakPolarHBondContact O-CG2 3.44Å; L31-V35 PolarHBondContact O-N 2.61Å; Q32-V35 PolarHBondContact O-N 3.48Å; Q33-V35 VanDerWaalsContact C-N 3.32Å; Q33-V35 PolarHBondContact O-N 2.95Å; V35-Q37 VanDerWaalsContact C-N 3.27Å; V35-Q37 PolarHBondContact O-N 3.23Å; V35-K38 PolarHBondContact O-N 2.86Å; V35-Q39 WeakPolarHBondContact O-CG 3.45Å; V35-Q39 PolarHBondContact O-N 2.83Å
36	K	80.2	Confident	73.7	Confident	147 Å²	147	111.3 Å²	111.3	64%	0.639	54%	0.542	S	S	*	.	H	α-helix	trans	-59.4	-36.5	175.5	-77.3	-176.2	173.1	179.8	0	112.5	Q32 Q33 Q39 R40	Q32-K36 PolarHBondContact O-N 3.12Å; Q33-K36 PolarHBondContact O-N 3.09Å; K36-Q39 PolarHBondContact O-N 3.36Å; K36-R40 PolarHBondContact O-N 2.93Å
37	Q	79.4	Confident	72.9	Confident	123 Å²	123	119 Å²	119	58%	0.575	56%	0.563	S	S	*	*	H	α-helix	trans	-67.4	-42.7	176.8	-163.8	174.4	24.5	0	0	111.9	Q33 V35 R40 Q41	Q33-Q37 WeakPolarHBondContact O-CB 3.44Å; Q33-Q37 PolarHBondContact O-N 2.84Å; V35-Q37 VanDerWaalsContact C-N 3.27Å; V35-Q37 PolarHBondContact O-N 3.23Å; Q37-R40 PolarHBondContact O-N 3.15Å; Q37-Q41 WeakPolarHBondContact O-CG 3.25Å; Q37-Q41 PolarHBondContact O-N 3.46Å
38	K	77.1	Confident	72.6	Confident	155 Å²	155	120.8 Å²	120.8	67%	0.674	57%	0.568	S	S	*	*	H	α-helix	trans	-63.3	-41.7	172.4	-80.2	-171.7	171.3	-171.8	0	112.7	K34 V35 R40 Q41 S42	K34-K38 PolarHBondContact O-N 2.83Å; V35-K38 PolarHBondContact O-N 2.86Å; K38-R40 PolarHBondContact O-N 3.08Å; K38-Q41 PolarHBondContact O-N 3.38Å; K38-Q41 VanDerWaalsContact O-N 3.16Å; K38-S42 PolarHBondContact O-N 2.91Å; K38-S42 PolarHBondContact O-OG 3.09Å
39	Q	76.1	Confident	71.6	Confident	105 Å²	105	125 Å²	125	49%	0.491	58%	0.577	S	S	.	*	H	α-helix	trans	-62.8	-39.9	176.2	-74.5	174.8	-36.9	0	0	112.1	V35 K36 Q41 S42 L43	V35-Q39 WeakPolarHBondContact O-CG 3.45Å; V35-Q39 PolarHBondContact O-N 2.83Å; K36-Q39 PolarHBondContact O-N 3.36Å; Q39-Q41 VanDerWaalsContact C-N 3.35Å; Q39-S42 WeakPolarHBondContact CA-OG 3.28Å; Q39-S42 PolarHBondContact O-N 3.28Å; Q39-S42 PolarHBondContact O-OG 2.89Å; Q39-L43 WeakPolarHBondContact O-CB 3.5Å; Q39-L43 VanDerWaalsContact O-CG 3.27Å; Q39-L43 WeakPolarHBondContact O-CG 3.48Å; Q39-L43 PolarHBondContact O-N 2.94Å
40	R	73.3	Confident	70.2	Confident	201 Å²	201	125.8 Å²	125.8	76%	0.758	58%	0.582	S	S	*	*	H	α-helix	trans	-63.3	-38.8	171.7	-78.5	-177.2	168.2	-172.6	-5	112.3	K36 Q37 K38 L43 A44	K36-R40 PolarHBondContact O-N 2.93Å; Q37-R40 PolarHBondContact O-N 3.15Å; K38-R40 PolarHBondContact O-N 3.08Å; R40-L43 PolarHBondContact O-N 3.47Å; R40-A44 WeakPolarHBondContact O-CB 3.34Å; R40-A44 PolarHBondContact O-N 3.49Å
41	Q	75	Confident	68.6	Low	123 Å²	123	121.3 Å²	121.3	58%	0.575	58%	0.576	S	S	*	*	H	α-helix	trans	-68.9	-34.6	176.3	-73.9	176.2	-23.6	0	0	113.4	Q37 K38 Q39 K45	Q37-Q41 WeakPolarHBondContact O-CG 3.25Å; Q37-Q41 PolarHBondContact O-N 3.46Å; K38-Q41 PolarHBondContact O-N 3.38Å; K38-Q41 VanDerWaalsContact O-N 3.16Å; Q39-Q41 VanDerWaalsContact C-N 3.35Å; Q41-K45 PolarHBondContact O-N 3.33Å
42	S	72.9	Confident	67.2	Low	59 Å²	59	124.7 Å²	124.7	41%	0.413	59%	0.589	S	S	.	*	H	α-helix	trans	-71.4	-40.1	172.9	56.1	0	0	0	0	112.1	K38 Q39 K45 Q46	K38-S42 PolarHBondContact O-N 2.91Å; K38-S42 PolarHBondContact O-OG 3.09Å; Q39-S42 WeakPolarHBondContact CA-OG 3.28Å; Q39-S42 PolarHBondContact O-N 3.28Å; Q39-S42 PolarHBondContact O-OG 2.89Å; S42-K45 PolarHBondContact O-N 3.18Å; S42-Q46 WeakPolarHBondContact O-CG 3.41Å; S42-Q46 PolarHBondContact O-N 3.26Å
43	L	72.3	Confident	65.2	Low	99 Å²	99	127.2 Å²	127.2	52%	0.518	60%	0.601	S	S	.	*	H	α-helix	trans	-65.9	-36.6	176.4	-72.2	167.4	0	0	0	112.4	Q39 R40 Q46 R47	Q39-L43 WeakPolarHBondContact O-CB 3.5Å; Q39-L43 VanDerWaalsContact O-CG 3.27Å; Q39-L43 WeakPolarHBondContact O-CG 3.48Å; Q39-L43 PolarHBondContact O-N 2.94Å; R40-L43 PolarHBondContact O-N 3.47Å; L43-Q46 PolarHBondContact O-N 3.42Å; L43-R47 PolarHBondContact O-N 3.27Å
44	A	70.3	Confident	63.2	Low	45 Å²	45	129.2 Å²	129.2	37%	0.372	61%	0.61	S	S	.	*	H	α-helix	trans	-60.6	-50.7	171.1	0	0	0	0	0	111.1	R40 Q46 R47 E48	R40-A44 WeakPolarHBondContact O-CB 3.34Å; R40-A44 PolarHBondContact O-N 3.49Å; A44-Q46 PolarHBondContact O-N 3.16Å; A44-R47 PolarHBondContact O-N 3.35Å; A44-E48 WeakPolarHBondContact O-CG 3.47Å; A44-E48 PolarHBondContact O-N 2.98Å
45	K	67.8	Low	61.1	Low	143 Å²	143	128.3 Å²	128.3	62%	0.622	62%	0.617	S	S	*	*	H	α-helix	trans	-66	-19.9	177.8	-76	-166.9	168.6	-164	0	115.3	Q41 S42 R49	Q41-K45 PolarHBondContact O-N 3.33Å; S42-K45 PolarHBondContact O-N 3.18Å; K45-R49 WeakPolarHBondContact O-CG 3.43Å
46	Q	59.7	Low	58.8	Low	121 Å²	121	133 Å²	133	57%	0.565	63%	0.633	S	S	*	*	H	α-helix	trans	-78.4	-42.9	169	-74.8	179.7	-74	0	0	111.1	S42 L43 A44 R49 T50	S42-Q46 WeakPolarHBondContact O-CG 3.41Å; S42-Q46 PolarHBondContact O-N 3.26Å; L43-Q46 PolarHBondContact O-N 3.42Å; A44-Q46 PolarHBondContact O-N 3.16Å; Q46-R49 PolarHBondContact O-N 3.29Å; Q46-T50 PolarHBondContact O-N 3.08Å; Q46-T50 PolarHBondContact O-OG1 3.07Å
47	R	53	Low	56.3	Low	203 Å²	203	134.9 Å²	134.9	77%	0.766	64%	0.644	S	S	*	*	H	α-helix	trans	-63.2	-40	176.3	-77.4	-177.4	169.1	-166.3	-6.4	113.4	L43 A44 R49 T50 G51	L43-R47 PolarHBondContact O-N 3.27Å; A44-R47 PolarHBondContact O-N 3.35Å; R47-R49 VanDerWaalsContact C-N 3.27Å; R47-R49 PolarHBondContact O-N 2.92Å; R47-T50 WeakPolarHBondContact CA-OG1 3.37Å; R47-T50 PolarHBondContact O-N 2.91Å; R47-T50 PolarHBondContact O-OG1 3.2Å; R47-T50 VanDerWaalsContact O-OG1 3.07Å; R47-G51 PolarHBondContact O-N 2.66Å; R47-G51 VanDerWaalsContact O-N 3.09Å
48	E	56	Low	53.9	Low	127 Å²	127	137.7 Å²	137.7	59%	0.593	66%	0.657	S	S	*	*	H	α-helix	trans	-57.3	-42	173.6	-72.5	167.1	166.9	0	0	111.1	A44 G51	A44-E48 WeakPolarHBondContact O-CG 3.47Å; A44-E48 PolarHBondContact O-N 2.98Å; E48-G51 PolarHBondContact O-N 3.15Å
49	R	48.5	Very low	51.5	Low	189 Å²	189	138.4 Å²	138.4	71%	0.713	66%	0.663	S	S	*	*	H	α-helix	trans	-72.5	-39.7	180	-74.1	177.2	169.4	-154.9	-8.9	114.1	K45 Q46 R47 G51 E52	K45-R49 WeakPolarHBondContact O-CG 3.43Å; Q46-R49 PolarHBondContact O-N 3.29Å; R47-R49 VanDerWaalsContact C-N 3.27Å; R47-R49 PolarHBondContact O-N 2.92Å; R49-G51 PolarHBondContact O-N 3.42Å; R49-E52 PolarHBondContact O-N 3.29Å
50	T	45.6	Very low	49.2	Very low	84 Å²	84	140 Å²	140	52%	0.515	68%	0.68	S	S	.	*	H	α-helix	trans	-69.2	-20.9	174.6	48.1	0	0	0	0	112.8	Q46 R47	Q46-T50 PolarHBondContact O-N 3.08Å; Q46-T50 PolarHBondContact O-OG1 3.07Å; R47-T50 WeakPolarHBondContact CA-OG1 3.37Å; R47-T50 PolarHBondContact O-N 2.91Å; R47-T50 PolarHBondContact O-OG1 3.2Å; R47-T50 VanDerWaalsContact O-OG1 3.07Å
51	G	42.8	Very low	47.5	Very low	48 Å²	48	135.8 Å²	135.8	50%	0.495	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.5	-17.5	176.8	0	0	0	0	0	114.8	R47 E48 R49	R47-G51 PolarHBondContact O-N 2.66Å; R47-G51 VanDerWaalsContact O-N 3.09Å; E48-G51 PolarHBondContact O-N 3.15Å; R49-G51 PolarHBondContact O-N 3.42Å
52	E	43.9	Very low	45.1	Very low	169 Å²	169	135 Å²	135	79%	0.79	69%	0.687	S	S	*	*	S	Bend	trans	-93.4	-9.8	-179	-67.5	-179.2	144.2	0	0	113.2	R49	R49-E52 PolarHBondContact O-N 3.29Å
53	E	37.7	Very low	42.9	Very low	173 Å²	173	140.5 Å²	140.5	81%	0.808	71%	0.706	S	S	*	*	S	Bend	trans	-100.2	-8.7	-177.3	-67.7	-176.5	149.8	0	0	114.4
54	E	35.8	Very low	40.7	Very low	177 Å²	177	141.4 Å²	141.4	83%	0.827	72%	0.715	S	S	*	*	S	Bend	trans	-105.6	21.5	-176.7	-66.2	-169	149.8	0	0	114.8
55	T	33.1	Very low	38.6	Very low	121 Å²	121	147.6 Å²	147.6	74%	0.742	73%	0.734	S	S	*	*			trans	-131.2	35	-176.7	-27.6	0	0	0	0	115.7
56	E	34	Very low	36.5	Very low	182 Å²	182	146.5 Å²	146.5	85%	0.85	74%	0.735	S	S	*	*			trans	-128	77.1	167.3	-75.3	-158.9	146.8	0	0	112.8
57	Q	28.5	Very low	35	Very low	185 Å²	185	147 Å²	147	86%	0.864	74%	0.737	S	S	*	*			trans	-168.3	133.7	153.6	-109.5	143.7	106.4	0	0	112.3
58	Q	28.1	Very low	33.8	Very low	182 Å²	182	143.2 Å²	143.2	85%	0.85	73%	0.727	S	S	*	*			trans	64.3	141.9	176.3	-64.5	164.3	-19.3	0	0	114.4
59	E	27.6	Very low	32.4	Very low	170 Å²	170	147.3 Å²	147.3	79%	0.794	74%	0.737	S	S	*	*			cis	-149.2	170.4	9	-139.8	168.7	-141.8	0	0	111.4
60	V	28	Very low	31.4	Very low	139 Å²	139	142.6 Å²	142.6	84%	0.842	73%	0.733	S	S	*	*			trans	-143.3	117.8	178.7	172.4	0	0	0	0	109.4
61	P	37.3	Very low	30.5	Very low	112 Å²	112	143.3 Å²	143.3	73%	0.727	74%	0.741	S	S	*	*				-145.7	-178	101.6	40.6	-24	0	0	0	112.3
62	S	24.4	Very low	29.8	Very low	108 Å²	108	147.5 Å²	147.5	76%	0.755	75%	0.747	S	S	*	*			cis	-154.9	178.8	4.7	11.8	0	0	0	0	110.7
63	E	27.1	Very low	28.9	Very low	174 Å²	174	146.1 Å²	146.1	81%	0.813	74%	0.739	S	S	*	*			trans	-33.4	148.1	163.9	-43.4	-174.2	150.1	0	0	114.8
64	T	25	Very low	28.4	Very low	117 Å²	117	144.5 Å²	144.5	72%	0.718	73%	0.731	S	S	*	*				-162.2	166	61.9	3.8	0	0	0	0	114.8
65	K	26.4	Very low	28.1	Very low	175 Å²	175	141.6 Å²	141.6	76%	0.761	72%	0.718	S	S	*	*			trans	9.9	146.9	136.9	-68.6	176.8	178	176	0	119.5
66	D	25.4	Very low	27.8	Very low	121 Å²	121	141 Å²	141	65%	0.647	71%	0.706	S	S	*	*			cis	-159.2	175.6	7.5	-125.1	-38.1	0	0	0	112.8
67	E	28.1	Very low	27.5	Very low	131 Å²	131	139.7 Å²	139.7	61%	0.612	70%	0.7	S	S	*	*			trans	12.9	149.2	144.6	-77.9	-166.5	122.8	0	0	122
68	K	27	Very low	27.4	Very low	124 Å²	124	137.4 Å²	137.4	54%	0.539	69%	0.687	S	S	.	*			cis	-169.9	147.2	30.1	-133.3	158.1	177	123.7	0	112.9
69	R	26.5	Very low	27.4	Very low	213 Å²	213	136.7 Å²	136.7	80%	0.804	68%	0.681	S	S	*	*			trans	62.8	159.8	143	-81.6	169.7	-168.8	-173.2	-0.7	118.8
70	S	26.6	Very low	27.2	Very low	90 Å²	90	138.1 Å²	138.1	63%	0.629	69%	0.685	S	S	*	*			cis	-160.3	126.7	-6.6	26.4	0	0	0	0	107.6
71	S	27.1	Very low	27.1	Very low	98 Å²	98	140.1 Å²	140.1	69%	0.685	68%	0.683	S	S	*	*				68.1	149.3	91.7	84.6	0	0	0	0	113.9
72	E	28.7	Very low	26.5	Very low	136 Å²	136	143.6 Å²	143.6	64%	0.636	69%	0.686	S	S	*	*			cis	-137.2	138.2	35.1	-77.2	-135.1	142.7	0	0	111.5
73	K	25	Very low	26.5	Very low	140 Å²	140	145.6 Å²	145.6	61%	0.609	68%	0.681	S	S	*	*				66.8	154	92.7	-60.5	-176.3	-172.7	160	0	113.4
74	H	27.9	Very low	26.3	Very low	139 Å²	139	147.5 Å²	147.5	64%	0.644	68%	0.681	S	S	*	*			cis	-165	172	5.6	-116.6	12.4	0	0	0	107.9
75	Q	27.9	Very low	26.1	Very low	117 Å²	117	151 Å²	151	55%	0.547	69%	0.686	S	S	.	*			cis	-160.5	145.2	-6.4	-138.6	-173	55	0	0	110.6
76	Q	27.9	Very low	25.9	Very low	108 Å²	108	146.6 Å²	146.6	51%	0.505	68%	0.678	S	S	.	*			trans	47.1	165.6	133.7	-72.6	-177.1	90.6	0	0	121.4	K78	Q76-K78 HydrophobicContact CG-CD 4.4Å
77	Q	27.9	Very low	25.8	Very low	155 Å²	155	146.9 Å²	146.9	72%	0.724	68%	0.684	S	S	*	*			cis	-158.1	168.5	16.8	-141.2	165.4	107.9	0	0	110
78	K	26.3	Very low	25.5	Very low	137 Å²	137	145.9 Å²	145.9	60%	0.596	70%	0.698	S	S	*	*			cis	177.2	150.3	-49.6	-135.9	171.6	-167.5	170.3	0	109.6	Q76	Q76-K78 HydrophobicContact CG-CD 4.4Å
79	K	26.9	Very low	25.4	Very low	166 Å²	166	143.2 Å²	143.2	72%	0.722	71%	0.706	S	S	*	*			trans	73	163.1	160.5	-51	157	178.3	168.6	0	116.1
80	K	24.9	Very low	25.1	Very low	200 Å²	200	140 Å²	140	87%	0.87	71%	0.71	S	S	*	*			cis	-125.4	144.8	4.2	-58.7	163.6	-175.4	166.4	0	108.8
81	K	24.8	Very low	25	Very low	182 Å²	182	143.1 Å²	143.1	79%	0.791	72%	0.718	S	S	*	*			cis	93.8	125.4	17.3	-162.7	-177.7	-170.7	179.9	0	116
82	K	24.8	Very low	24.9	Very low	185 Å²	185	145 Å²	145	80%	0.804	72%	0.72	S	S	*	*			trans	115.3	146.5	167.2	-70.2	179	178.5	176	0	112.9
83	K	23.5	Very low	24.6	Very low	149 Å²	149	145.4 Å²	145.4	65%	0.648	73%	0.727	S	S	*	*			cis	-159.6	155.4	-0.3	-132.8	-174.6	177.6	-175.1	0	113.2
84	R	22.8	Very low	24.7	Very low	214 Å²	214	143.1 Å²	143.1	81%	0.808	73%	0.733	S	S	*	*			trans	64.6	139.5	160.1	-72.6	176.2	164.4	161.3	-10.3	117
85	K	22.2	Very low	24.6	Very low	190 Å²	190	142.9 Å²	142.9	83%	0.826	74%	0.737	S	S	*	*			cis	105.8	125.8	7.1	-151.9	-152.6	-171.7	-163.7	0	115.9
86	S	22.5	Very low	24.6	Very low	84 Å²	84	142.2 Å²	142.2	59%	0.587	75%	0.746	S	S	*	*			trans	81.6	119.8	144.4	51.3	0	0	0	0	123.3
87	T	21.8	Very low	24.5	Very low	127 Å²	127	143.7 Å²	143.7	78%	0.779	76%	0.757	S	S	*	*			trans	67.7	106.2	130.2	58.5	0	0	0	0	121.9
88	A	23.3	Very low	24.3	Very low	109 Å²	109	141.5 Å²	141.5	90%	0.901	76%	0.759	S	S	*	*				36.4	133.6	115.5	0	0	0	0	0	121.4
89	G	23.1	Very low	24.2	Very low	69 Å²	69	139.7 Å²	139.7	71%	0.711	76%	0.763	S	S	*	*			trans	155.7	125.1	146.2	0	0	0	0	0	117.6
90	V	22.1	Very low	24.2	Very low	145 Å²	145	140.5 Å²	140.5	88%	0.879	77%	0.769	S	S	*	*			trans	78.9	150.8	146.6	-170.2	0	0	0	0	119.1
91	L	23.9	Very low	24.9	Very low	155 Å²	155	136 Å²	136	81%	0.812	76%	0.761	S	S	*	*			trans	-96	-168.6	-171	-67.6	140.6	0	0	0	112.5
92	L	24.2	Very low	24.9	Very low	138 Å²	138	132.4 Å²	132.4	72%	0.723	77%	0.765	S	S	*	*			trans	96.5	89.1	156.3	-51.1	-176	0	0	0	117.4
93	D	23.5	Very low	24.9	Very low	145 Å²	145	127.3 Å²	127.3	78%	0.775	77%	0.765	S	S	*	*				63.9	159.5	105.8	-56.3	-12	0	0	0	122.6
94	A	27.5	Very low	25	Very low	91 Å²	91	130.7 Å²	130.7	75%	0.752	78%	0.78	S	S	*	*			trans	81.4	135.8	150.5	0	0	0	0	0	119.8
95	D	25.1	Very low	25.3	Very low	134 Å²	134	130.5 Å²	130.5	72%	0.717	79%	0.785	S	S	*	*			cis	-168.7	-176	-25.9	-141.5	-41.7	0	0	0	110.7
96	S	27.8	Very low	25.3	Very low	104 Å²	104	130.5 Å²	130.5	73%	0.727	79%	0.785	S	S	*	*			trans	84.9	153.3	139.8	74.6	0	0	0	0	120.6
97	N	25.8	Very low	25.3	Very low	138 Å²	138	137.1 Å²	137.1	74%	0.738	80%	0.797	S	S	*	*			cis	-171.8	149.3	-48.1	-120.2	-40.3	0	0	0	109.4
98	S	23.5	Very low	25.3	Very low	110 Å²	110	140.8 Å²	140.8	77%	0.769	80%	0.802	S	S	*	*			trans	168.6	143.2	141	38.8	0	0	0	0	111.9
99	S	25.1	Very low	25.2	Very low	98 Å²	98	139.1 Å²	139.1	69%	0.685	80%	0.796	S	S	*	*			cis	-170.1	132.5	-35.5	37.1	0	0	0	0	109.9
100	E	27.1	Very low	25.3	Very low	183 Å²	183	140.2 Å²	140.2	86%	0.855	80%	0.798	S	S	*	*			trans	69.7	160.9	148	-71.5	-159	177.9	0	0	121.3
101	P	39.6	Very low	25.3	Very low	107 Å²	107	142.2 Å²	142.2	70%	0.695	80%	0.797	S	S	*	*			cis	-142.1	177	-38	38.8	-22.9	0	0	0	116.6
102	A	24.8	Very low	25.3	Very low	105 Å²	105	139.7 Å²	139.7	87%	0.868	79%	0.785	S	S	*	*			trans	84.3	139.8	145.9	0	0	0	0	0	121.6
103	G	24.3	Very low	25.4	Very low	79 Å²	79	140.9 Å²	140.9	81%	0.814	78%	0.784	S	S	*	*			trans	143.9	96.6	169.7	0	0	0	0	0	114.9
104	K	25.1	Very low	25.4	Very low	220 Å²	220	141.5 Å²	141.5	96%	0.957	78%	0.78	S	S	*	*			trans	-123.2	147.6	173.7	-92.9	-177.9	178.8	172	0	112.7
105	K	28.8	Very low	25.3	Very low	209 Å²	209	143.5 Å²	143.5	91%	0.909	77%	0.774	S	S	*	*			trans	-59.4	140.8	-172.3	-59.9	171.9	176.2	176.8	0	115.2
106	K	23.2	Very low	25.2	Very low	191 Å²	191	142.6 Å²	142.6	83%	0.83	77%	0.773	S	S	*	*			trans	-165.8	125.8	143.8	-116.3	171.6	-175	174.7	0	115.3
107	R	22.9	Very low	25	Very low	222 Å²	222	141.9 Å²	141.9	84%	0.838	77%	0.768	S	S	*	*			trans	56.1	139.6	142.2	-77.1	-178.4	168.9	-177.6	-4.3	123.6
108	K	21.8	Very low	24.9	Very low	205 Å²	205	143.2 Å²	143.2	89%	0.891	77%	0.77	S	S	*	*			trans	68.5	127.3	149.5	-75.4	-171.1	171.9	-167	0	120
109	G	20.7	Very low	25	Very low	74 Å²	74	145.1 Å²	145.1	76%	0.763	77%	0.767	S	S	*	*				116.8	98.6	103.6	0	0	0	0	0	120.6
110	A	24	Very low	25.1	Very low	92 Å²	92	146.4 Å²	146.4	76%	0.76	78%	0.776	S	S	*	*			trans	71	155.1	131.7	0	0	0	0	0	123.1
111	E	22.1	Very low	25	Very low	186 Å²	186	141.1 Å²	141.1	87%	0.869	77%	0.77	S	S	*	*			trans	61.4	143.5	154.2	-72.1	170.5	-163.5	0	0	120.7
112	D	24.2	Very low	24.2	Very low	103 Å²	103	145.6 Å²	145.6	55%	0.551	78%	0.782	S	S	*	*			cis	173.6	145	-12.1	-171.4	15.2	0	0	0	106.3
113	K	26.6	Very low	24.3	Very low	162 Å²	162	145.8 Å²	145.8	70%	0.704	78%	0.777	S	S	*	*			trans	63.8	165.2	154.2	-85.9	162	-148.6	145.4	0	119.4
114	K	24.1	Very low	24.3	Very low	159 Å²	159	148.3 Å²	148.3	69%	0.691	78%	0.776	S	S	*	*			cis	-155.5	144.8	14.1	-138.8	172.8	176	-140.4	0	115.6
115	Q	24.6	Very low	24.3	Very low	133 Å²	133	144.5 Å²	144.5	62%	0.621	77%	0.771	S	S	*	*				87.6	122.6	129.7	-111.4	175.5	-42	0	0	126
116	T	22.8	Very low	24	Very low	115 Å²	115	137.7 Å²	137.7	71%	0.706	76%	0.76	S	S	*	*			trans	73.2	151.3	137.7	31.4	0	0	0	0	121
117	S	23.8	Very low	24.1	Very low	89 Å²	89	135.2 Å²	135.2	62%	0.622	76%	0.761	S	S	*	*			cis	-154.1	150	9.9	3.7	0	0	0	0	115.3
118	Q	24.8	Very low	24.2	Very low	165 Å²	165	129.9 Å²	129.9	77%	0.771	76%	0.758	S	S	*	*			trans	68.2	155	137.1	-68.7	-171.7	-68.7	0	0	122.8
119	E	25.7	Very low	25.1	Very low	151 Å²	151	125.4 Å²	125.4	71%	0.706	75%	0.749	S	S	*	*			cis	-168.8	158.8	-36.6	-132.4	171.5	166.8	0	0	112.7
120	S	25.7	Very low	25.1	Very low	124 Å²	124	130.3 Å²	130.3	87%	0.867	75%	0.753	S	S	*	*			trans	64.6	144.6	159.9	73.3	0	0	0	0	120.3
121	G	25.5	Very low	25	Very low	72 Å²	72	130.4 Å²	130.4	74%	0.742	75%	0.747	S	S	*	*			cis	158.4	143.4	-15.6	0	0	0	0	0	115.2
122	Q	23.6	Very low	24.9	Very low	202 Å²	202	127.6 Å²	127.6	94%	0.944	75%	0.747	S	S	*	*			trans	-161.4	158.3	147.9	-114.9	178.2	11.8	0	0	110.9
123	S	25.6	Very low	24.7	Very low	108 Å²	108	134.2 Å²	134.2	76%	0.755	76%	0.764	S	S	*	*			trans	-156.8	173.9	-168	60.8	0	0	0	0	110.1
124	V	25.7	Very low	24.3	Very low	133 Å²	133	132.7 Å²	132.7	81%	0.806	77%	0.772	S	S	*	*			cis	-127.1	-156.8	10.5	-132.4	0	0	0	0	109.2
125	V	23.5	Very low	24.2	Very low	139 Å²	139	133.2 Å²	133.2	84%	0.842	78%	0.777	S	S	*	*			cis	-142.9	149.9	16.6	-177.9	0	0	0	0	109
126	G	23.6	Very low	24	Very low	66 Å²	66	132.6 Å²	132.6	68%	0.68	78%	0.783	S	S	*	*			trans	-171.4	154	165	0	0	0	0	0	112.3
127	V	23.9	Very low	23.9	Very low	140 Å²	140	133.5 Å²	133.5	85%	0.848	78%	0.779	S	S	*	*			trans	-143.6	141.9	172.7	-178	0	0	0	0	110.4
128	S	25.6	Very low	23.7	Very low	110 Å²	110	137.7 Å²	137.7	77%	0.769	78%	0.781	S	S	*	*			trans	-142.2	172.3	165.3	-40.9	0	0	0	0	105.9
129	P	41	Very low	23.5	Very low	110 Å²	110	135.9 Å²	135.9	71%	0.714	77%	0.773	S	S	*	*				-152	-153.3	53.7	36	-9.5	0	0	0	114.6
130	E	21.1	Very low	23.3	Very low	178 Å²	178	135.6 Å²	135.6	83%	0.832	77%	0.772	S	S	*	*			trans	77.6	143.9	163.8	-69	-179.3	-161.6	0	0	119.1
131	S	21.8	Very low	23.2	Very low	93 Å²	93	137.3 Å²	137.3	65%	0.65	77%	0.766	S	S	*	*			cis	-161.5	170.3	-17.9	61.1	0	0	0	0	113.5
132	C	19.8	Very low	23.1	Very low	128 Å²	128	140.3 Å²	140.3	87%	0.865	77%	0.769	S	S	*	*			trans	71.3	159.5	150.6	-71.4	0	0	0	0	122.9
133	R	20.1	Very low	23.2	Very low	241 Å²	241	139.4 Å²	139.4	91%	0.909	77%	0.765	S	S	*	*			trans	-119.1	160.1	171	-65.9	174.6	170.7	-179.9	-4.3	108.8
134	C	18.6	Very low	23.2	Very low	130 Å²	130	141 Å²	141	88%	0.878	76%	0.761	S	S	*	*			trans	-160.2	-174.5	132.3	-131.4	0	0	0	0	112.8
135	E	20.9	Very low	23.8	Very low	170 Å²	170	139.3 Å²	139.3	79%	0.794	75%	0.752	S	S	*	*			trans	-115.4	176.9	-168.5	-57	170.7	137.9	0	0	111.8
136	T	20.6	Very low	23.9	Very low	120 Å²	120	138.4 Å²	138.4	74%	0.736	74%	0.743	S	S	*	*			trans	61	158	153.7	24.9	0	0	0	0	119
137	E	21.8	Very low	24.1	Very low	135 Å²	135	143.1 Å²	143.1	63%	0.631	75%	0.745	S	S	*	*			cis	-159.7	174.3	-18.8	-147.4	171.3	-116.2	0	0	108.6
138	R	19.4	Very low	24.3	Very low	177 Å²	177	143.3 Å²	143.3	67%	0.668	74%	0.741	S	S	*	*			trans	81	132.3	149.1	-71.7	171.6	-166.2	-95	-11.2	125.5
139	E	20.8	Very low	24.7	Very low	127 Å²	127	142.9 Å²	142.9	59%	0.593	74%	0.738	S	S	*	*				77.6	103.8	124.7	-63.8	159.9	-162.9	0	0	124.1
140	Q	20.6	Very low	24.4	Very low	145 Å²	145	143 Å²	143	68%	0.678	74%	0.741	S	S	*	*				75.7	129.7	121.8	-72.8	172	-93.8	0	0	125.6
141	E	23.2	Very low	25.1	Very low	159 Å²	159	139.4 Å²	139.4	74%	0.743	74%	0.742	S	S	*	*			trans	69.7	147.3	141.5	-68.8	160	-145.3	0	0	119.2
142	V	23.7	Very low	26.1	Very low	135 Å²	135	139.9 Å²	139.9	82%	0.818	75%	0.751	S	S	*	*			cis	-147.7	156.6	43	163.1	0	0	0	0	113.1
143	E	25.3	Very low	27.3	Very low	184 Å²	184	140.7 Å²	140.7	86%	0.86	75%	0.753	S	S	*	*			trans	-103.8	177.4	176	-54.2	-169.6	112	0	0	112.4
144	E	26.8	Very low	28.7	Very low	142 Å²	142	133.2 Å²	133.2	66%	0.664	75%	0.751	S	S	*	*			cis	-138.1	-132.6	8.7	-149.1	-134.6	127.8	0	0	106	N146	E144-N146 WeakPolarHBondContact OE1-CA 3.38Å; E144-N146 PolarHBondContact OE1-N 3.34Å
145	P	37	Very low	29.8	Very low	96 Å²	96	135.8 Å²	135.8	62%	0.623	75%	0.748	S	S	*	*			cis	-129.3	146.4	-16.5	36.9	-18	0	0	0	118.8
146	N	25.4	Very low	31.2	Very low	121 Å²	121	138.2 Å²	138.2	65%	0.647	75%	0.75	S	S	*	*				161.5	111	117.4	-88.4	-66.2	0	0	0	113.5	E144	E144-N146 WeakPolarHBondContact OE1-CA 3.38Å; E144-N146 PolarHBondContact OE1-N 3.34Å
147	K	28.9	Very low	32.8	Very low	165 Å²	165	137.5 Å²	137.5	72%	0.717	75%	0.745	S	S	*	*				46.2	139	123.5	-67.5	-178.8	-177.1	177.5	0	120.5
148	D	28.8	Very low	34	Very low	144 Å²	144	138.5 Å²	138.5	77%	0.77	75%	0.753	S	S	*	*			cis	-142.5	166.1	22.5	-110	-41.5	0	0	0	115.4
149	S	33.4	Very low	35.2	Very low	100 Å²	100	132.3 Å²	132.3	70%	0.699	75%	0.745	S	S	*	*			trans	-90.6	172.7	174.5	70.6	0	0	0	0	111.9
150	S	34.8	Very low	36.3	Very low	112 Å²	112	129.8 Å²	129.8	78%	0.783	75%	0.753	S	S	*	*			cis	-169.7	158.4	-31.9	54.8	0	0	0	0	108.7
151	A	35.3	Very low	38	Very low	104 Å²	104	132.9 Å²	132.9	86%	0.86	77%	0.765	S	S	*	*			trans	-161.7	118.5	159	0	0	0	0	0	110.2
152	A	43.6	Very low	39.4	Very low	102 Å²	102	131.7 Å²	131.7	84%	0.843	76%	0.759	S	S	*	*			trans	-106.5	131	-176.7	0	0	0	0	0	112.5
153	T	43.4	Very low	40.9	Very low	145 Å²	145	131.2 Å²	131.2	89%	0.89	76%	0.761	S	S	*	*			trans	-125.7	134.4	150.5	52.1	0	0	0	0	108.8	F155	T153-F155 PolarHBondContact O-N 2.85Å; T153-F155 VanDerWaalsContact O-N 3.15Å
154	G	51.2	Low	42.1	Very low	85 Å²	85	131.2 Å²	131.2	88%	0.876	75%	0.754	S	S	*	*	S	Bend	trans	-85.4	89.2	-156.9	0	0	0	0	0	115.6
155	F	41.9	Very low	43.3	Very low	184 Å²	184	130.3 Å²	130.3	81%	0.807	76%	0.76	S	S	*	*			trans	-149.4	104	155	-152	-93.5	0	0	0	112.8	T153 V157	T153-F155 PolarHBondContact O-N 2.85Å; T153-F155 VanDerWaalsContact O-N 3.15Å; F155-V157 HydrophobicContact CD1-CG2 3.95Å; F155-V157 HydrophobicContact CE1-CG2 4.36Å; F155-V157 PolarHBondContact O-N 2.99Å
156	R	49.3	Very low	44.1	Very low	221 Å²	221	131.9 Å²	131.9	83%	0.834	77%	0.768	S	S	*	*			trans	-86.9	95.1	179.1	-174	170.2	178.8	154.4	-2.1	110.5	L158	R156-L158 HydrophobicContact CG-CD2 4.49Å; R156-L158 PolarHBondContact O-N 3.31Å; R156-L158 VanDerWaalsContact O-N 3.07Å
157	V	53.7	Low	45.2	Very low	105 Å²	105	135 Å²	135	64%	0.636	78%	0.778	S	S	*	*			trans	-66.8	104.1	172.9	-178.2	0	0	0	0	109.4	F155 G159	F155-V157 HydrophobicContact CD1-CG2 3.95Å; F155-V157 HydrophobicContact CE1-CG2 4.36Å; F155-V157 PolarHBondContact O-N 2.99Å; V157-G159 PolarHBondContact O-N 3.03Å
158	L	47.6	Very low	46	Very low	155 Å²	155	134.8 Å²	134.8	81%	0.812	78%	0.777	S	S	*	*			trans	-81	106	171.8	-72.2	174.6	0	0	0	109.7	R156	R156-L158 HydrophobicContact CG-CD2 4.49Å; R156-L158 PolarHBondContact O-N 3.31Å; R156-L158 VanDerWaalsContact O-N 3.07Å
159	G	44.5	Very low	47	Very low	48 Å²	48	132.2 Å²	132.2	50%	0.495	78%	0.776	S	S	.	*			trans	114.5	95.5	179.1	0	0	0	0	0	112.2	V157	V157-G159 PolarHBondContact O-N 3.03Å
160	G	44.8	Very low	47.8	Very low	73 Å²	73	136.9 Å²	136.9	75%	0.753	78%	0.784	S	S	*	*			trans	-67	138.1	159.8	0	0	0	0	0	109.4	E162	G160-E162 PolarHBondContact O-N 3.45Å
161	F	54.5	Low	48.9	Very low	211 Å²	211	142.7 Å²	142.7	93%	0.925	79%	0.788	S	S	*	*			trans	-75.8	72.1	176.8	-78.9	-88.3	0	0	0	111.1	S163	F161-S163 PolarHBondContact O-N 2.86Å
162	E	53.7	Low	50.4	Low	134 Å²	134	144 Å²	144	63%	0.626	79%	0.785	S	S	*	*			trans	-57.2	118.3	160	-72.1	-173.2	158.4	0	0	108.7	G160 R164	G160-E162 PolarHBondContact O-N 3.45Å; E162-R164 HydrophobicContact CB-CG 4.18Å; E162-R164 PolarHBondContact O-N 3.46Å; E162-R164 IonicContact OE2-CZ 2.68Å; E162-R164 VanDerWaalsContact OE2-CZ 3.29Å; E162-R164 IonicContact OE2-NE 3.4Å; E162-R164 PolarHBondContact OE2-NE 3.06Å; E162-R164 IonicContact OE2-NH2 3.2Å; E162-R164 PolarHBondContact OE2-NH2 3.37Å
163	S	55.3	Low	52	Low	124 Å²	124	142.7 Å²	142.7	87%	0.867	76%	0.764	S	S	*	*			trans	-73	66.8	174.1	-173	0	0	0	0	110.5	F161	F161-S163 PolarHBondContact O-N 2.86Å
164	R	50.8	Low	53.8	Low	185 Å²	185	138.1 Å²	138.1	70%	0.698	74%	0.736	S	S	*	*			trans	-61.9	126.8	172.9	-65.5	-175.2	-179.7	-164.8	-2.7	107.8	E162 V166	E162-R164 HydrophobicContact CB-CG 4.18Å; E162-R164 PolarHBondContact O-N 3.46Å; E162-R164 IonicContact OE2-CZ 2.68Å; E162-R164 VanDerWaalsContact OE2-CZ 3.29Å; E162-R164 IonicContact OE2-NE 3.4Å; E162-R164 PolarHBondContact OE2-NE 3.06Å; E162-R164 IonicContact OE2-NH2 3.2Å; E162-R164 PolarHBondContact OE2-NH2 3.37Å; R164-V166 PolarHBondContact O-N 3.37Å
165	P	50.4	Low	55.2	Low	123 Å²	123	140.7 Å²	140.7	80%	0.799	73%	0.726	S	S	*	*			trans	-63.1	106.4	-179.4	25.1	-33.2	0	0	0	108.9	H167	P165-H167 PolarHBondContact O-N 3.43Å
166	V	53.9	Low	57.2	Low	129 Å²	129	134.6 Å²	134.6	78%	0.782	70%	0.697	S	S	*	*			trans	-56.4	118.4	-178.9	178.4	0	0	0	0	108.2	R164 K168	R164-V166 PolarHBondContact O-N 3.37Å; V166-K168 PolarHBondContact O-N 2.95Å
167	H	48.9	Very low	58.8	Low	186 Å²	186	124.5 Å²	124.5	86%	0.861	66%	0.66	S	S	*	*			trans	-58.5	99.2	178.7	-122	-80.5	0	0	0	108.6	P165 A169	P165-H167 PolarHBondContact O-N 3.43Å; H167-A169 PolarHBondContact O-N 3.49Å
168	K	46.6	Very low	60	Low	160 Å²	160	121.1 Å²	121.1	70%	0.696	64%	0.643	S	S	*	*			trans	-63.2	99.9	-176.9	-72	-176.4	179.9	177.2	0	108.2	V166 K170 P462	V166-K168 PolarHBondContact O-N 2.95Å; K168-K170 PolarHBondContact O-N 3.25Å; K168-K170 VanDerWaalsContact O-N 3.09Å; K168-P462 HydrophobicContact CD-CG 4.12Å
169	A	48.4	Very low	61.6	Low	91 Å²	91	119.7 Å²	119.7	75%	0.752	63%	0.632	S	S	*	*			trans	-53.8	118.1	-177.5	0	0	0	0	0	109.8	H167 R171	H167-A169 PolarHBondContact O-N 3.49Å; A169-R171 PolarHBondContact O-N 3.31Å
170	K	51.4	Low	63.4	Low	198 Å²	198	118.3 Å²	118.3	86%	0.861	61%	0.614	S	S	*	*			trans	-62.2	108.8	176.3	-74.5	-177.2	177	178.1	0	107.6	K168 V172	K168-K170 PolarHBondContact O-N 3.25Å; K168-K170 VanDerWaalsContact O-N 3.09Å; K170-V172 VanDerWaalsContact C-N 3.31Å; K170-V172 PolarHBondContact O-N 2.99Å
171	R	57.1	Low	65.1	Low	233 Å²	233	118 Å²	118	88%	0.879	60%	0.595	S	S	*	*			trans	-67.6	90.6	173.7	-71	-176.5	174.9	-171.5	-4	109	A169 L173	A169-R171 PolarHBondContact O-N 3.31Å; R171-L173 PolarHBondContact O-N 3.45Å
172	V	68	Low	66.3	Low	131 Å²	131	111.7 Å²	111.7	79%	0.794	57%	0.574	S	S	*	*			trans	-70.2	112.1	169.2	-177.4	0	0	0	0	107.2	K170	K170-V172 VanDerWaalsContact C-N 3.31Å; K170-V172 PolarHBondContact O-N 2.99Å
173	L	75.9	Confident	67.5	Low	76 Å²	76	105.5 Å²	105.5	40%	0.398	55%	0.546	S	S	.	.			trans	-74	146.1	170.6	-63.1	176.2	0	0	0	109	R171 L177 A178	R171-L173 PolarHBondContact O-N 3.45Å; L173-L177 HydrophobicContact CD2-CD2 4.32Å; L173-A178 HydrophobicContact CB-CB 4.47Å
174	P	81	Confident	68.4	Low	48 Å²	48	105.1 Å²	105.1	31%	0.312	53%	0.53	S	S	.	.			trans	-54.3	142.8	169.7	-25.5	35.4	0	0	0	111.2	W176 L177 A178 P433	P174-W176 VanDerWaalsContact C-N 3.34Å; P174-W176 PolarHBondContact O-N 3.4Å; P174-L177 HydrophobicContact CB-CB 4.41Å; P174-L177 WeakPolarHBondContact O-CA 3.22Å; P174-L177 VanDerWaalsContact O-CB 3.31Å; P174-L177 WeakPolarHBondContact O-CB 3.47Å; P174-L177 PolarHBondContact O-N 3.44Å; P174-A178 PolarHBondContact O-N 3.12Å; P174-A178 VanDerWaalsContact O-N 3.1Å; P174-P433 HydrophobicContact CG-CB 4.16Å
175	Q	82.3	Confident	69.1	Low	139 Å²	139	100.8 Å²	100.8	65%	0.65	51%	0.513	S	S	*	.	H	α-helix	trans	-53	-48	-173.8	-172.4	177.9	3.2	0	0	112.9	L177 A178 E179	Q175-L177 PolarHBondContact O-N 3.23Å; Q175-A178 PolarHBondContact O-N 3.43Å; Q175-E179 WeakPolarHBondContact CG-OE2 3.37Å; Q175-E179 PolarHBondContact NE2-OE2 2.87Å; Q175-E179 PolarHBondContact O-N 2.79Å
176	W	82.8	Confident	69.9	Low	56 Å²	56	97.4 Å²	97.4	21%	0.212	49%	0.489	C	S	.	.	H	α-helix	trans	-58.9	-15.7	177	73.8	-88.4	0	0	0	115.5	P174 C248 L436 L441 P444 L446	P174-W176 VanDerWaalsContact C-N 3.34Å; P174-W176 PolarHBondContact O-N 3.4Å; W176-C248 HydrophobicContact CZ3-CB 4.35Å; W176-L436 HydrophobicContact CH2-CD1 3.81Å; W176-L436 HydrophobicContact CH2-CD2 4.45Å; W176-L436 HydrophobicContact CH2-CG 4.5Å; W176-L436 HydrophobicContact CZ2-CD1 4.11Å; W176-L441 HydrophobicContact CH2-CD1 4.1Å; W176-L441 HydrophobicContact CZ2-CD1 4.44Å; W176-P444 VanDerWaalsContact CB-O 3.24Å; W176-P444 WeakPolarHBondContact CB-O 3.32Å; W176-P444 HydrophobicContact CD2-CB 3.86Å; W176-P444 HydrophobicContact CD2-CG 3.57Å; W176-P444 HydrophobicContact CE3-CB 3.84Å; W176-P444 HydrophobicContact CE3-CG 4.09Å; W176-P444 HydrophobicContact CG-CB 4.46Å; W176-P444 HydrophobicContact CG-CG 3.91Å; W176-P444 HydrophobicContact CH2-CB 4.11Å; W176-P444 HydrophobicContact CH2-CG 4.23Å; W176-P444 HydrophobicContact CZ2-CB 4.15Å; W176-P444 HydrophobicContact CZ2-CG 3.76Å; W176-P444 HydrophobicContact CZ3-CB 3.96Å; W176-P444 HydrophobicContact CZ3-CG 4.39Å; W176-L446 HydrophobicContact CE3-CB 3.77Å; W176-L446 HydrophobicContact CZ3-CB 3.95Å; W176-L446 HydrophobicContact CZ3-CD2 4.46Å
177	L	82.8	Confident	70.8	Confident	9 Å²	9	92 Å²	92	5%	0.047	46%	0.455	C	S	.	.	H	α-helix	trans	-100.9	-24.9	178.7	-162.3	67.8	0	0	0	111.6	L173 P174 Q175 L436 L446	L173-L177 HydrophobicContact CD2-CD2 4.32Å; P174-L177 HydrophobicContact CB-CB 4.41Å; P174-L177 WeakPolarHBondContact O-CA 3.22Å; P174-L177 VanDerWaalsContact O-CB 3.31Å; P174-L177 WeakPolarHBondContact O-CB 3.47Å; P174-L177 PolarHBondContact O-N 3.44Å; Q175-L177 PolarHBondContact O-N 3.23Å; L177-L436 HydrophobicContact CD1-CD1 3.76Å; L177-L436 HydrophobicContact CD2-CD1 3.94Å; L177-L446 HydrophobicContact CD1-CD2 3.81Å
178	A	79.6	Confident	71.8	Confident	35 Å²	35	89.1 Å²	89.1	29%	0.289	44%	0.44	S	S	.	.	H	α-helix	trans	-83.7	-32.9	172.5	0	0	0	0	0	112.5	L173 P174 Q175 P180	L173-A178 HydrophobicContact CB-CB 4.47Å; P174-A178 PolarHBondContact O-N 3.12Å; P174-A178 VanDerWaalsContact O-N 3.1Å; Q175-A178 PolarHBondContact O-N 3.43Å; A178-P180 VanDerWaalsContact O-CD 3.28Å; A178-P180 WeakPolarHBondContact O-CD 3.28Å
179	E	80.6	Confident	72.7	Confident	124 Å²	124	86.3 Å²	86.3	58%	0.579	44%	0.439	S	S	*	.	S	Bend	trans	-120.1	72.4	-176.9	-62.3	175.1	163.4	0	0	109.9	Q175	Q175-E179 WeakPolarHBondContact CG-OE2 3.37Å; Q175-E179 PolarHBondContact NE2-OE2 2.87Å; Q175-E179 PolarHBondContact O-N 2.79Å
180	P	82.6	Confident	74	Confident	19 Å²	19	84.7 Å²	84.7	12%	0.123	42%	0.418	C	S	.	.			trans	-80.3	150.8	175.5	33.9	-35.8	0	0	0	112	A178 V182 L446	A178-P180 VanDerWaalsContact O-CD 3.28Å; A178-P180 WeakPolarHBondContact O-CD 3.28Å; P180-V182 PolarHBondContact O-N 3.02Å; P180-L446 CarbonylContact C-O 3.51Å; P180-L446 VanDerWaalsContact CA-O 3.28Å; P180-L446 WeakPolarHBondContact CA-O 3.35Å; P180-L446 HydrophobicContact CB-CB 4.2Å; P180-L446 HydrophobicContact CB-CD2 4.05Å; P180-L446 HydrophobicContact CB-CG 3.89Å; P180-L446 VanDerWaalsContact CB-O 3.26Å; P180-L446 WeakPolarHBondContact CB-O 3.48Å
181	D	80.3	Confident	75.4	Confident	66 Å²	66	78.6 Å²	78.6	35%	0.353	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	119.4	167.8	-60.2	-58.5	0	0	0	109.2	I183 Q445 L446 F447 S448	D181-I183 PolarHBondContact O-N 3.28Å; D181-Q445 WeakPolarHBondContact OD2-CG 3.43Å; D181-Q445 PolarHBondContact OD2-NE2 3.24Å; D181-L446 PolarHBondContact N-O 3.28Å; D181-F447 HydrophobicContact CB-CD1 3.63Å; D181-F447 HydrophobicContact CB-CE1 3.94Å; D181-F447 HydrophobicContact CB-CG 4.25Å; D181-F447 CarbonylContact O-C 3.53Å; D181-F447 WeakPolarHBondContact O-CA 3.43Å; D181-S448 PolarHBondContact O-N 3.35Å
182	V	79.8	Confident	76.7	Confident	79 Å²	79	69.5 Å²	69.5	48%	0.479	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	109	-169.2	-177.7	0	0	0	0	111.2	P180 S448	P180-V182 PolarHBondContact O-N 3.02Å; V182-S448 WeakPolarHBondContact CA-O 3.39Å
183	I	78.7	Confident	77.5	Confident	5 Å²	5	65.9 Å²	65.9	3%	0.026	34%	0.344	C	S	.	.			trans	-75.6	129.7	171.2	-55.9	161.8	0	0	0	109.2	D181 R185 P218 V219 V249 A251 F447 S448 S449	D181-I183 PolarHBondContact O-N 3.28Å; I183-R185 PolarHBondContact O-N 3.08Å; I183-P218 HydrophobicContact CG2-CB 3.73Å; I183-V219 HydrophobicContact CD1-CB 4.06Å; I183-V219 HydrophobicContact CD1-CG2 3.72Å; I183-V219 HydrophobicContact CG2-CB 4.12Å; I183-V249 HydrophobicContact CD1-CG1 4.43Å; I183-A251 HydrophobicContact CD1-CB 4.08Å; I183-F447 HydrophobicContact CD1-CB 3.73Å; I183-F447 HydrophobicContact CG1-CB 3.95Å; I183-S448 PolarHBondContact N-O 2.79Å; I183-S449 WeakPolarHBondContact O-CA 3.33Å
184	H	74.4	Confident	78	Confident	115 Å²	115	62.4 Å²	62.4	53%	0.532	33%	0.326	S	S	.	.			trans	-56.4	123.5	172.3	-74.6	-94.2	0	0	0	111.9	D186 N190 P218	H184-D186 VanDerWaalsContact C-N 3.33Å; H184-D186 PolarHBondContact O-N 2.68Å; H184-N190 HydrophobicContact CB-CB 4.35Å; H184-P218 HydrophobicContact CB-CB 4.15Å; H184-P218 HydrophobicContact CB-CG 4.24Å
185	R	66.1	Low	78.2	Confident	95 Å²	95	64.9 Å²	64.9	36%	0.358	34%	0.344	S	S	.	.	S	Bend	trans	-64.7	-33.2	-179.9	-78.4	178.1	162.9	-174.9	-13	113.6	I183 I187 S449 H451 D470 Q473	I183-R185 PolarHBondContact O-N 3.08Å; R185-I187 PolarHBondContact O-N 3.42Å; R185-S449 VanDerWaalsContact CG-O 3.24Å; R185-S449 WeakPolarHBondContact CG-O 3.38Å; R185-S449 PolarHBondContact NE-O 2.96Å; R185-H451 PolarHBondContact NH1-CE1 3.44Å; R185-D470 IonicContact CZ-OD1 3.88Å; R185-D470 VanDerWaalsContact CZ-OD1 3.26Å; R185-D470 IonicContact NE-OD1 3.66Å; R185-D470 PolarHBondContact NE-OD1 3.02Å; R185-D470 VanDerWaalsContact NE-OD1 3.08Å; R185-D470 IonicContact NH2-OD1 3.48Å; R185-D470 PolarHBondContact NH2-OD1 2.73Å; R185-Q473 PolarHBondContact O-NE2 3.48Å; R185-Q473 PolarHBondContact O-OE1 3.07Å; R185-Q473 VanDerWaalsContact O-OE1 3.12Å
186	D	67.4	Low	78.3	Confident	52 Å²	52	61.8 Å²	61.8	28%	0.278	34%	0.338	S	S	.	.			trans	-80.8	106.4	-176.2	-167.7	-32	0	0	0	112.2	H184 K188 C189 N190	H184-D186 VanDerWaalsContact C-N 3.33Å; H184-D186 PolarHBondContact O-N 2.68Å; D186-K188 VanDerWaalsContact C-N 3.33Å; D186-K188 WeakPolarHBondContact OD1-CA 3.37Å; D186-K188 PolarHBondContact OD1-N 3.01Å; D186-C189 HydrophobicContact CB-CB 4.45Å; D186-C189 PolarHBondContact OD1-N 3.22Å; D186-C189 PolarHBondContact OD2-SG 3.27Å; D186-N190 WeakPolarHBondContact O-CB 3.29Å; D186-N190 PolarHBondContact O-ND2 3.07Å
187	I	73.3	Confident	78.4	Confident	16 Å²	16	59.7 Å²	59.7	8%	0.082	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-23.9	-177.4	-56.4	179.1	0	0	0	111.8	R185 L191 F217 Q473	R185-I187 PolarHBondContact O-N 3.42Å; I187-L191 VanDerWaalsContact O-CD2 3.29Å; I187-L191 WeakPolarHBondContact O-CD2 3.41Å; I187-L191 WeakPolarHBondContact O-CG 3.28Å; I187-F217 HydrophobicContact CG2-CB 4.4Å; I187-F217 HydrophobicContact CG2-CD1 3.28Å; I187-F217 HydrophobicContact CG2-CE1 3.64Å; I187-F217 HydrophobicContact CG2-CG 3.95Å; I187-Q473 VanDerWaalsContact N-OE1 3.12Å
188	K	69.6	Low	78.3	Confident	124 Å²	124	63.1 Å²	63.1	54%	0.539	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-46.9	-175.6	-86.7	173	153.1	170.2	0	112.4	D186 N190 G596	D186-K188 VanDerWaalsContact C-N 3.33Å; D186-K188 WeakPolarHBondContact OD1-CA 3.37Å; D186-K188 PolarHBondContact OD1-N 3.01Å; K188-N190 VanDerWaalsContact C-N 3.33Å; K188-G596 WeakPolarHBondContact CE-O 3.4Å; K188-G596 PolarHBondContact NZ-O 2.94Å
189	C	65.1	Low	78.4	Confident	101 Å²	101	64 Å²	64	68%	0.682	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-18	-175	-56.9	0	0	0	0	112.7	D186	D186-C189 HydrophobicContact CB-CB 4.45Å; D186-C189 PolarHBondContact OD1-N 3.22Å; D186-C189 PolarHBondContact OD2-SG 3.27Å
190	N	75.1	Confident	78.8	Confident	57 Å²	57	58.9 Å²	58.9	31%	0.305	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	43.5	178.5	-49.3	-80.6	0	0	0	111.3	H184 D186 K188 V192 P218	H184-N190 HydrophobicContact CB-CB 4.35Å; D186-N190 WeakPolarHBondContact O-CB 3.29Å; D186-N190 PolarHBondContact O-ND2 3.07Å; K188-N190 VanDerWaalsContact C-N 3.33Å; N190-V192 PolarHBondContact O-N 3.16Å; N190-P218 HydrophobicContact CB-CG 3.8Å; N190-P218 WeakPolarHBondContact O-CD 3.37Å; N190-P218 WeakPolarHBondContact O-CG 3.39Å
191	L	81.9	Confident	79.2	Confident	71 Å²	71	59.4 Å²	59.4	37%	0.372	35%	0.35	S	S	.	.			trans	-73.8	115.9	169.8	-77.4	177.7	0	0	0	109.6	I187 H215 F217	I187-L191 VanDerWaalsContact O-CD2 3.29Å; I187-L191 WeakPolarHBondContact O-CD2 3.41Å; I187-L191 WeakPolarHBondContact O-CG 3.28Å; L191-H215 HydrophobicContact CB-CB 3.97Å; L191-H215 HydrophobicContact CD2-CB 4.16Å; L191-H215 HydrophobicContact CG-CB 4.46Å; L191-F217 HydrophobicContact CD2-CD1 3.63Å; L191-F217 HydrophobicContact CD2-CE1 3.94Å
192	V	82.9	Confident	79.7	Confident	41 Å²	41	59.3 Å²	59.3	25%	0.248	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	122	-176.4	-179.5	0	0	0	0	109	N190 V194 S196 V197 H215 F216 A221	N190-V192 PolarHBondContact O-N 3.16Å; V192-V194 PolarHBondContact O-N 3.23Å; V192-S196 VanDerWaalsContact CG1-OG 3.29Å; V192-S196 WeakPolarHBondContact CG1-OG 3.5Å; V192-V197 HydrophobicContact CG1-CG2 3.78Å; V192-H215 CarbonylContact O-C 3.45Å; V192-H215 VanDerWaalsContact O-CA 3.32Å; V192-H215 WeakPolarHBondContact O-CA 3.41Å; V192-F216 PolarHBondContact N-O 3.02Å; V192-F216 PolarHBondContact O-N 2.96Å; V192-A221 HydrophobicContact CB-CB 3.94Å; V192-A221 HydrophobicContact CG1-CB 4.16Å; V192-A221 HydrophobicContact CG2-CB 3.7Å
193	P	86	Confident	80.3	Confident	55 Å²	55	58.8 Å²	58.8	36%	0.357	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-53.7	136.3	177.2	-27.7	36	0	0	0	112.1	S195 S196	P193-S195 PolarHBondContact O-N 3.23Å; P193-S195 VanDerWaalsContact O-N 3.1Å; P193-S196 PolarHBondContact O-N 3.44Å; P193-S196 PolarHBondContact O-OG 3.06Å
194	V	86.7	Confident	80.9	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.018	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-26.4	-175	163.1	0	0	0	0	112.6	V192 L205 L208 I213 Q214 F216	V192-V194 PolarHBondContact O-N 3.23Å; V194-L205 HydrophobicContact CG1-CD2 3.48Å; V194-L205 VanDerWaalsContact CG1-CD2 3.48Å; V194-L205 WeakPolarHBondContact O-CD2 3.4Å; V194-L208 HydrophobicContact CG1-CB 4.2Å; V194-L208 HydrophobicContact CG1-CD1 3.8Å; V194-I213 HydrophobicContact CG2-CG2 4.27Å; V194-Q214 WeakPolarHBondContact CB-O 3.17Å; V194-Q214 WeakPolarHBondContact CG2-O 3.37Å; V194-Q214 PolarHBondContact N-O 2.94Å; V194-F216 HydrophobicContact CB-CD2 4.18Å; V194-F216 HydrophobicContact CB-CE2 4.01Å; V194-F216 HydrophobicContact CG1-CE2 3.89Å; V194-F216 HydrophobicContact CG1-CZ 4.13Å; V194-F216 HydrophobicContact CG2-CD1 4.2Å; V194-F216 HydrophobicContact CG2-CD2 3.67Å; V194-F216 HydrophobicContact CG2-CE1 4.26Å; V194-F216 HydrophobicContact CG2-CE2 3.76Å; V194-F216 HydrophobicContact CG2-CG 3.93Å; V194-F216 HydrophobicContact CG2-CZ 4.06Å
195	S	83.6	Confident	81.7	Confident	100 Å²	100	54.8 Å²	54.8	70%	0.699	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-17.9	174.6	53.1	0	0	0	0	115.5	P193	P193-S195 PolarHBondContact O-N 3.23Å; P193-S195 VanDerWaalsContact O-N 3.1Å
196	S	85.4	Confident	82.9	Confident	74 Å²	74	58.2 Å²	58.2	52%	0.517	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.4	-10.8	-179.2	65.7	0	0	0	0	113.9	V192 P193 S198	V192-S196 VanDerWaalsContact CG1-OG 3.29Å; V192-S196 WeakPolarHBondContact CG1-OG 3.5Å; P193-S196 PolarHBondContact O-N 3.44Å; P193-S196 PolarHBondContact O-OG 3.06Å; S196-S198 PolarHBondContact O-N 3.17Å
197	V	83.9	Confident	84.1	Confident	12 Å²	12	57.4 Å²	57.4	7%	0.073	34%	0.34	C	S	.	.	S	Bend	trans	-79.6	114.9	174	177.4	0	0	0	0	109.5	V192 V200 F216 A221 I224 P225	V192-V197 HydrophobicContact CG1-CG2 3.78Å; V197-V200 HydrophobicContact CG1-CG2 4.1Å; V197-F216 HydrophobicContact CB-CD2 4Å; V197-F216 HydrophobicContact CB-CE2 3.94Å; V197-F216 HydrophobicContact CG1-CE2 4.35Å; V197-F216 HydrophobicContact CG2-CD2 3.49Å; V197-F216 VanDerWaalsContact CG2-CD2 3.49Å; V197-F216 HydrophobicContact CG2-CE2 3.98Å; V197-F216 HydrophobicContact CG2-CG 4.48Å; V197-A221 HydrophobicContact CG2-CB 4.24Å; V197-I224 HydrophobicContact CG1-CG2 4.37Å; V197-P225 HydrophobicContact CG1-CG 3.71Å
198	S	80.8	Confident	85	Confident	82 Å²	82	56.6 Å²	56.6	57%	0.573	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	146.6	-172.3	57.2	0	0	0	0	113.3	S196 V200	S196-S198 PolarHBondContact O-N 3.17Å; S198-V200 VanDerWaalsContact C-N 3.32Å; S198-V200 PolarHBondContact O-N 2.97Å
199	G	82.5	Confident	86	Confident	54 Å²	54	55.7 Å²	55.7	56%	0.557	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.2	-4.9	171.6	0	0	0	0	0	116.8	Q267	G199-Q267 PolarHBondContact O-NE2 3.01Å
200	V	89.3	Confident	87.3	Confident	16 Å²	16	55.1 Å²	55.1	10%	0.097	34%	0.336	C	S	.	.			trans	-74.7	132.6	178.9	-176.7	0	0	0	0	111.4	V197 S198 L204 L205 I224 L228 I263	V197-V200 HydrophobicContact CG1-CG2 4.1Å; S198-V200 VanDerWaalsContact C-N 3.32Å; S198-V200 PolarHBondContact O-N 2.97Å; V200-L204 HydrophobicContact CG1-CB 4.25Å; V200-L205 HydrophobicContact CB-CD2 3.93Å; V200-L205 HydrophobicContact CB-CG 4.48Å; V200-L205 HydrophobicContact CG1-CD2 3.67Å; V200-L205 HydrophobicContact CG1-CG 4.08Å; V200-I224 HydrophobicContact CG2-CG2 3.89Å; V200-L228 HydrophobicContact CG2-CD1 4.29Å; V200-I263 HydrophobicContact CG1-CG2 4.26Å
201	S	90.3	Very high	88	Confident	30 Å²	30	56.4 Å²	56.4	21%	0.21	34%	0.343	C	S	.	.			trans	-73.6	142.9	-172.5	82	0	0	0	0	113.6	Q203 L204 L205	S201-Q203 PolarHBondContact O-N 3.01Å; S201-L204 WeakPolarHBondContact O-CA 3.48Å; S201-L204 PolarHBondContact O-N 3.27Å; S201-L205 WeakPolarHBondContact O-CG 3.48Å; S201-L205 PolarHBondContact O-N 2.99Å
202	A	90.6	Very high	88.3	Confident	63 Å²	63	56 Å²	56	52%	0.521	36%	0.356	S	S	.	.	H	α-helix	trans	-63.3	-9.3	-178.8	0	0	0	0	0	115.2	R206	A202-R206 PolarHBondContact O-NE 2.78Å; A202-R206 PolarHBondContact O-NH2 3.09Å
203	Q	91.8	Very high	88.7	Confident	69 Å²	69	55.9 Å²	55.9	32%	0.322	35%	0.354	S	S	.	.	H	α-helix	trans	-83.9	-35.4	168	-166.1	-172.9	4.2	0	0	111.7	S201 K207 M270 G302	S201-Q203 PolarHBondContact O-N 3.01Å; Q203-K207 WeakPolarHBondContact O-CG 3.46Å; Q203-K207 PolarHBondContact O-N 2.96Å; Q203-M270 HydrophobicContact CB-CE 4.35Å; Q203-G302 PolarHBondContact NE2-O 3.44Å
204	L	91.6	Very high	88.8	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-78.8	-36	177.7	-67.1	172.9	0	0	0	111.9	V200 S201 K207 L208 I263 I266 Q267 M270	V200-L204 HydrophobicContact CG1-CB 4.25Å; S201-L204 WeakPolarHBondContact O-CA 3.48Å; S201-L204 PolarHBondContact O-N 3.27Å; L204-K207 HydrophobicContact CD2-CD 4.29Å; L204-K207 WeakPolarHBondContact O-CB 3.43Å; L204-K207 PolarHBondContact O-N 2.88Å; L204-K207 VanDerWaalsContact O-N 3.16Å; L204-L208 WeakPolarHBondContact O-CG 3.32Å; L204-L208 PolarHBondContact O-N 3.05Å; L204-I263 HydrophobicContact CD1-CG2 4.36Å; L204-I266 HydrophobicContact CD2-CG2 4.13Å; L204-Q267 HydrophobicContact CD1-CB 3.6Å; L204-Q267 HydrophobicContact CD1-CG 4.08Å; L204-M270 HydrophobicContact CD1-SD 4Å; L204-M270 HydrophobicContact CD2-SD 4.42Å; L204-M270 HydrophobicContact CG-SD 4.12Å
205	L	92	Very high	89	Confident	35 Å²	35	63.5 Å²	63.5	18%	0.183	38%	0.384	C	S	.	.	H	α-helix	trans	-53.9	-55.3	171.6	-63.3	176.2	0	0	0	111.1	V194 V200 S201 K207 L208 E209	V194-L205 HydrophobicContact CG1-CD2 3.48Å; V194-L205 VanDerWaalsContact CG1-CD2 3.48Å; V194-L205 WeakPolarHBondContact O-CD2 3.4Å; V200-L205 HydrophobicContact CB-CD2 3.93Å; V200-L205 HydrophobicContact CB-CG 4.48Å; V200-L205 HydrophobicContact CG1-CD2 3.67Å; V200-L205 HydrophobicContact CG1-CG 4.08Å; S201-L205 WeakPolarHBondContact O-CG 3.48Å; S201-L205 PolarHBondContact O-N 2.99Å; L205-K207 PolarHBondContact O-N 3.2Å; L205-K207 VanDerWaalsContact O-N 3.16Å; L205-L208 WeakPolarHBondContact O-CB 3.2Å; L205-L208 PolarHBondContact O-N 3.06Å; L205-E209 WeakPolarHBondContact O-CG 3.19Å; L205-E209 PolarHBondContact O-N 2.89Å
206	R	91.7	Very high	89.3	Confident	168 Å²	168	58.7 Å²	58.7	63%	0.634	35%	0.351	S	S	*	.	H	α-helix	trans	-59.2	-28.9	177.2	-75.2	-179.1	-72.5	168	-5.2	114.1	A202 E209 A210	A202-R206 PolarHBondContact O-NE 2.78Å; A202-R206 PolarHBondContact O-NH2 3.09Å; R206-E209 WeakPolarHBondContact CA-OE2 3.4Å; R206-A210 VanDerWaalsContact O-CB 3.24Å; R206-A210 WeakPolarHBondContact O-CB 3.49Å; R206-A210 PolarHBondContact O-N 3.18Å
207	K	92.3	Very high	89.6	Confident	34 Å²	34	57.3 Å²	57.3	15%	0.148	34%	0.336	C	S	.	.	H	α-helix	trans	-77	-34	173.7	-79.7	172.1	169.6	174.2	0	113.3	Q203 L204 L205 N211 Y299 E301	Q203-K207 WeakPolarHBondContact O-CG 3.46Å; Q203-K207 PolarHBondContact O-N 2.96Å; L204-K207 HydrophobicContact CD2-CD 4.29Å; L204-K207 WeakPolarHBondContact O-CB 3.43Å; L204-K207 PolarHBondContact O-N 2.88Å; L204-K207 VanDerWaalsContact O-N 3.16Å; L205-K207 PolarHBondContact O-N 3.2Å; L205-K207 VanDerWaalsContact O-N 3.16Å; K207-N211 WeakPolarHBondContact O-CB 3.38Å; K207-N211 PolarHBondContact O-N 3.1Å; K207-N211 VanDerWaalsContact O-N 3.08Å; K207-N211 PolarHBondContact O-ND2 2.64Å; K207-Y299 HydrophobicContact CB-CD1 4.14Å; K207-Y299 HydrophobicContact CB-CE1 4.21Å; K207-Y299 PolarHBondContact NZ-O 2.92Å; K207-E301 WeakPolarHBondContact CE-O 3.26Å; K207-E301 PolarHBondContact NZ-O 3.4Å
208	L	92.4	Very high	89.8	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-65.2	-48.7	173	-72.9	159.7	0	0	0	109	V194 L204 L205 A210 N211 G212 I213 F216 I263 Y299	V194-L208 HydrophobicContact CG1-CB 4.2Å; V194-L208 HydrophobicContact CG1-CD1 3.8Å; L204-L208 WeakPolarHBondContact O-CG 3.32Å; L204-L208 PolarHBondContact O-N 3.05Å; L205-L208 WeakPolarHBondContact O-CB 3.2Å; L205-L208 PolarHBondContact O-N 3.06Å; L208-A210 PolarHBondContact O-N 2.86Å; L208-N211 CarbonylContact O-C 3.57Å; L208-N211 PolarHBondContact O-N 2.97Å; L208-N211 VanDerWaalsContact O-N 3.12Å; L208-G212 PolarHBondContact O-N 2.78Å; L208-I213 CarbonylContact C-O 3.56Å; L208-I213 HydrophobicContact CB-CB 4.22Å; L208-I213 HydrophobicContact CD2-CB 4.23Å; L208-I213 HydrophobicContact CD2-CD1 4.13Å; L208-I213 HydrophobicContact CD2-CG2 4.2Å; L208-I213 WeakPolarHBondContact O-CA 3.28Å; L208-I213 WeakPolarHBondContact O-CB 3.43Å; L208-I213 PolarHBondContact O-N 3.42Å; L208-F216 HydrophobicContact CD1-CE1 3.94Å; L208-F216 HydrophobicContact CD1-CZ 3.56Å; L208-F216 HydrophobicContact CD2-CE1 4.23Å; L208-I263 HydrophobicContact CD1-CD1 4.45Å; L208-I263 HydrophobicContact CD2-CD1 3.93Å; L208-I263 HydrophobicContact CD2-CG1 4.33Å; L208-I263 HydrophobicContact CG-CD1 4.32Å; L208-Y299 HydrophobicContact CD2-CE1 3.78Å; L208-Y299 HydrophobicContact CG-CE1 4.02Å
209	E	90.8	Very high	90.3	Very high	104 Å²	104	53.3 Å²	53.3	49%	0.486	31%	0.308	S	S	.	.	H	α-helix	trans	-56.1	-50.2	174.4	-68	165.7	171.4	0	0	112.2	L205 R206 N211 G212	L205-E209 WeakPolarHBondContact O-CG 3.19Å; L205-E209 PolarHBondContact O-N 2.89Å; R206-E209 WeakPolarHBondContact CA-OE2 3.4Å; E209-N211 PolarHBondContact O-N 2.78Å; E209-G212 WeakPolarHBondContact O-CA 3.19Å; E209-G212 PolarHBondContact O-N 2.86Å
210	A	91.6	Very high	90.8	Very high	89 Å²	89	50.9 Å²	50.9	74%	0.736	28%	0.282	S	S	*	.	H	α-helix	trans	-63.5	-26.3	177.5	0	0	0	0	0	113.8	R206 L208 G212	R206-A210 VanDerWaalsContact O-CB 3.24Å; R206-A210 WeakPolarHBondContact O-CB 3.49Å; R206-A210 PolarHBondContact O-N 3.18Å; L208-A210 PolarHBondContact O-N 2.86Å; A210-G212 VanDerWaalsContact C-N 3.28Å
211	N	89.9	Confident	90.9	Very high	84 Å²	84	50.7 Å²	50.7	45%	0.449	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	7.2	171.4	-78.8	-60.6	0	0	0	113.4	K207 L208 E209 Y299	K207-N211 WeakPolarHBondContact O-CB 3.38Å; K207-N211 PolarHBondContact O-N 3.1Å; K207-N211 VanDerWaalsContact O-N 3.08Å; K207-N211 PolarHBondContact O-ND2 2.64Å; L208-N211 CarbonylContact O-C 3.57Å; L208-N211 PolarHBondContact O-N 2.97Å; L208-N211 VanDerWaalsContact O-N 3.12Å; E209-N211 PolarHBondContact O-N 2.78Å; N211-Y299 PolarHBondContact ND2-OH 2.66Å
212	G	89.3	Confident	90.9	Very high	63 Å²	63	53.6 Å²	53.6	65%	0.649	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.3	16.3	179.1	0	0	0	0	0	115	L208 E209 A210	L208-G212 PolarHBondContact O-N 2.78Å; E209-G212 WeakPolarHBondContact O-CA 3.19Å; E209-G212 PolarHBondContact O-N 2.86Å; A210-G212 VanDerWaalsContact C-N 3.28Å
213	I	89.6	Confident	91	Very high	38 Å²	38	50.6 Å²	50.6	20%	0.195	27%	0.267	C	S	.	.			trans	-102.2	92.3	-178.4	-50.5	-172.2	0	0	0	109.3	V194 L208 H215 L259 Y299	V194-I213 HydrophobicContact CG2-CG2 4.27Å; L208-I213 CarbonylContact C-O 3.56Å; L208-I213 HydrophobicContact CB-CB 4.22Å; L208-I213 HydrophobicContact CD2-CB 4.23Å; L208-I213 HydrophobicContact CD2-CD1 4.13Å; L208-I213 HydrophobicContact CD2-CG2 4.2Å; L208-I213 WeakPolarHBondContact O-CA 3.28Å; L208-I213 WeakPolarHBondContact O-CB 3.43Å; L208-I213 PolarHBondContact O-N 3.42Å; I213-H215 WeakPolarHBondContact CG2-O 3.35Å; I213-L259 HydrophobicContact CD1-CD1 3.44Å; I213-L259 VanDerWaalsContact CD1-CD1 3.44Å; I213-Y299 WeakPolarHBondContact CD1-OH 3.39Å
214	Q	87.9	Confident	91.2	Very high	140 Å²	140	47.3 Å²	47.3	65%	0.654	25%	0.252	S	S	*	.			trans	-87.7	-23.4	174.8	-65.6	172.3	-15.1	0	0	112.9	V194	V194-Q214 WeakPolarHBondContact CB-O 3.17Å; V194-Q214 WeakPolarHBondContact CG2-O 3.37Å; V194-Q214 PolarHBondContact N-O 2.94Å
215	H	91.1	Very high	91.2	Very high	78 Å²	78	48.4 Å²	48.4	36%	0.361	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	140.5	-176.4	-59.2	83	0	0	0	110.7	L191 V192 I213	L191-H215 HydrophobicContact CB-CB 3.97Å; L191-H215 HydrophobicContact CD2-CB 4.16Å; L191-H215 HydrophobicContact CG-CB 4.46Å; V192-H215 CarbonylContact O-C 3.45Å; V192-H215 VanDerWaalsContact O-CA 3.32Å; V192-H215 WeakPolarHBondContact O-CA 3.41Å; I213-H215 WeakPolarHBondContact CG2-O 3.35Å
216	F	91.1	Very high	91.1	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	148.6	167.9	-72.4	-58	0	0	0	110.9	V192 V194 V197 L208 Q220 I224	V192-F216 PolarHBondContact N-O 3.02Å; V192-F216 PolarHBondContact O-N 2.96Å; V194-F216 HydrophobicContact CB-CD2 4.18Å; V194-F216 HydrophobicContact CB-CE2 4.01Å; V194-F216 HydrophobicContact CG1-CE2 3.89Å; V194-F216 HydrophobicContact CG1-CZ 4.13Å; V194-F216 HydrophobicContact CG2-CD1 4.2Å; V194-F216 HydrophobicContact CG2-CD2 3.67Å; V194-F216 HydrophobicContact CG2-CE1 4.26Å; V194-F216 HydrophobicContact CG2-CE2 3.76Å; V194-F216 HydrophobicContact CG2-CG 3.93Å; V194-F216 HydrophobicContact CG2-CZ 4.06Å; V197-F216 HydrophobicContact CB-CD2 4Å; V197-F216 HydrophobicContact CB-CE2 3.94Å; V197-F216 HydrophobicContact CG1-CE2 4.35Å; V197-F216 HydrophobicContact CG2-CD2 3.49Å; V197-F216 VanDerWaalsContact CG2-CD2 3.49Å; V197-F216 HydrophobicContact CG2-CE2 3.98Å; V197-F216 HydrophobicContact CG2-CG 4.48Å; L208-F216 HydrophobicContact CD1-CE1 3.94Å; L208-F216 HydrophobicContact CD1-CZ 3.56Å; L208-F216 HydrophobicContact CD2-CE1 4.23Å; F216-Q220 HydrophobicContact CB-CB 3.95Å; F216-Q220 HydrophobicContact CD1-CB 3.86Å; F216-Q220 HydrophobicContact CG-CB 4.17Å; F216-I224 HydrophobicContact CD1-CD1 4.15Å; F216-I224 HydrophobicContact CE1-CD1 3.7Å; F216-I224 HydrophobicContact CZ-CD1 3.92Å
217	F	90.4	Very high	91.2	Very high	45 Å²	45	40 Å²	40	20%	0.197	23%	0.23	C	C	.	.			trans	-77.2	159.1	166.8	-56	-52.4	0	0	0	110.8	I187 L191 V219 Q220 A221 S255 A595	I187-F217 HydrophobicContact CG2-CB 4.4Å; I187-F217 HydrophobicContact CG2-CD1 3.28Å; I187-F217 HydrophobicContact CG2-CE1 3.64Å; I187-F217 HydrophobicContact CG2-CG 3.95Å; L191-F217 HydrophobicContact CD2-CD1 3.63Å; L191-F217 HydrophobicContact CD2-CE1 3.94Å; F217-V219 VanDerWaalsContact C-N 3.35Å; F217-V219 PolarHBondContact O-N 2.77Å; F217-Q220 WeakPolarHBondContact O-CA 3.46Å; F217-Q220 WeakPolarHBondContact O-CB 3.4Å; F217-Q220 PolarHBondContact O-N 3.43Å; F217-A221 PolarHBondContact O-N 3.24Å; F217-S255 VanDerWaalsContact CD2-O 3.28Å; F217-S255 WeakPolarHBondContact CD2-O 3.24Å; F217-A595 HydrophobicContact CE1-CB 4.22Å; F217-A595 HydrophobicContact CZ-CB 3.74Å
218	P	89.4	Confident	91.1	Very high	7 Å²	7	39 Å²	39	5%	0.045	23%	0.227	C	C	.	.	H	α-helix	trans	-49.8	-46.5	-178.7	-33	38	0	0	0	115	I183 H184 N190 Q220 A221 E222	I183-P218 HydrophobicContact CG2-CB 3.73Å; H184-P218 HydrophobicContact CB-CB 4.15Å; H184-P218 HydrophobicContact CB-CG 4.24Å; N190-P218 HydrophobicContact CB-CG 3.8Å; N190-P218 WeakPolarHBondContact O-CD 3.37Å; N190-P218 WeakPolarHBondContact O-CG 3.39Å; P218-Q220 PolarHBondContact O-N 3.15Å; P218-Q220 VanDerWaalsContact O-N 3.15Å; P218-A221 PolarHBondContact O-N 3.26Å; P218-A221 VanDerWaalsContact O-N 3.12Å; P218-E222 PolarHBondContact O-N 3.23Å
219	V	90.8	Very high	90.8	Very high	3 Å²	3	42.4 Å²	42.4	2%	0.018	24%	0.242	C	C	.	.	H	α-helix	trans	-63.7	-20.6	177.8	66.5	0	0	0	0	113.9	I183 F217 V223 V249 A251 S255 K257	I183-V219 HydrophobicContact CD1-CB 4.06Å; I183-V219 HydrophobicContact CD1-CG2 3.72Å; I183-V219 HydrophobicContact CG2-CB 4.12Å; F217-V219 VanDerWaalsContact C-N 3.35Å; F217-V219 PolarHBondContact O-N 2.77Å; V219-V223 HydrophobicContact CG2-CG2 4.27Å; V219-V223 VanDerWaalsContact O-CB 3.24Å; V219-V223 WeakPolarHBondContact O-CB 3.49Å; V219-V223 WeakPolarHBondContact O-CG2 3.38Å; V219-V249 HydrophobicContact CG2-CG1 3.45Å; V219-V249 VanDerWaalsContact CG2-CG1 3.45Å; V219-A251 HydrophobicContact CB-CB 4.17Å; V219-A251 HydrophobicContact CG2-CB 3.88Å; V219-S255 WeakPolarHBondContact CG1-O 3.39Å; V219-K257 HydrophobicContact CG2-CG 4.26Å
220	Q	93.1	Very high	90.4	Very high	3 Å²	3	37.9 Å²	37.9	1%	0.014	22%	0.224	C	C	.	.	H	α-helix	trans	-85.4	-40.7	173.8	-64.9	163.4	-18.3	0	0	110.4	F216 F217 P218 E222 I224 G256 A260	F216-Q220 HydrophobicContact CB-CB 3.95Å; F216-Q220 HydrophobicContact CD1-CB 3.86Å; F216-Q220 HydrophobicContact CG-CB 4.17Å; F217-Q220 WeakPolarHBondContact O-CA 3.46Å; F217-Q220 WeakPolarHBondContact O-CB 3.4Å; F217-Q220 PolarHBondContact O-N 3.43Å; P218-Q220 PolarHBondContact O-N 3.15Å; P218-Q220 VanDerWaalsContact O-N 3.15Å; Q220-E222 PolarHBondContact O-N 2.85Å; Q220-I224 HydrophobicContact CB-CD1 4.04Å; Q220-I224 VanDerWaalsContact O-CB 3.26Å; Q220-I224 WeakPolarHBondContact O-CB 3.46Å; Q220-I224 WeakPolarHBondContact O-CD1 3.46Å; Q220-I224 WeakPolarHBondContact O-CG1 3.36Å; Q220-I224 PolarHBondContact O-N 3.41Å; Q220-I224 VanDerWaalsContact O-N 3.07Å; Q220-G256 PolarHBondContact NE2-O 3.24Å; Q220-A260 HydrophobicContact CG-CB 4.07Å
221	A	90.9	Very high	90	Very high	12 Å²	12	34 Å²	34	10%	0.099	19%	0.192	C	C	.	.	H	α-helix	trans	-61.5	-40	177.9	0	0	0	0	0	113	V192 V197 F217 P218 P225	V192-A221 HydrophobicContact CB-CB 3.94Å; V192-A221 HydrophobicContact CG1-CB 4.16Å; V192-A221 HydrophobicContact CG2-CB 3.7Å; V197-A221 HydrophobicContact CG2-CB 4.24Å; F217-A221 PolarHBondContact O-N 3.24Å; P218-A221 PolarHBondContact O-N 3.26Å; P218-A221 VanDerWaalsContact O-N 3.12Å; A221-P225 WeakPolarHBondContact O-CD 3.25Å; A221-P225 VanDerWaalsContact O-CG 3.3Å; A221-P225 WeakPolarHBondContact O-CG 3.5Å
222	E	90.8	Very high	89.3	Confident	91 Å²	91	36 Å²	36	43%	0.425	20%	0.198	S	C	.	.	H	α-helix	trans	-75.9	-47.4	176.8	-60	-52.1	137.2	0	0	112.9	P218 Q220 A226 F447	P218-E222 PolarHBondContact O-N 3.23Å; Q220-E222 PolarHBondContact O-N 2.85Å; E222-A226 PolarHBondContact O-N 3.02Å; E222-F447 HydrophobicContact CB-CD1 4.05Å; E222-F447 HydrophobicContact CB-CE1 4.08Å
223	V	93.4	Very high	88.6	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-81.3	-28.3	-167.2	176.9	0	0	0	0	112.8	V219 A226 I227 V249 A260 F425 F447	V219-V223 HydrophobicContact CG2-CG2 4.27Å; V219-V223 VanDerWaalsContact O-CB 3.24Å; V219-V223 WeakPolarHBondContact O-CB 3.49Å; V219-V223 WeakPolarHBondContact O-CG2 3.38Å; V223-A226 PolarHBondContact O-N 3.05Å; V223-I227 HydrophobicContact CG1-CD1 3.72Å; V223-I227 HydrophobicContact CG1-CG1 4.27Å; V223-I227 WeakPolarHBondContact O-CG1 3.4Å; V223-I227 PolarHBondContact O-N 2.84Å; V223-I227 VanDerWaalsContact O-N 3.12Å; V223-V249 HydrophobicContact CG1-CG2 4.17Å; V223-V249 HydrophobicContact CG2-CG1 4.33Å; V223-V249 HydrophobicContact CG2-CG2 3.83Å; V223-A260 HydrophobicContact CB-CB 4.22Å; V223-A260 HydrophobicContact CG1-CB 4.23Å; V223-F425 HydrophobicContact CG1-CE1 4.25Å; V223-F425 HydrophobicContact CG1-CZ 4.18Å; V223-F447 HydrophobicContact CG2-CB 4.31Å; V223-F447 HydrophobicContact CG2-CD1 4.3Å; V223-F447 HydrophobicContact CG2-CD2 4.07Å; V223-F447 HydrophobicContact CG2-CE2 4.48Å; V223-F447 HydrophobicContact CG2-CG 3.97Å
224	I	94.5	Very high	87.9	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-65.7	-52.3	-179.9	-66.9	173.6	0	0	0	111.1	V197 V200 F216 Q220 A226 I227 L228 I263 P264	V197-I224 HydrophobicContact CG1-CG2 4.37Å; V200-I224 HydrophobicContact CG2-CG2 3.89Å; F216-I224 HydrophobicContact CD1-CD1 4.15Å; F216-I224 HydrophobicContact CE1-CD1 3.7Å; F216-I224 HydrophobicContact CZ-CD1 3.92Å; Q220-I224 HydrophobicContact CB-CD1 4.04Å; Q220-I224 VanDerWaalsContact O-CB 3.26Å; Q220-I224 WeakPolarHBondContact O-CB 3.46Å; Q220-I224 WeakPolarHBondContact O-CD1 3.46Å; Q220-I224 WeakPolarHBondContact O-CG1 3.36Å; Q220-I224 PolarHBondContact O-N 3.41Å; Q220-I224 VanDerWaalsContact O-N 3.07Å; I224-A226 PolarHBondContact O-N 3.12Å; I224-I227 PolarHBondContact O-N 3.19Å; I224-L228 HydrophobicContact CG2-CD1 4.02Å; I224-L228 WeakPolarHBondContact O-CG 3.47Å; I224-L228 PolarHBondContact O-N 3.35Å; I224-L228 VanDerWaalsContact O-N 3.07Å; I224-I263 HydrophobicContact CD1-CB 4.33Å; I224-P264 HydrophobicContact CG1-CG 4.39Å; I224-P264 HydrophobicContact CG2-CB 4.37Å; I224-P264 HydrophobicContact CG2-CG 4.45Å
225	P	91.8	Very high	87.2	Confident	23 Å²	23	32.5 Å²	32.5	15%	0.149	17%	0.17	C	C	.	.	H	α-helix	trans	-57.5	-43.7	173.1	-26.2	36.7	0	0	0	112.9	V197 A221 I227 L228 E229	V197-P225 HydrophobicContact CG1-CG 3.71Å; A221-P225 WeakPolarHBondContact O-CD 3.25Å; A221-P225 VanDerWaalsContact O-CG 3.3Å; A221-P225 WeakPolarHBondContact O-CG 3.5Å; P225-I227 VanDerWaalsContact C-N 3.27Å; P225-I227 PolarHBondContact O-N 3.39Å; P225-L228 PolarHBondContact O-N 3.37Å; P225-E229 PolarHBondContact O-N 3.39Å
226	A	91.4	Very high	86.3	Confident	25 Å²	25	32.2 Å²	32.2	21%	0.207	17%	0.171	C	C	.	.	H	α-helix	trans	-59.9	-33.8	-179.6	0	0	0	0	0	113.5	E222 V223 I224 L247 F447	E222-A226 PolarHBondContact O-N 3.02Å; V223-A226 PolarHBondContact O-N 3.05Å; I224-A226 PolarHBondContact O-N 3.12Å; A226-L247 HydrophobicContact CB-CD1 4.32Å; A226-F447 HydrophobicContact CB-CE2 4.25Å; A226-F447 HydrophobicContact CB-CZ 3.69Å
227	I	92.4	Very high	85.3	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-76.3	-39.5	173.2	-63.9	167.6	0	0	0	111.1	V223 I224 P225 G230 L247 P264 F362 L423	V223-I227 HydrophobicContact CG1-CD1 3.72Å; V223-I227 HydrophobicContact CG1-CG1 4.27Å; V223-I227 WeakPolarHBondContact O-CG1 3.4Å; V223-I227 PolarHBondContact O-N 2.84Å; V223-I227 VanDerWaalsContact O-N 3.12Å; I224-I227 PolarHBondContact O-N 3.19Å; P225-I227 VanDerWaalsContact C-N 3.27Å; P225-I227 PolarHBondContact O-N 3.39Å; I227-G230 PolarHBondContact O-N 3.13Å; I227-L247 HydrophobicContact CD1-CD1 4.49Å; I227-L247 HydrophobicContact CG1-CD1 3.62Å; I227-P264 HydrophobicContact CB-CB 3.93Å; I227-P264 HydrophobicContact CB-CG 3.94Å; I227-P264 HydrophobicContact CD1-CG 3.86Å; I227-P264 HydrophobicContact CG2-CB 3.74Å; I227-P264 HydrophobicContact CG2-CG 3.92Å; I227-F362 HydrophobicContact CG2-CE1 4.13Å; I227-L423 HydrophobicContact CD1-CD1 3.98Å; I227-L423 HydrophobicContact CD1-CD2 4.34Å; I227-L423 HydrophobicContact CG1-CD1 4.42Å; I227-L423 HydrophobicContact CG1-CD2 4.19Å
228	L	90.7	Very high	84.2	Confident	14 Å²	14	33.8 Å²	33.8	7%	0.073	18%	0.18	C	C	.	.	H	α-helix	trans	-67.1	-43.8	179.6	-69.1	177.7	0	0	0	112.5	V200 I224 P225 G230 A231 Q232 P264 Q267 V268	V200-L228 HydrophobicContact CG2-CD1 4.29Å; I224-L228 HydrophobicContact CG2-CD1 4.02Å; I224-L228 WeakPolarHBondContact O-CG 3.47Å; I224-L228 PolarHBondContact O-N 3.35Å; I224-L228 VanDerWaalsContact O-N 3.07Å; P225-L228 PolarHBondContact O-N 3.37Å; L228-G230 PolarHBondContact O-N 2.96Å; L228-A231 CarbonylContact O-C 3.6Å; L228-A231 WeakPolarHBondContact O-CA 3.47Å; L228-A231 PolarHBondContact O-N 2.81Å; L228-Q232 PolarHBondContact O-N 3.19Å; L228-P264 HydrophobicContact CD2-CB 3.71Å; L228-P264 HydrophobicContact CG-CB 3.87Å; L228-Q267 HydrophobicContact CD2-CB 4.28Å; L228-Q267 HydrophobicContact CD2-CG 4.44Å; L228-V268 HydrophobicContact CD2-CG2 4.15Å
229	E	87	Confident	83.2	Confident	71 Å²	71	41.4 Å²	41.4	33%	0.332	21%	0.208	S	C	.	.	H	α-helix	trans	-54.3	-40	172.5	-81.5	-164.2	-147.6	0	0	112.1	P225 A231 Q232 R239	P225-E229 PolarHBondContact O-N 3.39Å; E229-A231 PolarHBondContact O-N 2.87Å; E229-Q232 PolarHBondContact O-N 3.41Å; E229-R239 IonicContact OE2-CZ 2.66Å; E229-R239 IonicContact OE2-NH1 2.64Å; E229-R239 PolarHBondContact OE2-NH1 2.6Å
230	G	82.1	Confident	82	Confident	9 Å²	9	44 Å²	44	9%	0.093	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-7.4	174.9	0	0	0	0	0	114.8	I227 L228 R361	I227-G230 PolarHBondContact O-N 3.13Å; L228-G230 PolarHBondContact O-N 2.96Å; G230-R361 PolarHBondContact O-NH2 2.92Å
231	A	82.1	Confident	81	Confident	9 Å²	9	45.9 Å²	45.9	7%	0.074	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.9	6.5	-178.4	0	0	0	0	0	114.5	L228 E229 H233 G234 V268	L228-A231 CarbonylContact O-C 3.6Å; L228-A231 WeakPolarHBondContact O-CA 3.47Å; L228-A231 PolarHBondContact O-N 2.81Å; E229-A231 PolarHBondContact O-N 2.87Å; A231-H233 PolarHBondContact O-N 3.03Å; A231-H233 VanDerWaalsContact O-N 3.07Å; A231-G234 PolarHBondContact O-N 2.89Å; A231-V268 HydrophobicContact CB-CB 4.38Å; A231-V268 HydrophobicContact CB-CG1 3.87Å; A231-V268 HydrophobicContact CB-CG2 3.5Å; A231-V268 VanDerWaalsContact CB-CG2 3.5Å
232	Q	75.4	Confident	80.2	Confident	124 Å²	124	51.9 Å²	51.9	58%	0.579	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-17.5	-179.4	-83.3	175	1.8	0	0	114.8	L228 E229	L228-Q232 PolarHBondContact O-N 3.19Å; E229-Q232 PolarHBondContact O-N 3.41Å
233	H	74	Confident	79.7	Confident	108 Å²	108	50 Å²	50	50%	0.5	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.4	25.7	174.7	-50.3	-36.5	0	0	0	111.8	A231 I237	A231-H233 PolarHBondContact O-N 3.03Å; A231-H233 VanDerWaalsContact O-N 3.07Å; H233-I237 HydrophobicContact CB-CG2 4.4Å
234	G	75.9	Confident	79.4	Confident	22 Å²	22	50.6 Å²	50.6	23%	0.227	27%	0.27	C	S	.	.			trans	80.7	-157.6	179	0	0	0	0	0	113.9	A231	A231-G234 PolarHBondContact O-N 2.89Å
235	F	73.1	Confident	79.1	Confident	38 Å²	38	56.4 Å²	56.4	17%	0.167	29%	0.292	C	S	.	.	S	Bend	trans	-76.3	-38	-168.2	-68.1	-75.4	0	0	0	115	V268 L269 R272 R361 M418 P419	F235-V268 HydrophobicContact CD1-CG1 4.31Å; F235-V268 HydrophobicContact CE1-CG1 3.89Å; F235-V268 VanDerWaalsContact CE1-O 3.25Å; F235-V268 WeakPolarHBondContact CE1-O 3.46Å; F235-V268 WeakPolarHBondContact CZ-O 3.42Å; F235-L269 HydrophobicContact CE1-CD2 4.12Å; F235-R272 HydrophobicContact CE1-CB 4.42Å; F235-R272 HydrophobicContact CE2-CB 4.17Å; F235-R272 HydrophobicContact CZ-CB 3.64Å; F235-R361 PolarHBondContact O-NE 3.5Å; F235-M418 HydrophobicContact CB-CE 3.95Å; F235-M418 HydrophobicContact CB-SD 3.86Å; F235-P419 VanDerWaalsContact O-CD 3.25Å; F235-P419 WeakPolarHBondContact O-CD 3.39Å
236	L	71.1	Confident	79.2	Confident	73 Å²	73	55.3 Å²	55.3	38%	0.382	29%	0.285	S	S	.	.	S	Bend	trans	-89.7	-23.6	-165.3	-60	178.3	0	0	0	113.9	M418	L236-M418 HydrophobicContact CD2-CB 4.11Å; L236-M418 HydrophobicContact CD2-CE 4.28Å
237	I	70	Confident	79.4	Confident	76 Å²	76	54.3 Å²	54.3	39%	0.39	28%	0.276	S	S	.	.			trans	-133.1	130.2	-169.5	-70.3	171.5	0	0	0	108.9	H233	H233-I237 HydrophobicContact CB-CG2 4.4Å
238	G	67.6	Low	79.4	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.01	28%	0.276	C	S	.	.			trans	-89.1	179.5	169.5	0	0	0	0	0	112.2	G240 G241 Y242	G238-G240 PolarHBondContact O-N 3.19Å; G238-G241 PolarHBondContact O-N 3.05Å; G238-Y242 WeakPolarHBondContact CA-O 3.25Å; G238-Y242 PolarHBondContact N-O 3.36Å
239	R	68.3	Low	79.5	Confident	167 Å²	167	53.7 Å²	53.7	63%	0.63	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-45.3	122.6	178.8	-172.8	171.3	174.1	178.7	-4.4	111.7	E229 G241	E229-R239 IonicContact OE2-CZ 2.66Å; E229-R239 IonicContact OE2-NH1 2.64Å; E229-R239 PolarHBondContact OE2-NH1 2.6Å; R239-G241 PolarHBondContact O-N 3.48Å
240	G	66.5	Low	79.7	Confident	59 Å²	59	50.6 Å²	50.6	61%	0.608	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	71	17.5	177.7	0	0	0	0	0	116.5	G238 Y242	G238-G240 PolarHBondContact O-N 3.19Å; G240-Y242 WeakPolarHBondContact O-CD2 3.48Å; G240-Y242 WeakPolarHBondContact O-CE2 3.08Å
241	G	71.3	Confident	80	Confident	41 Å²	41	50.3 Å²	50.3	42%	0.423	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	94.6	-9.6	-179.7	0	0	0	0	0	114.5	G238 R239	G238-G241 PolarHBondContact O-N 3.05Å; R239-G241 PolarHBondContact O-N 3.48Å
242	Y	75.2	Confident	80	Confident	138 Å²	138	50.6 Å²	50.6	54%	0.541	26%	0.256	S	S	.	.	S	Bend	trans	-90	163	-171.2	-61.5	-73.8	0	0	0	113.7	G238 G240	G238-Y242 WeakPolarHBondContact CA-O 3.25Å; G238-Y242 PolarHBondContact N-O 3.36Å; G240-Y242 WeakPolarHBondContact O-CD2 3.48Å; G240-Y242 WeakPolarHBondContact O-CE2 3.08Å
243	R	80.8	Confident	80.3	Confident	52 Å²	52	45.5 Å²	45.5	20%	0.196	23%	0.234	C	C	.	.	P	Polyproline II helix	trans	-66.5	129	167.4	173.9	170.5	174.4	-149.3	-9.7	109.5	D246 P419 L420 H442	R243-D246 IonicContact NH2-OD1 2.75Å; R243-P419 HydrophobicContact CG-CB 3.92Å; R243-L420 VanDerWaalsContact CZ-O 3.27Å; R243-L420 PolarHBondContact NE-O 3.2Å; R243-L420 PolarHBondContact NH2-O 3.45Å; R243-H442 VanDerWaalsContact CZ-CB 3.49Å
244	P	86.8	Confident	80.4	Confident	12 Å²	12	41.5 Å²	41.5	8%	0.078	22%	0.221	C	C	.	.	P	Polyproline II helix	trans	-66.3	148.9	176.1	24.2	-31.2	0	0	0	112.2	P419	P244-P419 HydrophobicContact CG-CB 4.42Å; P244-P419 HydrophobicContact CG-CG 4.1Å
245	R	88.8	Confident	80.6	Confident	123 Å²	123	40.7 Å²	40.7	46%	0.464	21%	0.212	S	C	.	.	P	Polyproline II helix	trans	-67.7	140.9	-176.5	-65.7	-171.6	174.6	-158.7	1.3	112.3	L247 Q421 Q443	R245-L247 HydrophobicContact CB-CD2 4.41Å; R245-Q421 VanDerWaalsContact O-CG 3.27Å; R245-Q421 WeakPolarHBondContact O-CG 3.38Å; R245-Q421 PolarHBondContact O-NE2 2.91Å; R245-Q443 VanDerWaalsContact CB-O 3.32Å; R245-Q443 WeakPolarHBondContact CB-O 3.38Å; R245-Q443 WeakPolarHBondContact CD-O 3.38Å; R245-Q443 HydrophobicContact CG-CB 3.97Å; R245-Q443 WeakPolarHBondContact CG-O 3.4Å
246	D	93.3	Very high	81.2	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-67.5	135.9	166.5	-71.7	-14.4	0	0	0	108.7	R243 K422 L441 H442 P444 Q445	R243-D246 IonicContact NH2-OD1 2.75Å; D246-K422 CarbonylContact C-O 3.57Å; D246-K422 VanDerWaalsContact CA-O 3.31Å; D246-K422 WeakPolarHBondContact CA-O 3.33Å; D246-K422 HydrophobicContact CB-CB 4.23Å; D246-K422 PolarHBondContact OD1-N 3.3Å; D246-K422 IonicContact OD2-NZ 2.7Å; D246-K422 PolarHBondContact OD2-NZ 2.9Å; D246-L441 HydrophobicContact CB-CB 4.49Å; D246-L441 HydrophobicContact CB-CD2 4.28Å; D246-L441 WeakPolarHBondContact OD2-CA 3.5Å; D246-H442 PolarHBondContact N-O 3.32Å; D246-H442 PolarHBondContact OD2-N 3.03Å; D246-P444 VanDerWaalsContact O-CA 3.27Å; D246-P444 WeakPolarHBondContact O-CA 3.45Å; D246-Q445 PolarHBondContact O-N 3.18Å
247	L	94.5	Very high	82.1	Confident	4 Å²	4	37.2 Å²	37.2	2%	0.021	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	141.3	-177.6	-54.1	-172.7	0	0	0	111.4	A226 I227 R245 K422 L423 L424 Q445 F447	A226-L247 HydrophobicContact CB-CD1 4.32Å; I227-L247 HydrophobicContact CD1-CD1 4.49Å; I227-L247 HydrophobicContact CG1-CD1 3.62Å; R245-L247 HydrophobicContact CB-CD2 4.41Å; L247-K422 PolarHBondContact N-O 3.34Å; L247-L423 HydrophobicContact CB-CD2 3.82Å; L247-L423 HydrophobicContact CD1-CD2 3.95Å; L247-L423 HydrophobicContact CG-CD2 3.82Å; L247-L424 PolarHBondContact O-N 3.29Å; L247-Q445 HydrophobicContact CD2-CB 3.96Å; L247-F447 HydrophobicContact CD1-CE2 4.29Å; L247-F447 HydrophobicContact CD2-CE2 4.28Å
248	C	93.8	Very high	83.2	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	134.8	171.7	-67.7	0	0	0	0	109.6	W176 L424 L429 Q445 L446 F447	W176-C248 HydrophobicContact CZ3-CB 4.35Å; C248-L424 CarbonylContact C-O 3.58Å; C248-L429 HydrophobicContact CB-CD2 3.9Å; C248-Q445 PolarHBondContact N-O 3.29Å; C248-L446 HydrophobicContact CB-CB 4.44Å; C248-L446 HydrophobicContact CB-CD1 3.78Å; C248-L446 WeakPolarHBondContact O-CA 3.36Å; C248-F447 PolarHBondContact O-N 3.1Å
249	V	92.9	Very high	84.5	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	113.2	-176.5	-177.4	0	0	0	0	109.7	I183 V219 V223 K257 L424 F425 S426 F447	I183-V249 HydrophobicContact CD1-CG1 4.43Å; V219-V249 HydrophobicContact CG2-CG1 3.45Å; V219-V249 VanDerWaalsContact CG2-CG1 3.45Å; V223-V249 HydrophobicContact CG1-CG2 4.17Å; V223-V249 HydrophobicContact CG2-CG1 4.33Å; V223-V249 HydrophobicContact CG2-CG2 3.83Å; V249-K257 HydrophobicContact CG1-CD 4.24Å; V249-K257 HydrophobicContact CG1-CG 4.47Å; V249-L424 PolarHBondContact N-O 2.92Å; V249-F425 HydrophobicContact CB-CD1 3.62Å; V249-F425 HydrophobicContact CB-CE1 3.78Å; V249-F425 HydrophobicContact CB-CG 4.4Å; V249-F425 HydrophobicContact CG1-CD1 3.9Å; V249-F425 HydrophobicContact CG1-CE1 4.03Å; V249-F425 HydrophobicContact CG2-CD1 3.96Å; V249-F425 HydrophobicContact CG2-CE1 3.58Å; V249-F425 HydrophobicContact CG2-CZ 4.12Å; V249-S426 PolarHBondContact O-N 3.28Å; V249-F447 WeakPolarHBondContact CA-O 3.25Å; V249-F447 HydrophobicContact CG2-CB 4.41Å; V249-F447 HydrophobicContact CG2-CD2 4.31Å
250	S	90.8	Very high	85.7	Confident	7 Å²	7	28 Å²	28	5%	0.049	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	98	175.9	-168.6	0	0	0	0	109.7	L429 F447 S448 S449	S250-L429 PolarHBondContact OG-N 3.16Å; S250-F447 PolarHBondContact N-O 2.8Å; S250-S448 WeakPolarHBondContact O-CA 3.42Å; S250-S449 PolarHBondContact O-N 2.95Å; S250-S449 VanDerWaalsContact O-N 3.13Å; S250-S449 PolarHBondContact O-OG 2.95Å
251	A	87.1	Confident	87.1	Confident	2 Å²	2	25.2 Å²	25.2	2%	0.017	14%	0.135	C	C	.	.			trans	-142.4	147.1	179.6	0	0	0	0	0	110.4	I183 V219 K257 S426 A427 S449	I183-A251 HydrophobicContact CD1-CB 4.08Å; V219-A251 HydrophobicContact CB-CB 4.17Å; V219-A251 HydrophobicContact CG2-CB 3.88Å; A251-K257 HydrophobicContact CB-CD 4.4Å; A251-K257 PolarHBondContact O-NZ 3.38Å; A251-S426 PolarHBondContact N-O 2.97Å; A251-A427 WeakPolarHBondContact O-CA 3.29Å; A251-S449 WeakPolarHBondContact CA-OG 3.17Å
252	P	83	Confident	88.3	Confident	16 Å²	16	23.2 Å²	23.2	10%	0.104	12%	0.115	C	C	.	.			trans	-57.5	161.1	-168.4	19.5	-32.8	0	0	0	114.7	G254 S255 K257 S449 D470	P252-G254 PolarHBondContact O-N 2.8Å; P252-S255 WeakPolarHBondContact O-CB 3.45Å; P252-S255 PolarHBondContact O-N 3.13Å; P252-S255 PolarHBondContact O-OG 2.55Å; P252-K257 PolarHBondContact O-NZ 3.22Å; P252-S449 WeakPolarHBondContact CD-OG 3.37Å; P252-D470 HydrophobicContact CB-CB 4.2Å; P252-D470 HydrophobicContact CG-CB 4.19Å
253	T	81.9	Confident	89.3	Confident	17 Å²	17	16.7 Å²	16.7	10%	0.104	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	135.6	171.6	45.8	0	0	0	0	111.2	A427 G590	T253-A427 HydrophobicContact CG2-CB 3.64Å; T253-G590 WeakPolarHBondContact CB-O 3.32Å; T253-G590 WeakPolarHBondContact OG1-CA 3.47Å; T253-G590 PolarHBondContact OG1-O 2.73Å
254	G	75.3	Confident	90	Very high	23 Å²	23	14.2 Å²	14.2	24%	0.237	8%	0.08	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	2.8	-179.4	0	0	0	0	0	115.3	P252 G256 A595	P252-G254 PolarHBondContact O-N 2.8Å; G254-G256 PolarHBondContact O-N 3.36Å; G254-A595 PolarHBondContact O-N 2.88Å
255	S	80	Confident	90.4	Very high	5 Å²	5	13.6 Å²	13.6	4%	0.035	8%	0.077	C	C	.	.	S	Bend	trans	-76.6	5.5	169.8	57.1	0	0	0	0	114.6	F217 V219 P252 K257	F217-S255 VanDerWaalsContact CD2-O 3.28Å; F217-S255 WeakPolarHBondContact CD2-O 3.24Å; V219-S255 WeakPolarHBondContact CG1-O 3.39Å; P252-S255 WeakPolarHBondContact O-CB 3.45Å; P252-S255 PolarHBondContact O-N 3.13Å; P252-S255 PolarHBondContact O-OG 2.55Å; S255-K257 PolarHBondContact O-N 3.42Å
256	G	85.5	Confident	90.7	Very high	20 Å²	20	7.8 Å²	7.8	21%	0.206	5%	0.054	C	C	.	.			trans	74	15.7	175.7	0	0	0	0	0	117	Q220 G254 T258 L259	Q220-G256 PolarHBondContact NE2-O 3.24Å; G254-G256 PolarHBondContact O-N 3.36Å; G256-T258 PolarHBondContact O-N 3.1Å; G256-L259 PolarHBondContact O-N 3.23Å
257	K	90.8	Very high	90.8	Very high	19 Å²	19	8.9 Å²	8.9	8%	0.083	6%	0.06	C	C	.	.	H	α-helix	trans	-39.1	-36	176.4	-73.4	-170.3	-61.2	-74.5	0	115.6	V219 V249 A251 P252 S255 L259 A260 F261 F425 S426	V219-K257 HydrophobicContact CG2-CG 4.26Å; V249-K257 HydrophobicContact CG1-CD 4.24Å; V249-K257 HydrophobicContact CG1-CG 4.47Å; A251-K257 HydrophobicContact CB-CD 4.4Å; A251-K257 PolarHBondContact O-NZ 3.38Å; P252-K257 PolarHBondContact O-NZ 3.22Å; S255-K257 PolarHBondContact O-N 3.42Å; K257-L259 VanDerWaalsContact C-N 3.32Å; K257-L259 PolarHBondContact O-N 3.46Å; K257-A260 VanDerWaalsContact O-CB 3.3Å; K257-A260 WeakPolarHBondContact O-CB 3.03Å; K257-A260 PolarHBondContact O-N 2.76Å; K257-A260 VanDerWaalsContact O-N 3.08Å; K257-F261 WeakPolarHBondContact O-CD1 3.37Å; K257-F425 HydrophobicContact CB-CD1 4.01Å; K257-F425 HydrophobicContact CD-CB 4.32Å; K257-F425 HydrophobicContact CD-CD1 4.1Å; K257-F425 HydrophobicContact CG-CD1 4.24Å; K257-S426 WeakPolarHBondContact CD-O 3.41Å; K257-S426 WeakPolarHBondContact CE-O 3.34Å; K257-S426 PolarHBondContact NZ-O 3.28Å
258	T	93.4	Very high	90.7	Very high	28 Å²	28	9.2 Å²	9.2	17%	0.172	6%	0.062	C	C	.	.	H	α-helix	trans	-56.2	-41.8	179.2	-48.7	0	0	0	0	113	G256 A260 F261 V262 V292 V295	G256-T258 PolarHBondContact O-N 3.1Å; T258-A260 VanDerWaalsContact C-N 3.33Å; T258-F261 HydrophobicContact CG2-CE2 4.46Å; T258-F261 HydrophobicContact CG2-CZ 4.05Å; T258-V262 HydrophobicContact CG2-CG2 4.16Å; T258-V262 WeakPolarHBondContact O-CB 3.43Å; T258-V262 WeakPolarHBondContact O-CG2 3.28Å; T258-V262 PolarHBondContact O-N 2.94Å; T258-V292 HydrophobicContact CG2-CG1 4.28Å; T258-V292 HydrophobicContact CG2-CG2 3.88Å; T258-V295 HydrophobicContact CG2-CB 4.36Å; T258-V295 HydrophobicContact CG2-CG1 4.28Å; T258-V295 HydrophobicContact CG2-CG2 4.33Å
259	L	93.8	Very high	90.6	Very high	22 Å²	22	9.2 Å²	9.2	12%	0.115	6%	0.062	C	C	.	.	H	α-helix	trans	-73.2	-28.4	178.2	-63.7	175.3	0	0	0	112.4	I213 G256 K257 F261 V262 I263 V295 Y299	I213-L259 HydrophobicContact CD1-CD1 3.44Å; I213-L259 VanDerWaalsContact CD1-CD1 3.44Å; G256-L259 PolarHBondContact O-N 3.23Å; K257-L259 VanDerWaalsContact C-N 3.32Å; K257-L259 PolarHBondContact O-N 3.46Å; L259-F261 PolarHBondContact O-N 3.08Å; L259-V262 PolarHBondContact O-N 3.09Å; L259-I263 HydrophobicContact CB-CG1 4.33Å; L259-I263 WeakPolarHBondContact O-CG1 3.37Å; L259-I263 PolarHBondContact O-N 3.18Å; L259-I263 VanDerWaalsContact O-N 3.08Å; L259-V295 HydrophobicContact CD2-CG1 3.63Å; L259-Y299 HydrophobicContact CD2-CD2 4.13Å; L259-Y299 HydrophobicContact CD2-CE2 3.54Å
260	A	94.6	Very high	90.6	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-61.2	-26.7	179.3	0	0	0	0	0	113	Q220 V223 K257 T258 P264 F425	Q220-A260 HydrophobicContact CG-CB 4.07Å; V223-A260 HydrophobicContact CB-CB 4.22Å; V223-A260 HydrophobicContact CG1-CB 4.23Å; K257-A260 VanDerWaalsContact O-CB 3.3Å; K257-A260 WeakPolarHBondContact O-CB 3.03Å; K257-A260 PolarHBondContact O-N 2.76Å; K257-A260 VanDerWaalsContact O-N 3.08Å; T258-A260 VanDerWaalsContact C-N 3.33Å; A260-P264 WeakPolarHBondContact O-CD 3.33Å; A260-P264 VanDerWaalsContact O-CG 3.25Å; A260-P264 WeakPolarHBondContact O-CG 3.28Å; A260-F425 HydrophobicContact CB-CE1 4.29Å
261	F	95.7	Very high	90.4	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-100.6	-34.5	167.8	62.4	-103	0	0	0	114.4	K257 T258 L259 I263 V265 V292 F296 I364 F425	K257-F261 WeakPolarHBondContact O-CD1 3.37Å; T258-F261 HydrophobicContact CG2-CE2 4.46Å; T258-F261 HydrophobicContact CG2-CZ 4.05Å; L259-F261 PolarHBondContact O-N 3.08Å; F261-I263 PolarHBondContact O-N 3.32Å; F261-V265 VanDerWaalsContact O-CB 3.23Å; F261-V265 WeakPolarHBondContact O-CB 3.27Å; F261-V265 VanDerWaalsContact O-CG2 3.23Å; F261-V265 WeakPolarHBondContact O-CG2 3.44Å; F261-V265 PolarHBondContact O-N 3Å; F261-V292 HydrophobicContact CE2-CG1 3.87Å; F261-V292 HydrophobicContact CZ-CG1 4Å; F261-F296 HydrophobicContact CD2-CE2 4.27Å; F261-F296 AromaticContact CD2-CZ 3.86Å; F261-F296 HydrophobicContact CD2-CZ 3.86Å; F261-F296 AromaticContact CE2-CE2 3.84Å; F261-F296 HydrophobicContact CE2-CE2 3.84Å; F261-F296 AromaticContact CE2-CZ 3.92Å; F261-F296 HydrophobicContact CE2-CZ 3.92Å; F261-I364 HydrophobicContact CB-CD1 4.43Å; F261-I364 HydrophobicContact CD1-CG2 4.12Å; F261-I364 HydrophobicContact CD2-CD1 3.78Å; F261-I364 HydrophobicContact CD2-CG1 4.46Å; F261-I364 HydrophobicContact CD2-CG2 3.95Å; F261-I364 HydrophobicContact CE1-CG2 4.17Å; F261-I364 HydrophobicContact CE2-CD1 4.4Å; F261-I364 HydrophobicContact CE2-CG2 4.04Å; F261-I364 HydrophobicContact CG-CD1 4.38Å; F261-I364 HydrophobicContact CG-CG2 3.99Å; F261-I364 HydrophobicContact CZ-CG2 4.13Å; F261-F425 HydrophobicContact CB-CE2 3.62Å; F261-F425 HydrophobicContact CB-CZ 3.7Å; F261-F425 HydrophobicContact CD1-CD1 4.18Å; F261-F425 AromaticContact CD1-CD2 3.53Å; F261-F425 HydrophobicContact CD1-CD2 3.53Å; F261-F425 HydrophobicContact CD1-CE1 4.1Å; F261-F425 AromaticContact CD1-CE2 3.43Å; F261-F425 HydrophobicContact CD1-CE2 3.43Å; F261-F425 VanDerWaalsContact CD1-CE2 3.43Å; F261-F425 AromaticContact CD1-CG 3.93Å; F261-F425 HydrophobicContact CD1-CG 3.93Å; F261-F425 AromaticContact CD1-CZ 3.75Å; F261-F425 HydrophobicContact CD1-CZ 3.75Å; F261-F425 HydrophobicContact CE1-CD2 4.04Å; F261-F425 HydrophobicContact CE1-CE2 4.37Å; F261-F425 HydrophobicContact CE1-CG 4.24Å; F261-F425 HydrophobicContact CG-CD2 4.36Å; F261-F425 AromaticContact CG-CE2 3.89Å; F261-F425 HydrophobicContact CG-CE2 3.89Å; F261-F425 HydrophobicContact CG-CZ 4.21Å
262	V	96.8	Very high	90.4	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.8	-47.3	-176.9	168	0	0	0	0	111.9	T258 L259 I266 V295 F296 Y299	T258-V262 HydrophobicContact CG2-CG2 4.16Å; T258-V262 WeakPolarHBondContact O-CB 3.43Å; T258-V262 WeakPolarHBondContact O-CG2 3.28Å; T258-V262 PolarHBondContact O-N 2.94Å; L259-V262 PolarHBondContact O-N 3.09Å; V262-I266 HydrophobicContact CG1-CD1 3.58Å; V262-I266 HydrophobicContact CG1-CG1 4.38Å; V262-I266 WeakPolarHBondContact O-CB 3.42Å; V262-I266 VanDerWaalsContact O-CG1 3.32Å; V262-I266 WeakPolarHBondContact O-CG1 3.06Å; V262-I266 PolarHBondContact O-N 3.45Å; V262-V295 HydrophobicContact CB-CG1 4.45Å; V262-V295 HydrophobicContact CG1-CG1 4.2Å; V262-V295 HydrophobicContact CG2-CG1 4.11Å; V262-F296 HydrophobicContact CB-CD1 4.25Å; V262-F296 HydrophobicContact CB-CE1 4.11Å; V262-F296 HydrophobicContact CG1-CD1 3.83Å; V262-F296 HydrophobicContact CG1-CE1 4.15Å; V262-F296 HydrophobicContact CG1-CG 4.35Å; V262-F296 HydrophobicContact CG2-CD1 3.9Å; V262-F296 HydrophobicContact CG2-CD2 4.01Å; V262-F296 HydrophobicContact CG2-CE1 3.78Å; V262-F296 HydrophobicContact CG2-CE2 3.91Å; V262-F296 HydrophobicContact CG2-CG 4Å; V262-F296 HydrophobicContact CG2-CZ 3.79Å; V262-Y299 HydrophobicContact CG1-CD2 4.24Å
263	I	95.5	Very high	90.6	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63	-56.2	-174.9	-60.6	-59.4	0	0	0	112.3	V200 L204 L208 I224 L259 F261 V265 I266 Q267 Y299	V200-I263 HydrophobicContact CG1-CG2 4.26Å; L204-I263 HydrophobicContact CD1-CG2 4.36Å; L208-I263 HydrophobicContact CD1-CD1 4.45Å; L208-I263 HydrophobicContact CD2-CD1 3.93Å; L208-I263 HydrophobicContact CD2-CG1 4.33Å; L208-I263 HydrophobicContact CG-CD1 4.32Å; I224-I263 HydrophobicContact CD1-CB 4.33Å; L259-I263 HydrophobicContact CB-CG1 4.33Å; L259-I263 WeakPolarHBondContact O-CG1 3.37Å; L259-I263 PolarHBondContact O-N 3.18Å; L259-I263 VanDerWaalsContact O-N 3.08Å; F261-I263 PolarHBondContact O-N 3.32Å; I263-V265 PolarHBondContact O-N 3.07Å; I263-I266 PolarHBondContact O-N 2.74Å; I263-Q267 PolarHBondContact O-N 2.82Å; I263-Y299 HydrophobicContact CD1-CD1 3.58Å; I263-Y299 HydrophobicContact CD1-CD2 4.26Å; I263-Y299 HydrophobicContact CD1-CE1 3.85Å; I263-Y299 HydrophobicContact CD1-CG 3.83Å
264	P	95.1	Very high	90.9	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-68.9	-33.1	-177.9	27.4	-36	0	0	0	112.8	I224 I227 L228 A260 Q267 V268	I224-P264 HydrophobicContact CG1-CG 4.39Å; I224-P264 HydrophobicContact CG2-CB 4.37Å; I224-P264 HydrophobicContact CG2-CG 4.45Å; I227-P264 HydrophobicContact CB-CB 3.93Å; I227-P264 HydrophobicContact CB-CG 3.94Å; I227-P264 HydrophobicContact CD1-CG 3.86Å; I227-P264 HydrophobicContact CG2-CB 3.74Å; I227-P264 HydrophobicContact CG2-CG 3.92Å; L228-P264 HydrophobicContact CD2-CB 3.71Å; L228-P264 HydrophobicContact CG-CB 3.87Å; A260-P264 WeakPolarHBondContact O-CD 3.33Å; A260-P264 VanDerWaalsContact O-CG 3.25Å; A260-P264 WeakPolarHBondContact O-CG 3.28Å; P264-Q267 PolarHBondContact O-N 3.3Å; P264-V268 WeakPolarHBondContact O-CG2 3.34Å; P264-V268 PolarHBondContact O-N 2.99Å
265	V	95.7	Very high	91.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-69.7	-38.3	177.3	172.5	0	0	0	0	111.7	F261 I263 L269 A279 F296 I337 F362 I364 L423	F261-V265 VanDerWaalsContact O-CB 3.23Å; F261-V265 WeakPolarHBondContact O-CB 3.27Å; F261-V265 VanDerWaalsContact O-CG2 3.23Å; F261-V265 WeakPolarHBondContact O-CG2 3.44Å; F261-V265 PolarHBondContact O-N 3Å; I263-V265 PolarHBondContact O-N 3.07Å; V265-L269 HydrophobicContact CG1-CD1 3.98Å; V265-L269 WeakPolarHBondContact O-CB 3.32Å; V265-L269 WeakPolarHBondContact O-CD1 3.3Å; V265-L269 WeakPolarHBondContact O-CG 3.45Å; V265-L269 PolarHBondContact O-N 3.13Å; V265-A279 HydrophobicContact CG1-CB 3.55Å; V265-F296 HydrophobicContact CG1-CE1 4.4Å; V265-I337 HydrophobicContact CG1-CD1 4.47Å; V265-F362 HydrophobicContact CG1-CD2 4.03Å; V265-F362 HydrophobicContact CG2-CD1 4.29Å; V265-F362 HydrophobicContact CG2-CD2 4.12Å; V265-F362 HydrophobicContact CG2-CE2 4.37Å; V265-F362 HydrophobicContact CG2-CG 4.08Å; V265-I364 HydrophobicContact CG2-CD1 4.25Å; V265-L423 HydrophobicContact CG2-CD1 4.26Å
266	I	95.6	Very high	92.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63.7	-45.9	171	-72.2	171.9	0	0	0	110	L204 V262 I263 V268 L269 M270 F296 Y299 A300 I337	L204-I266 HydrophobicContact CD2-CG2 4.13Å; V262-I266 HydrophobicContact CG1-CD1 3.58Å; V262-I266 HydrophobicContact CG1-CG1 4.38Å; V262-I266 WeakPolarHBondContact O-CB 3.42Å; V262-I266 VanDerWaalsContact O-CG1 3.32Å; V262-I266 WeakPolarHBondContact O-CG1 3.06Å; V262-I266 PolarHBondContact O-N 3.45Å; I263-I266 PolarHBondContact O-N 2.74Å; I266-V268 PolarHBondContact O-N 3.33Å; I266-L269 CarbonylContact O-C 3.52Å; I266-L269 WeakPolarHBondContact O-CA 3.36Å; I266-L269 PolarHBondContact O-N 2.85Å; I266-M270 HydrophobicContact CG2-CG 4.37Å; I266-M270 HydrophobicContact CG2-SD 4.38Å; I266-M270 WeakPolarHBondContact O-CG 3.47Å; I266-M270 PolarHBondContact O-N 3.01Å; I266-F296 HydrophobicContact CD1-CD1 4.01Å; I266-F296 HydrophobicContact CG1-CD1 4Å; I266-F296 HydrophobicContact CG1-CE1 4.41Å; I266-Y299 VanDerWaalsContact CD1-CB 3.42Å; I266-A300 HydrophobicContact CD1-CB 4.3Å; I266-I337 HydrophobicContact CG1-CD1 3.89Å
267	Q	94.1	Very high	92.6	Very high	23 Å²	23	27.9 Å²	27.9	11%	0.107	15%	0.15	C	C	.	.	H	α-helix	trans	-58.5	-52.2	-177.7	-170.8	172.2	-57.5	0	0	112.6	G199 L204 L228 I263 P264 L269 M270	G199-Q267 PolarHBondContact O-NE2 3.01Å; L204-Q267 HydrophobicContact CD1-CB 3.6Å; L204-Q267 HydrophobicContact CD1-CG 4.08Å; L228-Q267 HydrophobicContact CD2-CB 4.28Å; L228-Q267 HydrophobicContact CD2-CG 4.44Å; I263-Q267 PolarHBondContact O-N 2.82Å; P264-Q267 PolarHBondContact O-N 3.3Å; Q267-L269 PolarHBondContact O-N 3.28Å; Q267-L269 VanDerWaalsContact O-N 3.13Å; Q267-M270 WeakPolarHBondContact O-CB 3.45Å; Q267-M270 PolarHBondContact O-N 3.37Å
268	V	92.6	Very high	92.8	Very high	11 Å²	11	27.6 Å²	27.6	7%	0.067	15%	0.148	C	C	.	.	H	α-helix	trans	-59.4	-28	178.1	173.4	0	0	0	0	111	L228 A231 F235 P264 I266 F362	L228-V268 HydrophobicContact CD2-CG2 4.15Å; A231-V268 HydrophobicContact CB-CB 4.38Å; A231-V268 HydrophobicContact CB-CG1 3.87Å; A231-V268 HydrophobicContact CB-CG2 3.5Å; A231-V268 VanDerWaalsContact CB-CG2 3.5Å; F235-V268 HydrophobicContact CD1-CG1 4.31Å; F235-V268 HydrophobicContact CE1-CG1 3.89Å; F235-V268 VanDerWaalsContact CE1-O 3.25Å; F235-V268 WeakPolarHBondContact CE1-O 3.46Å; F235-V268 WeakPolarHBondContact CZ-O 3.42Å; P264-V268 WeakPolarHBondContact O-CG2 3.34Å; P264-V268 PolarHBondContact O-N 2.99Å; I266-V268 PolarHBondContact O-N 3.33Å; V268-F362 HydrophobicContact CB-CE2 4.17Å; V268-F362 HydrophobicContact CB-CZ 4.26Å; V268-F362 HydrophobicContact CG1-CE2 3.87Å; V268-F362 HydrophobicContact CG1-CZ 3.99Å; V268-F362 HydrophobicContact CG2-CZ 4.4Å
269	L	93.1	Very high	92.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-85.7	-10.8	176.1	-64.1	174	0	0	0	114.5	F235 V265 I266 Q267 E271 R272 R278 A279 V305 I337	F235-L269 HydrophobicContact CE1-CD2 4.12Å; V265-L269 HydrophobicContact CG1-CD1 3.98Å; V265-L269 WeakPolarHBondContact O-CB 3.32Å; V265-L269 WeakPolarHBondContact O-CD1 3.3Å; V265-L269 WeakPolarHBondContact O-CG 3.45Å; V265-L269 PolarHBondContact O-N 3.13Å; I266-L269 CarbonylContact O-C 3.52Å; I266-L269 WeakPolarHBondContact O-CA 3.36Å; I266-L269 PolarHBondContact O-N 2.85Å; Q267-L269 PolarHBondContact O-N 3.28Å; Q267-L269 VanDerWaalsContact O-N 3.13Å; L269-E271 PolarHBondContact O-N 2.76Å; L269-R272 WeakPolarHBondContact O-CG 3.44Å; L269-R272 PolarHBondContact O-N 2.81Å; L269-R278 HydrophobicContact CD2-CB 3.43Å; L269-R278 VanDerWaalsContact CD2-CB 3.43Å; L269-R278 HydrophobicContact CD2-CG 4.15Å; L269-A279 HydrophobicContact CD1-CB 4.02Å; L269-V305 HydrophobicContact CB-CG1 4.06Å; L269-V305 HydrophobicContact CB-CG2 3.87Å; L269-V305 HydrophobicContact CD1-CG1 4.37Å; L269-V305 WeakPolarHBondContact O-CG2 3.48Å; L269-I337 HydrophobicContact CD1-CD1 3.86Å; L269-I337 HydrophobicContact CD1-CG1 3.52Å
270	M	91.9	Very high	93.1	Very high	42 Å²	42	25.2 Å²	25.2	21%	0.207	13%	0.134	C	C	.	.	H	α-helix	trans	-65.8	-29.6	174.3	-72.8	168.5	54.8	0	0	112	Q203 L204 I266 Q267 R272 T303 V305	Q203-M270 HydrophobicContact CB-CE 4.35Å; L204-M270 HydrophobicContact CD1-SD 4Å; L204-M270 HydrophobicContact CD2-SD 4.42Å; L204-M270 HydrophobicContact CG-SD 4.12Å; I266-M270 HydrophobicContact CG2-CG 4.37Å; I266-M270 HydrophobicContact CG2-SD 4.38Å; I266-M270 WeakPolarHBondContact O-CG 3.47Å; I266-M270 PolarHBondContact O-N 3.01Å; Q267-M270 WeakPolarHBondContact O-CB 3.45Å; Q267-M270 PolarHBondContact O-N 3.37Å; M270-R272 VanDerWaalsContact C-N 3.3Å; M270-R272 PolarHBondContact O-N 2.75Å; M270-T303 HydrophobicContact CG-CG2 4.27Å; M270-T303 HydrophobicContact SD-CG2 4.25Å; M270-V305 HydrophobicContact CG-CG2 4.22Å
271	E	86.9	Confident	93.2	Very high	135 Å²	135	25.2 Å²	25.2	63%	0.631	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.3	1.5	-179.4	-64	171.2	-165	0	0	113.7	L269	L269-E271 PolarHBondContact O-N 2.76Å
272	R	88.2	Confident	93.2	Very high	27 Å²	27	25.2 Å²	25.2	10%	0.102	14%	0.135	C	C	.	.			trans	-78.9	126.9	-172.4	77.4	92.7	-177.2	80.5	2.9	112.5	F235 L269 M270 V274 P304 D336	F235-R272 HydrophobicContact CE1-CB 4.42Å; F235-R272 HydrophobicContact CE2-CB 4.17Å; F235-R272 HydrophobicContact CZ-CB 3.64Å; L269-R272 WeakPolarHBondContact O-CG 3.44Å; L269-R272 PolarHBondContact O-N 2.81Å; M270-R272 VanDerWaalsContact C-N 3.3Å; M270-R272 PolarHBondContact O-N 2.75Å; R272-V274 WeakPolarHBondContact CD-O 3.3Å; R272-P304 PolarHBondContact NH2-O 2.93Å; R272-D336 WeakPolarHBondContact CD-OD1 3.19Å; R272-D336 IonicContact CZ-OD1 2.71Å; R272-D336 IonicContact CZ-OD2 2.68Å; R272-D336 IonicContact NE-OD1 3.35Å; R272-D336 PolarHBondContact NE-OD1 3.23Å; R272-D336 IonicContact NE-OD2 3.9Å; R272-D336 PolarHBondContact NE-OD2 2.97Å; R272-D336 VanDerWaalsContact NE-OD2 3.15Å; R272-D336 IonicContact NH2-OD1 3.96Å; R272-D336 IonicContact NH2-OD2 3.16Å; R272-D336 PolarHBondContact NH2-OD2 3.43Å
273	T	85.3	Confident	93	Very high	131 Å²	131	25.3 Å²	25.3	80%	0.804	14%	0.135	S	C	*	.	S	Bend	trans	-70.7	-55.2	179.7	52.5	0	0	0	0	113.3
274	V	88.9	Confident	92.7	Very high	86 Å²	86	26.8 Å²	26.8	52%	0.521	15%	0.145	S	C	.	.	S	Bend	trans	-106.5	133.2	-177.4	-60.1	0	0	0	0	112	R272 E276 R278	R272-V274 WeakPolarHBondContact CD-O 3.3Å; V274-E276 HydrophobicContact CG2-CG 4.49Å; V274-E276 PolarHBondContact O-N 3.34Å; V274-R278 VanDerWaalsContact O-CZ 3.25Å; V274-R278 PolarHBondContact O-NH1 3.09Å; V274-R278 PolarHBondContact O-NH2 2.84Å
275	C	90.8	Very high	92.3	Very high	24 Å²	24	27.5 Å²	27.5	16%	0.162	15%	0.149	C	C	.	.			trans	-68.3	107.8	179.7	-178	0	0	0	0	110.8	S333 R334 D336	C275-S333 WeakPolarHBondContact O-CB 3.44Å; C275-S333 PolarHBondContact SG-O 2.99Å; C275-R334 VanDerWaalsContact SG-C 3.56Å; C275-D336 WeakPolarHBondContact CA-OD1 3.39Å
276	E	91.8	Very high	91.8	Very high	34 Å²	34	31.7 Å²	31.7	16%	0.159	17%	0.167	C	C	.	.			trans	-156	149.2	-176.2	-83.5	-52	144.9	0	0	111.2	V274 R278 S333 A335 D336 H359	V274-E276 HydrophobicContact CG2-CG 4.49Å; V274-E276 PolarHBondContact O-N 3.34Å; E276-R278 WeakPolarHBondContact O-CG 2.91Å; E276-R278 PolarHBondContact O-N 3.1Å; E276-R278 PolarHBondContact O-NH1 2.95Å; E276-S333 WeakPolarHBondContact OE1-CB 3.5Å; E276-S333 PolarHBondContact OE1-N 2.75Å; E276-S333 VanDerWaalsContact OE1-N 3.12Å; E276-S333 WeakPolarHBondContact OE2-CB 3.17Å; E276-A335 CarbonylContact C-O 3.58Å; E276-A335 VanDerWaalsContact C-O 3.26Å; E276-D336 PolarHBondContact N-OD1 3.3Å; E276-D336 VanDerWaalsContact N-OD1 3.11Å; E276-H359 HydrophobicContact CB-CB 4.41Å
277	I	94.2	Very high	91.2	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.015	18%	0.18	C	C	.	.			trans	-68.2	99.5	-169.3	-56.6	175.3	0	0	0	110.2	L323 A335 V338 F355 L357 H359 L360	I277-L323 HydrophobicContact CD1-CD2 4.46Å; I277-A335 HydrophobicContact CG1-CB 4.37Å; I277-A335 WeakPolarHBondContact CG1-O 3.13Å; I277-A335 PolarHBondContact N-O 2.8Å; I277-V338 HydrophobicContact CD1-CG2 4.05Å; I277-V338 HydrophobicContact CG1-CG2 4.19Å; I277-V338 HydrophobicContact CG2-CB 4.48Å; I277-V338 HydrophobicContact CG2-CG2 3.99Å; I277-F355 HydrophobicContact CD1-CD2 3.78Å; I277-F355 HydrophobicContact CD1-CE2 3.83Å; I277-L357 HydrophobicContact CG2-CD2 3.92Å; I277-H359 CarbonylContact O-C 3.37Å; I277-L360 WeakPolarHBondContact O-CA 3.46Å; I277-L360 PolarHBondContact O-N 3.27Å
278	R	94	Very high	90.9	Very high	13 Å²	13	33.7 Å²	33.7	5%	0.049	18%	0.177	C	C	.	.			trans	-109.8	-20.2	-177.5	-76.2	176.8	-169.6	80.6	-8.8	113.4	L269 V274 E276 D336 H359 R361 F362	L269-R278 HydrophobicContact CD2-CB 3.43Å; L269-R278 VanDerWaalsContact CD2-CB 3.43Å; L269-R278 HydrophobicContact CD2-CG 4.15Å; V274-R278 VanDerWaalsContact O-CZ 3.25Å; V274-R278 PolarHBondContact O-NH1 3.09Å; V274-R278 PolarHBondContact O-NH2 2.84Å; E276-R278 WeakPolarHBondContact O-CG 2.91Å; E276-R278 PolarHBondContact O-N 3.1Å; E276-R278 PolarHBondContact O-NH1 2.95Å; R278-D336 PolarHBondContact N-O 2.84Å; R278-D336 IonicContact NH1-OD1 2.7Å; R278-H359 HydrophobicContact CG-CB 4.5Å; R278-H359 WeakPolarHBondContact CG-O 3.36Å; R278-R361 HydrophobicContact CB-CB 4.36Å; R278-R361 WeakPolarHBondContact O-CA 3.36Å; R278-R361 PolarHBondContact O-N 2.88Å; R278-F362 PolarHBondContact O-N 2.98Å
279	A	96.9	Very high	90.8	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	133.2	171.8	0	0	0	0	0	111.9	V265 L269 D336 I337 V338 F362	V265-A279 HydrophobicContact CG1-CB 3.55Å; L269-A279 HydrophobicContact CD1-CB 4.02Å; A279-D336 PolarHBondContact N-O 2.81Å; A279-I337 HydrophobicContact CB-CB 4.48Å; A279-I337 HydrophobicContact CB-CG1 4.18Å; A279-I337 HydrophobicContact CB-CG2 4.26Å; A279-I337 WeakPolarHBondContact O-CA 3.5Å; A279-V338 PolarHBondContact O-N 2.59Å; A279-F362 WeakPolarHBondContact CA-O 3.43Å; A279-F362 HydrophobicContact CB-CB 4.21Å
280	L	97.7	Very high	90.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	110.9	177.9	-173.9	64.9	0	0	0	108.8	V282 V338 V340 L345 F355 L357 L360 F362 L363 I364 V383	L280-V282 HydrophobicContact CD2-CG2 4.43Å; L280-V282 HydrophobicContact CG-CG2 4.08Å; L280-V338 WeakPolarHBondContact CA-O 3.26Å; L280-V338 HydrophobicContact CD1-CB 3.78Å; L280-V338 HydrophobicContact CD1-CG1 3.7Å; L280-V340 HydrophobicContact CD1-CG1 3.67Å; L280-V340 HydrophobicContact CG-CG1 4.33Å; L280-L345 HydrophobicContact CD1-CD1 4.21Å; L280-L345 HydrophobicContact CD2-CD1 3.94Å; L280-L345 HydrophobicContact CD2-CD2 3.94Å; L280-F355 HydrophobicContact CD1-CZ 4.24Å; L280-L357 HydrophobicContact CD2-CD1 4.15Å; L280-L357 HydrophobicContact CD2-CD2 4.13Å; L280-L360 HydrophobicContact CB-CD1 3.51Å; L280-L360 HydrophobicContact CB-CD2 4.18Å; L280-L360 HydrophobicContact CB-CG 4.49Å; L280-L360 HydrophobicContact CD2-CD2 4.16Å; L280-F362 PolarHBondContact N-O 2.8Å; L280-L363 HydrophobicContact CB-CD1 4.32Å; L280-L363 HydrophobicContact CD2-CD1 4.16Å; L280-L363 HydrophobicContact CG-CD1 4.34Å; L280-I364 PolarHBondContact O-N 3.08Å; L280-V383 HydrophobicContact CD2-CG1 4.36Å
281	A	97.5	Very high	90.5	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.008	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	116.2	175.8	0	0	0	0	0	109.8	L283 F296 V338 V339 V340 I364	A281-L283 HydrophobicContact CB-CD1 4.06Å; A281-L283 VanDerWaalsContact O-CD1 3.32Å; A281-L283 WeakPolarHBondContact O-CD1 3.28Å; A281-F296 HydrophobicContact CB-CE2 4.1Å; A281-V338 PolarHBondContact N-O 2.78Å; A281-V339 HydrophobicContact CB-CG2 4.42Å; A281-V340 PolarHBondContact O-N 2.91Å; A281-I364 HydrophobicContact CB-CB 4.2Å; A281-I364 HydrophobicContact CB-CD1 4.34Å
282	V	95.4	Very high	90.8	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	122.1	-177.2	-170.5	0	0	0	0	109.4	L280 V340 P342 L345 L363 I364 D366 M371 W379	L280-V282 HydrophobicContact CD2-CG2 4.43Å; L280-V282 HydrophobicContact CG-CG2 4.08Å; V282-V340 WeakPolarHBondContact CA-O 3.15Å; V282-V340 HydrophobicContact CG2-CG1 4.08Å; V282-P342 HydrophobicContact CG1-CB 4.46Å; V282-P342 HydrophobicContact CG1-CG 3.94Å; V282-L345 HydrophobicContact CG1-CD2 4.37Å; V282-L345 HydrophobicContact CG2-CD2 3.67Å; V282-L363 HydrophobicContact CG2-CD1 3.89Å; V282-I364 PolarHBondContact N-O 3.22Å; V282-D366 PolarHBondContact O-N 3.4Å; V282-M371 HydrophobicContact CG1-CE 3.85Å; V282-W379 HydrophobicContact CB-CH2 4.35Å; V282-W379 HydrophobicContact CB-CZ3 4.24Å; V282-W379 HydrophobicContact CG1-CE3 4.19Å; V282-W379 HydrophobicContact CG1-CH2 4.12Å; V282-W379 HydrophobicContact CG1-CZ3 3.88Å; V282-W379 HydrophobicContact CG2-CZ3 4.01Å
283	L	92.9	Very high	91.1	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.005	17%	0.166	C	C	.	.			trans	-135.3	141.7	-171.8	-48.2	93.6	0	0	0	110.8	A281 T285 L288 A289 V292 V339 V340 D366	A281-L283 HydrophobicContact CB-CD1 4.06Å; A281-L283 VanDerWaalsContact O-CD1 3.32Å; A281-L283 WeakPolarHBondContact O-CD1 3.28Å; L283-T285 PolarHBondContact O-N 2.86Å; L283-L288 HydrophobicContact CB-CD2 4.21Å; L283-L288 HydrophobicContact CB-CG 4.27Å; L283-L288 HydrophobicContact CD2-CD1 4.47Å; L283-L288 HydrophobicContact CD2-CD2 4.13Å; L283-L288 HydrophobicContact CD2-CG 3.73Å; L283-A289 HydrophobicContact CB-CB 4.32Å; L283-A289 HydrophobicContact CD1-CB 4.13Å; L283-V292 HydrophobicContact CD2-CB 3.79Å; L283-V292 HydrophobicContact CD2-CG1 4.12Å; L283-V292 HydrophobicContact CD2-CG2 3.53Å; L283-V339 HydrophobicContact CD1-CG1 3.6Å; L283-V340 PolarHBondContact N-O 2.88Å; L283-V340 VanDerWaalsContact N-O 3.1Å; L283-D366 HydrophobicContact CD2-CB 4.01Å; L283-D366 HydrophobicContact CG-CB 4.33Å
284	P	88.6	Confident	91.6	Very high	32 Å²	32	31.7 Å²	31.7	21%	0.208	15%	0.154	C	C	.	.	S	Bend	trans	-73.1	-17.2	-168.2	25.7	-35.6	0	0	0	115.7	D366 E367 M371	P284-D366 VanDerWaalsContact CD-O 3.23Å; P284-D366 WeakPolarHBondContact CD-O 3.05Å; P284-E367 HydrophobicContact CG-CB 3.7Å; P284-M371 HydrophobicContact CB-SD 3.88Å; P284-M371 HydrophobicContact CG-SD 4.41Å
285	T	85.8	Confident	91.8	Very high	14 Å²	14	29.2 Å²	29.2	9%	0.086	14%	0.139	C	C	.	.	S	Bend	trans	-126.3	148.9	179.8	70.8	0	0	0	0	111.8	L283 E287 L288 A289	L283-T285 PolarHBondContact O-N 2.86Å; T285-E287 PolarHBondContact O-N 2.89Å; T285-L288 VanDerWaalsContact OG1-CB 3.27Å; T285-L288 WeakPolarHBondContact OG1-CB 3.42Å; T285-L288 PolarHBondContact OG1-N 3.48Å; T285-A289 WeakPolarHBondContact O-CB 3.35Å; T285-A289 PolarHBondContact O-N 3.28Å
286	K	85.3	Confident	92.1	Very high	88 Å²	88	28.1 Å²	28.1	38%	0.383	13%	0.131	S	C	.	.	H	α-helix	trans	-64.5	-28.6	178.7	-65.4	-171.4	177.2	-149.9	0	111.4	Q290 M309 G311 G312 T341	K286-Q290 VanDerWaalsContact O-CB 3.25Å; K286-Q290 WeakPolarHBondContact O-CB 3.36Å; K286-Q290 PolarHBondContact O-N 3.19Å; K286-M309 WeakPolarHBondContact O-CE 3.37Å; K286-G311 WeakPolarHBondContact CD-O 3.05Å; K286-G311 WeakPolarHBondContact CE-O 3.43Å; K286-G311 PolarHBondContact NZ-O 2.9Å; K286-G312 PolarHBondContact NZ-O 3.5Å; K286-T341 HydrophobicContact CG-CG2 4.12Å
287	E	83.4	Confident	92.4	Very high	56 Å²	56	28 Å²	28	26%	0.262	14%	0.136	S	C	.	.	H	α-helix	trans	-75.5	-46.5	-176.4	-64.4	66.9	-155.9	0	0	110.8	T285 Q290 Q291 R540 I565	T285-E287 PolarHBondContact O-N 2.89Å; E287-Q290 PolarHBondContact O-N 3.23Å; E287-Q291 PolarHBondContact O-N 2.97Å; E287-R540 IonicContact OE1-CZ 2.76Å; E287-R540 IonicContact OE1-NH1 3.37Å; E287-R540 PolarHBondContact OE1-NH1 3.1Å; E287-R540 IonicContact OE1-NH2 3.45Å; E287-R540 PolarHBondContact OE1-NH2 2.83Å; E287-I565 HydrophobicContact CB-CD1 4.42Å; E287-I565 HydrophobicContact CB-CG1 4.16Å
288	L	86.8	Confident	92.4	Very high	9 Å²	9	29.9 Å²	29.9	5%	0.047	15%	0.15	C	C	.	.	H	α-helix	trans	-64.4	-44.1	171.9	-178.3	56.9	0	0	0	111.2	L283 T285 Q290 Q291 V292 E367 G564	L283-L288 HydrophobicContact CB-CD2 4.21Å; L283-L288 HydrophobicContact CB-CG 4.27Å; L283-L288 HydrophobicContact CD2-CD1 4.47Å; L283-L288 HydrophobicContact CD2-CD2 4.13Å; L283-L288 HydrophobicContact CD2-CG 3.73Å; T285-L288 VanDerWaalsContact OG1-CB 3.27Å; T285-L288 WeakPolarHBondContact OG1-CB 3.42Å; T285-L288 PolarHBondContact OG1-N 3.48Å; L288-Q290 VanDerWaalsContact C-N 3.28Å; L288-Q290 PolarHBondContact O-N 2.99Å; L288-Q291 WeakPolarHBondContact O-CB 3.49Å; L288-Q291 PolarHBondContact O-N 2.82Å; L288-Q291 VanDerWaalsContact O-N 3.11Å; L288-V292 HydrophobicContact CD1-CG2 4.04Å; L288-V292 HydrophobicContact CG-CG2 4.5Å; L288-V292 WeakPolarHBondContact O-CG2 3.28Å; L288-V292 PolarHBondContact O-N 3.04Å; L288-E367 HydrophobicContact CD2-CB 4.49Å; L288-E367 HydrophobicContact CD2-CG 4.03Å; L288-G564 WeakPolarHBondContact CA-O 3.49Å; L288-G564 WeakPolarHBondContact CB-O 3.21Å; L288-G564 VanDerWaalsContact CD1-O 3.25Å; L288-G564 WeakPolarHBondContact CD1-O 3.25Å
289	A	91	Very high	92.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-59.2	-39.9	174.2	0	0	0	0	0	111.7	L283 T285 Q291 Y293 M309 V339 T341	L283-A289 HydrophobicContact CB-CB 4.32Å; L283-A289 HydrophobicContact CD1-CB 4.13Å; T285-A289 WeakPolarHBondContact O-CB 3.35Å; T285-A289 PolarHBondContact O-N 3.28Å; A289-Q291 VanDerWaalsContact C-N 3.34Å; A289-Q291 PolarHBondContact O-N 3.43Å; A289-Y293 WeakPolarHBondContact O-CB 3.39Å; A289-Y293 PolarHBondContact O-N 2.82Å; A289-M309 HydrophobicContact CB-CE 3.66Å; A289-V339 HydrophobicContact CB-CG1 4.21Å; A289-V339 WeakPolarHBondContact O-CG1 3.3Å; A289-T341 HydrophobicContact CB-CG2 4.14Å
290	Q	89.9	Confident	92.4	Very high	65 Å²	65	30.1 Å²	30.1	30%	0.304	15%	0.152	S	C	.	.	H	α-helix	trans	-67.3	-34	175.8	177.9	64.3	105.4	0	0	112.4	K286 E287 L288 K294 M309	K286-Q290 VanDerWaalsContact O-CB 3.25Å; K286-Q290 WeakPolarHBondContact O-CB 3.36Å; K286-Q290 PolarHBondContact O-N 3.19Å; E287-Q290 PolarHBondContact O-N 3.23Å; L288-Q290 VanDerWaalsContact C-N 3.28Å; L288-Q290 PolarHBondContact O-N 2.99Å; Q290-K294 WeakPolarHBondContact O-CG 3.43Å; Q290-K294 PolarHBondContact O-N 3.31Å; Q290-M309 HydrophobicContact CB-CE 3.85Å; Q290-M309 HydrophobicContact CB-SD 4.08Å; Q290-M309 VanDerWaalsContact N-CE 3.26Å
291	Q	88.8	Confident	92.2	Very high	41 Å²	41	36.9 Å²	36.9	19%	0.192	18%	0.184	C	C	.	.	H	α-helix	trans	-68.1	-55.1	174.1	-178.5	-167.9	-43	0	0	111	E287 L288 A289 Y293 K294 V295 G564 D566	E287-Q291 PolarHBondContact O-N 2.97Å; L288-Q291 WeakPolarHBondContact O-CB 3.49Å; L288-Q291 PolarHBondContact O-N 2.82Å; L288-Q291 VanDerWaalsContact O-N 3.11Å; A289-Q291 VanDerWaalsContact C-N 3.34Å; A289-Q291 PolarHBondContact O-N 3.43Å; Q291-Y293 VanDerWaalsContact C-N 3.28Å; Q291-Y293 PolarHBondContact O-N 2.89Å; Q291-K294 WeakPolarHBondContact O-CB 3.44Å; Q291-K294 PolarHBondContact O-N 2.97Å; Q291-V295 PolarHBondContact O-N 3Å; Q291-G564 PolarHBondContact OE1-O 3.29Å; Q291-D566 VanDerWaalsContact CD-CB 3.43Å; Q291-D566 VanDerWaalsContact NE2-CB 3.3Å
292	V	93.8	Very high	91.8	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.1	-34.8	-177.6	174.6	0	0	0	0	111.5	T258 F261 L283 L288 K294 V295 F296	T258-V292 HydrophobicContact CG2-CG1 4.28Å; T258-V292 HydrophobicContact CG2-CG2 3.88Å; F261-V292 HydrophobicContact CE2-CG1 3.87Å; F261-V292 HydrophobicContact CZ-CG1 4Å; L283-V292 HydrophobicContact CD2-CB 3.79Å; L283-V292 HydrophobicContact CD2-CG1 4.12Å; L283-V292 HydrophobicContact CD2-CG2 3.53Å; L288-V292 HydrophobicContact CD1-CG2 4.04Å; L288-V292 HydrophobicContact CG-CG2 4.5Å; L288-V292 WeakPolarHBondContact O-CG2 3.28Å; L288-V292 PolarHBondContact O-N 3.04Å; V292-K294 PolarHBondContact O-N 3.11Å; V292-V295 PolarHBondContact O-N 2.92Å; V292-F296 HydrophobicContact CG1-CD2 3.76Å; V292-F296 HydrophobicContact CG1-CE2 3.73Å; V292-F296 WeakPolarHBondContact O-CD2 3.1Å; V292-F296 PolarHBondContact O-N 3.41Å
293	Y	95.5	Very high	91.7	Very high	70 Å²	70	41.1 Å²	41.1	28%	0.275	22%	0.223	S	C	.	.	H	α-helix	trans	-56.8	-43.6	169.2	169.7	-95.1	0	0	0	113.3	A289 Q291 V295 F296 A297 V307 M309	A289-Y293 WeakPolarHBondContact O-CB 3.39Å; A289-Y293 PolarHBondContact O-N 2.82Å; Q291-Y293 VanDerWaalsContact C-N 3.28Å; Q291-Y293 PolarHBondContact O-N 2.89Å; Y293-V295 VanDerWaalsContact C-N 3.31Å; Y293-V295 PolarHBondContact O-N 3.31Å; Y293-F296 PolarHBondContact O-N 3.37Å; Y293-A297 HydrophobicContact CE1-CB 4.48Å; Y293-A297 VanDerWaalsContact O-CB 3.29Å; Y293-A297 WeakPolarHBondContact O-CB 3.45Å; Y293-A297 PolarHBondContact O-N 2.92Å; Y293-V307 HydrophobicContact CD2-CG1 3.7Å; Y293-V307 HydrophobicContact CE2-CB 4.32Å; Y293-V307 HydrophobicContact CE2-CG1 3.84Å; Y293-M309 HydrophobicContact CD1-CB 4.47Å; Y293-M309 HydrophobicContact CD2-CB 3.59Å; Y293-M309 HydrophobicContact CD2-CG 4.44Å; Y293-M309 HydrophobicContact CE2-CB 3.97Å; Y293-M309 HydrophobicContact CG-CB 3.85Å; Y293-M309 HydrophobicContact CG-CG 4.33Å; Y293-M309 HydrophobicContact CG-SD 4.35Å
294	K	93.7	Very high	91.7	Very high	129 Å²	129	44.2 Å²	44.2	56%	0.561	24%	0.244	S	C	*	.	H	α-helix	trans	-63.8	-38.8	177.5	-67.7	165.8	-176.5	173.9	0	111.6	Q290 Q291 V292 A297 S298	Q290-K294 WeakPolarHBondContact O-CG 3.43Å; Q290-K294 PolarHBondContact O-N 3.31Å; Q291-K294 WeakPolarHBondContact O-CB 3.44Å; Q291-K294 PolarHBondContact O-N 2.97Å; V292-K294 PolarHBondContact O-N 3.11Å; K294-A297 PolarHBondContact O-N 2.94Å; K294-S298 WeakPolarHBondContact O-CB 3.32Å; K294-S298 PolarHBondContact O-N 3.07Å
295	V	95.2	Very high	92	Very high	34 Å²	34	43.1 Å²	43.1	21%	0.206	24%	0.236	C	C	.	.	H	α-helix	trans	-65.1	-50.2	178.3	-173.7	0	0	0	0	109.5	T258 L259 V262 Q291 V292 Y293 A297 S298 Y299	T258-V295 HydrophobicContact CG2-CB 4.36Å; T258-V295 HydrophobicContact CG2-CG1 4.28Å; T258-V295 HydrophobicContact CG2-CG2 4.33Å; L259-V295 HydrophobicContact CD2-CG1 3.63Å; V262-V295 HydrophobicContact CB-CG1 4.45Å; V262-V295 HydrophobicContact CG1-CG1 4.2Å; V262-V295 HydrophobicContact CG2-CG1 4.11Å; Q291-V295 PolarHBondContact O-N 3Å; V292-V295 PolarHBondContact O-N 2.92Å; Y293-V295 VanDerWaalsContact C-N 3.31Å; Y293-V295 PolarHBondContact O-N 3.31Å; V295-A297 PolarHBondContact O-N 2.96Å; V295-S298 PolarHBondContact O-N 3.47Å; V295-Y299 HydrophobicContact CG1-CD2 4Å; V295-Y299 HydrophobicContact CG1-CE2 4.08Å; V295-Y299 WeakPolarHBondContact O-CD2 3.36Å; V295-Y299 PolarHBondContact O-N 2.89Å; V295-Y299 VanDerWaalsContact O-N 3.16Å
296	F	96.9	Very high	92.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-55.6	-47.3	172.9	-86.5	-65.6	0	0	0	112.5	F261 V262 V265 I266 A281 V292 Y293 S298 Y299 A300 V307 I337 V339 I364	F261-F296 HydrophobicContact CD2-CE2 4.27Å; F261-F296 AromaticContact CD2-CZ 3.86Å; F261-F296 HydrophobicContact CD2-CZ 3.86Å; F261-F296 AromaticContact CE2-CE2 3.84Å; F261-F296 HydrophobicContact CE2-CE2 3.84Å; F261-F296 AromaticContact CE2-CZ 3.92Å; F261-F296 HydrophobicContact CE2-CZ 3.92Å; V262-F296 HydrophobicContact CB-CD1 4.25Å; V262-F296 HydrophobicContact CB-CE1 4.11Å; V262-F296 HydrophobicContact CG1-CD1 3.83Å; V262-F296 HydrophobicContact CG1-CE1 4.15Å; V262-F296 HydrophobicContact CG1-CG 4.35Å; V262-F296 HydrophobicContact CG2-CD1 3.9Å; V262-F296 HydrophobicContact CG2-CD2 4.01Å; V262-F296 HydrophobicContact CG2-CE1 3.78Å; V262-F296 HydrophobicContact CG2-CE2 3.91Å; V262-F296 HydrophobicContact CG2-CG 4Å; V262-F296 HydrophobicContact CG2-CZ 3.79Å; V265-F296 HydrophobicContact CG1-CE1 4.4Å; I266-F296 HydrophobicContact CD1-CD1 4.01Å; I266-F296 HydrophobicContact CG1-CD1 4Å; I266-F296 HydrophobicContact CG1-CE1 4.41Å; A281-F296 HydrophobicContact CB-CE2 4.1Å; V292-F296 HydrophobicContact CG1-CD2 3.76Å; V292-F296 HydrophobicContact CG1-CE2 3.73Å; V292-F296 WeakPolarHBondContact O-CD2 3.1Å; V292-F296 PolarHBondContact O-N 3.41Å; Y293-F296 PolarHBondContact O-N 3.37Å; F296-S298 PolarHBondContact O-N 3.15Å; F296-Y299 PolarHBondContact O-N 3Å; F296-A300 WeakPolarHBondContact O-CB 3.4Å; F296-A300 PolarHBondContact O-N 2.77Å; F296-V307 HydrophobicContact CB-CG1 3.69Å; F296-V307 HydrophobicContact CB-CG2 4.1Å; F296-V307 HydrophobicContact CG-CG1 4.5Å; F296-I337 HydrophobicContact CD1-CD1 3.59Å; F296-I337 HydrophobicContact CD1-CG2 3.99Å; F296-I337 HydrophobicContact CD2-CG2 4.23Å; F296-I337 HydrophobicContact CE1-CD1 3.76Å; F296-I337 HydrophobicContact CE1-CG2 3.98Å; F296-I337 HydrophobicContact CE2-CG2 4.21Å; F296-I337 HydrophobicContact CG-CD1 4.5Å; F296-I337 HydrophobicContact CG-CG2 4.13Å; F296-I337 HydrophobicContact CZ-CG2 4.09Å; F296-V339 HydrophobicContact CD2-CG2 3.82Å; F296-V339 HydrophobicContact CE2-CG2 4.27Å; F296-I364 HydrophobicContact CZ-CD1 3.93Å
297	A	96.3	Very high	93.1	Very high	32 Å²	32	44.2 Å²	44.2	26%	0.264	24%	0.241	S	C	.	.	H	α-helix	trans	-62.1	-43.9	-178.6	0	0	0	0	0	112.6	Y293 K294 V295 A300 E301	Y293-A297 HydrophobicContact CE1-CB 4.48Å; Y293-A297 VanDerWaalsContact O-CB 3.29Å; Y293-A297 WeakPolarHBondContact O-CB 3.45Å; Y293-A297 PolarHBondContact O-N 2.92Å; K294-A297 PolarHBondContact O-N 2.94Å; V295-A297 PolarHBondContact O-N 2.96Å; A297-A300 PolarHBondContact O-N 2.88Å; A297-E301 PolarHBondContact O-N 2.86Å
298	S	95.8	Very high	93.7	Very high	43 Å²	43	42.4 Å²	42.4	30%	0.301	23%	0.234	S	C	.	.	H	α-helix	trans	-65	-40	179.2	176.6	0	0	0	0	112.8	K294 V295 F296	K294-S298 WeakPolarHBondContact O-CB 3.32Å; K294-S298 PolarHBondContact O-N 3.07Å; V295-S298 PolarHBondContact O-N 3.47Å; F296-S298 PolarHBondContact O-N 3.15Å
299	Y	95.4	Very high	94	Very high	11 Å²	11	43.2 Å²	43.2	4%	0.043	24%	0.238	C	C	.	.	H	α-helix	trans	-78.2	-25	176	-74	-76.7	0	0	0	112.9	K207 L208 N211 I213 L259 V262 I263 I266 V295 F296	K207-Y299 HydrophobicContact CB-CD1 4.14Å; K207-Y299 HydrophobicContact CB-CE1 4.21Å; K207-Y299 PolarHBondContact NZ-O 2.92Å; L208-Y299 HydrophobicContact CD2-CE1 3.78Å; L208-Y299 HydrophobicContact CG-CE1 4.02Å; N211-Y299 PolarHBondContact ND2-OH 2.66Å; I213-Y299 WeakPolarHBondContact CD1-OH 3.39Å; L259-Y299 HydrophobicContact CD2-CD2 4.13Å; L259-Y299 HydrophobicContact CD2-CE2 3.54Å; V262-Y299 HydrophobicContact CG1-CD2 4.24Å; I263-Y299 HydrophobicContact CD1-CD1 3.58Å; I263-Y299 HydrophobicContact CD1-CD2 4.26Å; I263-Y299 HydrophobicContact CD1-CE1 3.85Å; I263-Y299 HydrophobicContact CD1-CG 3.83Å; I266-Y299 VanDerWaalsContact CD1-CB 3.42Å; V295-Y299 HydrophobicContact CG1-CD2 4Å; V295-Y299 HydrophobicContact CG1-CE2 4.08Å; V295-Y299 WeakPolarHBondContact O-CD2 3.36Å; V295-Y299 PolarHBondContact O-N 2.89Å; V295-Y299 VanDerWaalsContact O-N 3.16Å; F296-Y299 PolarHBondContact O-N 3Å
300	A	95.1	Very high	94.2	Very high	6 Å²	6	43.2 Å²	43.2	5%	0.05	24%	0.238	C	C	.	.	H	α-helix	trans	-81.5	-17.4	175.2	0	0	0	0	0	114.1	I266 F296 A297 G302 T303 V305 V307	I266-A300 HydrophobicContact CD1-CB 4.3Å; F296-A300 WeakPolarHBondContact O-CB 3.4Å; F296-A300 PolarHBondContact O-N 2.77Å; A297-A300 PolarHBondContact O-N 2.88Å; A300-G302 PolarHBondContact O-N 3.34Å; A300-T303 WeakPolarHBondContact O-CB 3.42Å; A300-T303 WeakPolarHBondContact O-CG2 3.45Å; A300-T303 PolarHBondContact O-N 3.17Å; A300-T303 PolarHBondContact O-OG1 3.45Å; A300-V305 HydrophobicContact CB-CB 4.44Å; A300-V307 HydrophobicContact CB-CG2 3.69Å
301	E	93.9	Very high	93.9	Very high	143 Å²	143	40.1 Å²	40.1	67%	0.668	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.2	125.9	178.2	-175	165.5	-163.2	0	0	111.8	K207 A297 T303	K207-E301 WeakPolarHBondContact CE-O 3.26Å; K207-E301 PolarHBondContact NZ-O 3.4Å; A297-E301 PolarHBondContact O-N 2.86Å; E301-T303 VanDerWaalsContact C-N 3.27Å; E301-T303 PolarHBondContact O-N 2.93Å
302	G	89	Confident	93.6	Very high	69 Å²	69	39.4 Å²	39.4	71%	0.711	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.1	17.2	-173.3	0	0	0	0	0	115.2	Q203 A300	Q203-G302 PolarHBondContact NE2-O 3.44Å; A300-G302 PolarHBondContact O-N 3.34Å
303	T	92.7	Very high	93	Very high	20 Å²	20	43.7 Å²	43.7	12%	0.123	25%	0.247	C	C	.	.	S	Bend	trans	-109.7	165.9	162.7	78.1	0	0	0	0	109.2	M270 A300 E301 V305	M270-T303 HydrophobicContact CG-CG2 4.27Å; M270-T303 HydrophobicContact SD-CG2 4.25Å; A300-T303 WeakPolarHBondContact O-CB 3.42Å; A300-T303 WeakPolarHBondContact O-CG2 3.45Å; A300-T303 PolarHBondContact O-N 3.17Å; A300-T303 PolarHBondContact O-OG1 3.45Å; E301-T303 VanDerWaalsContact C-N 3.27Å; E301-T303 PolarHBondContact O-N 2.93Å; T303-V305 PolarHBondContact O-N 2.99Å; T303-V305 WeakPolarHBondContact OG1-CB 3.44Å; T303-V305 PolarHBondContact OG1-N 2.98Å; T303-V305 VanDerWaalsContact OG1-N 3.17Å
304	P	93.4	Very high	92.5	Very high	67 Å²	67	48.3 Å²	48.3	44%	0.435	26%	0.264	S	S	.	.	S	Bend	trans	-70.2	-9.5	172.5	29.4	-36.7	0	0	0	114.1	R272	R272-P304 PolarHBondContact NH2-O 2.93Å
305	V	95.3	Very high	92.4	Very high	9 Å²	9	45.9 Å²	45.9	6%	0.055	26%	0.263	C	S	.	.			trans	-76.2	127.8	-169.3	-173.9	0	0	0	0	111.8	L269 M270 A300 T303 D336 I337	L269-V305 HydrophobicContact CB-CG1 4.06Å; L269-V305 HydrophobicContact CB-CG2 3.87Å; L269-V305 HydrophobicContact CD1-CG1 4.37Å; L269-V305 WeakPolarHBondContact O-CG2 3.48Å; M270-V305 HydrophobicContact CG-CG2 4.22Å; A300-V305 HydrophobicContact CB-CB 4.44Å; T303-V305 PolarHBondContact O-N 2.99Å; T303-V305 WeakPolarHBondContact OG1-CB 3.44Å; T303-V305 PolarHBondContact OG1-N 2.98Å; T303-V305 VanDerWaalsContact OG1-N 3.17Å; V305-D336 HydrophobicContact CG1-CB 3.99Å; V305-I337 HydrophobicContact CG1-CD1 3.77Å; V305-I337 HydrophobicContact CG1-CG1 3.86Å
306	K	95.8	Very high	92.3	Very high	104 Å²	104	47.1 Å²	47.1	45%	0.452	27%	0.266	S	S	.	.			trans	-103.3	126.4	-178.7	-63	177.3	-167.6	160.3	0	112.1	R334 D336 I337	K306-R334 WeakPolarHBondContact CB-O 3.31Å; K306-R334 WeakPolarHBondContact CD-O 3.37Å; K306-D336 PolarHBondContact N-OD2 2.69Å; K306-D336 PolarHBondContact O-N 3.26Å; K306-I337 PolarHBondContact O-N 3.2Å
307	V	97	Very high	92	Very high	20 Å²	20	50.5 Å²	50.5	12%	0.121	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	130	-178.7	-169.1	0	0	0	0	110	Y293 F296 A300 I337 V339	Y293-V307 HydrophobicContact CD2-CG1 3.7Å; Y293-V307 HydrophobicContact CE2-CB 4.32Å; Y293-V307 HydrophobicContact CE2-CG1 3.84Å; F296-V307 HydrophobicContact CB-CG1 3.69Å; F296-V307 HydrophobicContact CB-CG2 4.1Å; F296-V307 HydrophobicContact CG-CG1 4.5Å; A300-V307 HydrophobicContact CB-CG2 3.69Å; V307-I337 CarbonylContact C-O 3.26Å; V307-I337 WeakPolarHBondContact CA-O 3.23Å; V307-I337 HydrophobicContact CG1-CB 4.3Å; V307-I337 HydrophobicContact CG1-CG2 4.34Å; V307-I337 HydrophobicContact CG2-CB 4.31Å; V307-I337 HydrophobicContact CG2-CD1 4.35Å; V307-V339 HydrophobicContact CG1-CG2 4.29Å
308	V	95.9	Very high	91.7	Very high	18 Å²	18	50.8 Å²	50.8	11%	0.109	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	143	177.1	175.1	0	0	0	0	110.7	L310 L323 A335 I337 V338 V339	V308-L310 HydrophobicContact CG1-CD2 4.15Å; V308-L323 HydrophobicContact CB-CD2 4.47Å; V308-L323 HydrophobicContact CG1-CD2 4Å; V308-L323 HydrophobicContact CG1-CG 4.41Å; V308-A335 HydrophobicContact CB-CB 4Å; V308-A335 HydrophobicContact CG2-CB 3.66Å; V308-I337 PolarHBondContact N-O 2.93Å; V308-V338 WeakPolarHBondContact O-CA 3.2Å; V308-V339 PolarHBondContact O-N 2.88Å
309	M	94.8	Very high	91.5	Very high	26 Å²	26	48.9 Å²	48.9	13%	0.128	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	135.1	174.8	-167.3	-176.5	174.9	0	0	111.7	K286 A289 Q290 Y293 Q313 V339	K286-M309 WeakPolarHBondContact O-CE 3.37Å; A289-M309 HydrophobicContact CB-CE 3.66Å; Q290-M309 HydrophobicContact CB-CE 3.85Å; Q290-M309 HydrophobicContact CB-SD 4.08Å; Q290-M309 VanDerWaalsContact N-CE 3.26Å; Y293-M309 HydrophobicContact CD1-CB 4.47Å; Y293-M309 HydrophobicContact CD2-CB 3.59Å; Y293-M309 HydrophobicContact CD2-CG 4.44Å; Y293-M309 HydrophobicContact CE2-CB 3.97Å; Y293-M309 HydrophobicContact CG-CB 3.85Å; Y293-M309 HydrophobicContact CG-CG 4.33Å; Y293-M309 HydrophobicContact CG-SD 4.35Å; M309-Q313 VanDerWaalsContact CE-NE2 3.28Å; M309-V339 CarbonylContact C-O 3.47Å; M309-V339 WeakPolarHBondContact CA-O 3.24Å
310	L	93.7	Very high	91.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	67.4	177	-56.4	178.7	0	0	0	110.2	V308 E319 L323 V338 V339 V340 R344 F355	V308-L310 HydrophobicContact CG1-CD2 4.15Å; L310-E319 HydrophobicContact CD2-CB 3.91Å; L310-E319 HydrophobicContact CD2-CG 4.38Å; L310-L323 HydrophobicContact CD1-CD1 3.87Å; L310-L323 HydrophobicContact CD1-CD2 4.04Å; L310-L323 HydrophobicContact CD1-CG 4.43Å; L310-L323 HydrophobicContact CD2-CD1 3.71Å; L310-L323 HydrophobicContact CD2-CD2 4.1Å; L310-L323 HydrophobicContact CD2-CG 3.92Å; L310-L323 HydrophobicContact CG-CD1 4.41Å; L310-L323 HydrophobicContact CG-CD2 4.39Å; L310-V338 HydrophobicContact CD1-CG1 3.45Å; L310-V338 VanDerWaalsContact CD1-CG1 3.45Å; L310-V338 HydrophobicContact CG-CG1 3.91Å; L310-V339 PolarHBondContact N-O 3.2Å; L310-V340 HydrophobicContact CB-CB 4.04Å; L310-V340 HydrophobicContact CB-CG2 3.72Å; L310-V340 HydrophobicContact CD1-CG2 4.28Å; L310-V340 WeakPolarHBondContact O-CG2 3.41Å; L310-R344 HydrophobicContact CB-CG 4.37Å; L310-R344 WeakPolarHBondContact O-CG 3.42Å; L310-F355 HydrophobicContact CD1-CE2 4.03Å
311	G	83.8	Confident	91	Very high	0 Å²	0	52 Å²	52	0%	0	31%	0.309	C	S	.	.	S	Bend	trans	-99.9	1	178.5	0	0	0	0	0	114.3	K286	K286-G311 WeakPolarHBondContact CD-O 3.05Å; K286-G311 WeakPolarHBondContact CE-O 3.43Å; K286-G311 PolarHBondContact NZ-O 2.9Å
312	G	83.3	Confident	90.8	Very high	26 Å²	26	46.6 Å²	46.6	27%	0.268	29%	0.287	S	S	.	.	S	Bend	trans	62.2	46.8	-170.4	0	0	0	0	0	111	K286 E319	K286-G312 PolarHBondContact NZ-O 3.5Å; G312-E319 VanDerWaalsContact CA-OE1 3.23Å; G312-E319 WeakPolarHBondContact CA-OE1 3.31Å; G312-E319 PolarHBondContact N-OE1 2.97Å
313	Q	79.8	Confident	90.8	Very high	90 Å²	90	43.4 Å²	43.4	42%	0.421	25%	0.254	S	S	.	.	S	Bend	trans	-95.7	-16.3	163.2	-64.3	87.2	-3.1	0	0	111.6	M309	M309-Q313 VanDerWaalsContact CE-NE2 3.28Å
314	R	86.4	Confident	90.6	Very high	167 Å²	167	43 Å²	43	63%	0.63	25%	0.253	S	S	*	.	S	Bend	trans	-115.2	167.5	174.9	-68	177.3	176.2	-178.9	-2	109.5	A318 E319 S322	R314-A318 HydrophobicContact CB-CB 4.25Å; R314-E319 HydrophobicContact CB-CG 3.87Å; R314-S322 PolarHBondContact NH1-OG 2.93Å
315	S	91.3	Very high	90.2	Very high	78 Å²	78	42.7 Å²	42.7	55%	0.545	25%	0.245	S	C	.	.			trans	-62.8	152.5	170.9	66.1	0	0	0	0	110.7	A317 A318 E319	S315-A317 VanDerWaalsContact C-N 3.29Å; S315-A317 PolarHBondContact O-N 3.43Å; S315-A318 PolarHBondContact O-N 2.68Å; S315-A318 VanDerWaalsContact O-N 3.1Å; S315-A318 WeakPolarHBondContact OG-CB 3.28Å; S315-A318 PolarHBondContact OG-N 3.15Å; S315-E319 PolarHBondContact O-N 3.4Å
316	F	92.1	Very high	89.5	Confident	60 Å²	60	49.2 Å²	49.2	26%	0.263	28%	0.275	S	S	.	.	H	α-helix	trans	-57.9	-41.8	-179.5	-177.3	-112.3	0	0	0	111.9	A318 E319 C320 D347 H348 K351 N352	F316-A318 PolarHBondContact O-N 3.43Å; F316-E319 PolarHBondContact O-N 2.93Å; F316-C320 VanDerWaalsContact CZ-SG 3.57Å; F316-C320 PolarHBondContact O-N 2.8Å; F316-C320 PolarHBondContact O-SG 3.49Å; F316-D347 HydrophobicContact CE2-CB 4.37Å; F316-H348 AromaticContact CD2-CE1 3.57Å; F316-H348 AromaticContact CD2-NE2 3.89Å; F316-H348 AromaticContact CE2-CE1 3.32Å; F316-H348 WeakPolarHBondContact CE2-CE1 3.46Å; F316-H348 AromaticContact CE2-CG 3.84Å; F316-H348 AromaticContact CE2-ND1 3.33Å; F316-H348 VanDerWaalsContact CE2-ND1 3.33Å; F316-H348 WeakPolarHBondContact CE2-ND1 3.36Å; F316-H348 AromaticContact CE2-NE2 3.8Å; F316-H348 AromaticContact CZ-ND1 3.94Å; F316-K351 HydrophobicContact CE1-CB 3.88Å; F316-K351 HydrophobicContact CZ-CB 3.59Å; F316-N352 HydrophobicContact CZ-CB 4.12Å
317	A	90.4	Very high	88.7	Confident	72 Å²	72	52.2 Å²	52.2	60%	0.595	28%	0.283	S	S	*	.	H	α-helix	trans	-58.7	-43.1	175.1	0	0	0	0	0	112.9	S315 C320 A321	S315-A317 VanDerWaalsContact C-N 3.29Å; S315-A317 PolarHBondContact O-N 3.43Å; A317-C320 PolarHBondContact O-N 3.1Å; A317-A321 WeakPolarHBondContact O-CB 3.35Å; A317-A321 PolarHBondContact O-N 3.32Å
318	A	90.4	Very high	88	Confident	37 Å²	37	54.2 Å²	54.2	31%	0.306	31%	0.308	S	S	.	.	H	α-helix	trans	-69.6	-32.7	177.8	0	0	0	0	0	112.8	R314 S315 F316 S322	R314-A318 HydrophobicContact CB-CB 4.25Å; S315-A318 PolarHBondContact O-N 2.68Å; S315-A318 VanDerWaalsContact O-N 3.1Å; S315-A318 WeakPolarHBondContact OG-CB 3.28Å; S315-A318 PolarHBondContact OG-N 3.15Å; F316-A318 PolarHBondContact O-N 3.43Å; A318-S322 WeakPolarHBondContact O-CB 3.5Å; A318-S322 PolarHBondContact O-N 3.42Å; A318-S322 VanDerWaalsContact O-N 3.07Å; A318-S322 PolarHBondContact O-OG 2.66Å
319	E	92.2	Very high	87	Confident	3 Å²	3	59.1 Å²	59.1	1%	0.014	34%	0.344	C	S	.	.	H	α-helix	trans	-69.2	-42.8	171.9	-68.8	-177.8	159.7	0	0	111.1	L310 G312 R314 S315 F316 S322 L323 R344 H348	L310-E319 HydrophobicContact CD2-CB 3.91Å; L310-E319 HydrophobicContact CD2-CG 4.38Å; G312-E319 VanDerWaalsContact CA-OE1 3.23Å; G312-E319 WeakPolarHBondContact CA-OE1 3.31Å; G312-E319 PolarHBondContact N-OE1 2.97Å; R314-E319 HydrophobicContact CB-CG 3.87Å; S315-E319 PolarHBondContact O-N 3.4Å; F316-E319 PolarHBondContact O-N 2.93Å; E319-S322 WeakPolarHBondContact O-CB 2.99Å; E319-S322 PolarHBondContact O-N 3.26Å; E319-L323 WeakPolarHBondContact O-CG 3.3Å; E319-L323 PolarHBondContact O-N 2.88Å; E319-L323 VanDerWaalsContact O-N 3.15Å; E319-R344 IonicContact OE2-CZ 2.71Å; E319-R344 IonicContact OE2-NE 2.74Å; E319-R344 PolarHBondContact OE2-NE 3.06Å; E319-R344 IonicContact OE2-NH2 3.73Å; E319-R344 PolarHBondContact OE2-NH2 2.8Å; E319-H348 IonicContact OE2-NE2 3.06Å
320	C	90.6	Very high	86	Confident	19 Å²	19	62 Å²	62	13%	0.128	36%	0.363	C	S	.	.	H	α-helix	trans	-61.2	-44.1	174.2	-67.3	0	0	0	0	113	F316 A317 S322 L323 S324	F316-C320 VanDerWaalsContact CZ-SG 3.57Å; F316-C320 PolarHBondContact O-N 2.8Å; F316-C320 PolarHBondContact O-SG 3.49Å; A317-C320 PolarHBondContact O-N 3.1Å; C320-S322 VanDerWaalsContact C-N 3.28Å; C320-S322 PolarHBondContact O-N 3.24Å; C320-L323 PolarHBondContact O-N 3.01Å; C320-S324 PolarHBondContact O-N 2.8Å
321	A	89.7	Confident	85.2	Confident	63 Å²	63	66.4 Å²	66.4	52%	0.521	38%	0.379	S	S	.	.	H	α-helix	trans	-67.6	-26.5	175.4	0	0	0	0	0	113.1	A317 L323	A317-A321 WeakPolarHBondContact O-CB 3.35Å; A317-A321 PolarHBondContact O-N 3.32Å; A321-L323 VanDerWaalsContact C-N 3.33Å
322	S	89.9	Confident	85.2	Confident	30 Å²	30	68.5 Å²	68.5	21%	0.21	39%	0.393	C	S	.	.	H	α-helix	trans	-72.7	-26.5	172.9	-58.7	0	0	0	0	112.4	R314 A318 E319 C320	R314-S322 PolarHBondContact NH1-OG 2.93Å; A318-S322 WeakPolarHBondContact O-CB 3.5Å; A318-S322 PolarHBondContact O-N 3.42Å; A318-S322 VanDerWaalsContact O-N 3.07Å; A318-S322 PolarHBondContact O-OG 2.66Å; E319-S322 WeakPolarHBondContact O-CB 2.99Å; E319-S322 PolarHBondContact O-N 3.26Å; C320-S322 VanDerWaalsContact C-N 3.28Å; C320-S322 PolarHBondContact O-N 3.24Å
323	L	89.3	Confident	85.5	Confident	2 Å²	2	68 Å²	68	1%	0.01	39%	0.385	C	S	.	.	H	α-helix	trans	-85.5	-33.6	-176.7	-75.1	164.3	0	0	0	114.2	I277 V308 L310 E319 C320 A321 R334 A335 V338 F355	I277-L323 HydrophobicContact CD1-CD2 4.46Å; V308-L323 HydrophobicContact CB-CD2 4.47Å; V308-L323 HydrophobicContact CG1-CD2 4Å; V308-L323 HydrophobicContact CG1-CG 4.41Å; L310-L323 HydrophobicContact CD1-CD1 3.87Å; L310-L323 HydrophobicContact CD1-CD2 4.04Å; L310-L323 HydrophobicContact CD1-CG 4.43Å; L310-L323 HydrophobicContact CD2-CD1 3.71Å; L310-L323 HydrophobicContact CD2-CD2 4.1Å; L310-L323 HydrophobicContact CD2-CG 3.92Å; L310-L323 HydrophobicContact CG-CD1 4.41Å; L310-L323 HydrophobicContact CG-CD2 4.39Å; E319-L323 WeakPolarHBondContact O-CG 3.3Å; E319-L323 PolarHBondContact O-N 2.88Å; E319-L323 VanDerWaalsContact O-N 3.15Å; C320-L323 PolarHBondContact O-N 3.01Å; A321-L323 VanDerWaalsContact C-N 3.33Å; L323-R334 PolarHBondContact O-N 3.01Å; L323-A335 HydrophobicContact CD2-CB 4.28Å; L323-V338 HydrophobicContact CD2-CG2 3.89Å; L323-F355 HydrophobicContact CD1-CD2 3.92Å; L323-F355 HydrophobicContact CD2-CD2 4.25Å; L323-F355 HydrophobicContact CD2-CE2 4.45Å
324	S	87.9	Confident	86	Confident	13 Å²	13	68.9 Å²	68.9	9%	0.091	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	147	-171	62.5	0	0	0	0	112.4	C320 R331 C332	C320-S324 PolarHBondContact O-N 2.8Å; S324-R331 PolarHBondContact OG-NE 3.39Å; S324-R331 VanDerWaalsContact OG-NE 3.1Å; S324-R331 PolarHBondContact OG-NH2 2.92Å; S324-C332 CarbonylContact C-O 3.6Å; S324-C332 VanDerWaalsContact CA-O 3.29Å; S324-C332 WeakPolarHBondContact CA-O 3.26Å
325	E	85.7	Confident	86.3	Confident	60 Å²	60	60.9 Å²	60.9	28%	0.28	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	142.7	174.5	-170.1	170.4	-102.4	0	0	109.3	R327 C332 R334	E325-R327 HydrophobicContact CG-CG 4.38Å; E325-R327 IonicContact OE2-CZ 2.64Å; E325-R327 IonicContact OE2-NE 3.8Å; E325-R327 PolarHBondContact OE2-NE 2.71Å; E325-R327 IonicContact OE2-NH2 2.7Å; E325-R327 PolarHBondContact OE2-NH2 2.78Å; E325-C332 PolarHBondContact N-O 3.41Å; E325-C332 PolarHBondContact O-N 3.06Å; E325-R334 HydrophobicContact CB-CG 4.19Å; E325-R334 IonicContact OE1-CZ 2.65Å; E325-R334 IonicContact OE1-NH1 2.76Å; E325-R334 PolarHBondContact OE1-NH1 3.37Å; E325-R334 IonicContact OE1-NH2 3.87Å
326	Q	79.9	Confident	86.6	Confident	145 Å²	145	57.2 Å²	57.2	68%	0.678	33%	0.329	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102	123.2	173.4	-177.2	171.2	-16.5	0	0	109.2	G328	Q326-G328 WeakPolarHBondContact CG-O 3.5Å; Q326-G328 PolarHBondContact NE2-O 3.35Å
327	R	79.4	Confident	86.8	Confident	167 Å²	167	54.3 Å²	54.3	63%	0.63	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119	91.6	-179.6	-66.5	-173.9	176.5	-150.2	-5.8	108.3	E325 S329 V330	E325-R327 HydrophobicContact CG-CG 4.38Å; E325-R327 IonicContact OE2-CZ 2.64Å; E325-R327 IonicContact OE2-NE 3.8Å; E325-R327 PolarHBondContact OE2-NE 2.71Å; E325-R327 IonicContact OE2-NH2 2.7Å; E325-R327 PolarHBondContact OE2-NH2 2.78Å; R327-S329 PolarHBondContact O-N 3.1Å; R327-V330 PolarHBondContact N-O 3.19Å; R327-V330 PolarHBondContact O-N 2.76Å
328	G	80.6	Confident	87.2	Confident	63 Å²	63	50.9 Å²	50.9	65%	0.649	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	-123.7	-170.4	0	0	0	0	0	111.4	Q326	Q326-G328 WeakPolarHBondContact CG-O 3.5Å; Q326-G328 PolarHBondContact NE2-O 3.35Å
329	S	75.1	Confident	87.5	Confident	121 Å²	121	49.1 Å²	49.1	85%	0.846	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.8	-18	175.2	51	0	0	0	0	114	R327	R327-S329 PolarHBondContact O-N 3.1Å
330	V	74.2	Confident	87.6	Confident	87 Å²	87	49 Å²	49	53%	0.527	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	134.2	-174.7	-176	0	0	0	0	110.5	R327	R327-V330 PolarHBondContact N-O 3.19Å; R327-V330 PolarHBondContact O-N 2.76Å
331	R	77.3	Confident	87.8	Confident	92 Å²	92	48.9 Å²	48.9	35%	0.347	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	129.7	171.8	-170.6	169.1	-174.7	163.8	-3.5	109.6	S324 N352 P353	S324-R331 PolarHBondContact OG-NE 3.39Å; S324-R331 VanDerWaalsContact OG-NE 3.1Å; S324-R331 PolarHBondContact OG-NH2 2.92Å; R331-N352 PolarHBondContact NH2-OD1 2.71Å; R331-P353 PolarHBondContact NH1-O 2.96Å; R331-P353 VanDerWaalsContact NH1-O 3.11Å
332	C	82.8	Confident	87.9	Confident	44 Å²	44	46.5 Å²	46.5	30%	0.297	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	134.6	-179.1	-53.4	0	0	0	0	110	S324 E325	S324-C332 CarbonylContact C-O 3.6Å; S324-C332 VanDerWaalsContact CA-O 3.29Å; S324-C332 WeakPolarHBondContact CA-O 3.26Å; E325-C332 PolarHBondContact N-O 3.41Å; E325-C332 PolarHBondContact O-N 3.06Å
333	S	89.6	Confident	87.9	Confident	15 Å²	15	47.3 Å²	47.3	11%	0.105	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	147.8	168	178.9	0	0	0	0	111.8	C275 E276 A335	C275-S333 WeakPolarHBondContact O-CB 3.44Å; C275-S333 PolarHBondContact SG-O 2.99Å; E276-S333 WeakPolarHBondContact OE1-CB 3.5Å; E276-S333 PolarHBondContact OE1-N 2.75Å; E276-S333 VanDerWaalsContact OE1-N 3.12Å; E276-S333 WeakPolarHBondContact OE2-CB 3.17Å; S333-A335 PolarHBondContact OG-N 3.21Å; S333-A335 PolarHBondContact OG-O 2.76Å
334	R	90.5	Very high	88	Confident	108 Å²	108	49 Å²	49	41%	0.408	27%	0.27	S	S	.	.			trans	-105.9	-1	170.4	-58.4	-176.9	80.2	117.7	11.4	112.6	C275 K306 L323 E325	C275-R334 VanDerWaalsContact SG-C 3.56Å; K306-R334 WeakPolarHBondContact CB-O 3.31Å; K306-R334 WeakPolarHBondContact CD-O 3.37Å; L323-R334 PolarHBondContact O-N 3.01Å; E325-R334 HydrophobicContact CB-CG 4.19Å; E325-R334 IonicContact OE1-CZ 2.65Å; E325-R334 IonicContact OE1-NH1 2.76Å; E325-R334 PolarHBondContact OE1-NH1 3.37Å; E325-R334 IonicContact OE1-NH2 3.87Å
335	A	94.3	Very high	88.3	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.266	C	S	.	.			trans	-127.8	136.8	-173.5	0	0	0	0	0	112.1	E276 I277 V308 L323 S333 V338	E276-A335 CarbonylContact C-O 3.58Å; E276-A335 VanDerWaalsContact C-O 3.26Å; I277-A335 HydrophobicContact CG1-CB 4.37Å; I277-A335 WeakPolarHBondContact CG1-O 3.13Å; I277-A335 PolarHBondContact N-O 2.8Å; V308-A335 HydrophobicContact CB-CB 4Å; V308-A335 HydrophobicContact CG2-CB 3.66Å; L323-A335 HydrophobicContact CD2-CB 4.28Å; S333-A335 PolarHBondContact OG-N 3.21Å; S333-A335 PolarHBondContact OG-O 2.76Å; A335-V338 HydrophobicContact CB-CG2 3.93Å
336	D	95.8	Very high	88.6	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.264	C	S	.	.	S	Bend	trans	-103.4	-39.1	170.5	-60.5	-62.5	0	0	0	111.2	R272 C275 E276 R278 A279 V305 K306	R272-D336 WeakPolarHBondContact CD-OD1 3.19Å; R272-D336 IonicContact CZ-OD1 2.71Å; R272-D336 IonicContact CZ-OD2 2.68Å; R272-D336 IonicContact NE-OD1 3.35Å; R272-D336 PolarHBondContact NE-OD1 3.23Å; R272-D336 IonicContact NE-OD2 3.9Å; R272-D336 PolarHBondContact NE-OD2 2.97Å; R272-D336 VanDerWaalsContact NE-OD2 3.15Å; R272-D336 IonicContact NH2-OD1 3.96Å; R272-D336 IonicContact NH2-OD2 3.16Å; R272-D336 PolarHBondContact NH2-OD2 3.43Å; C275-D336 WeakPolarHBondContact CA-OD1 3.39Å; E276-D336 PolarHBondContact N-OD1 3.3Å; E276-D336 VanDerWaalsContact N-OD1 3.11Å; R278-D336 PolarHBondContact N-O 2.84Å; R278-D336 IonicContact NH1-OD1 2.7Å; A279-D336 PolarHBondContact N-O 2.81Å; V305-D336 HydrophobicContact CG1-CB 3.99Å; K306-D336 PolarHBondContact N-OD2 2.69Å; K306-D336 PolarHBondContact O-N 3.26Å
337	I	97.6	Very high	89.2	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.2	177.2	-50.5	-173.6	0	0	0	108.9	V265 I266 L269 A279 F296 V305 K306 V307 V308 V339	V265-I337 HydrophobicContact CG1-CD1 4.47Å; I266-I337 HydrophobicContact CG1-CD1 3.89Å; L269-I337 HydrophobicContact CD1-CD1 3.86Å; L269-I337 HydrophobicContact CD1-CG1 3.52Å; A279-I337 HydrophobicContact CB-CB 4.48Å; A279-I337 HydrophobicContact CB-CG1 4.18Å; A279-I337 HydrophobicContact CB-CG2 4.26Å; A279-I337 WeakPolarHBondContact O-CA 3.5Å; F296-I337 HydrophobicContact CD1-CD1 3.59Å; F296-I337 HydrophobicContact CD1-CG2 3.99Å; F296-I337 HydrophobicContact CD2-CG2 4.23Å; F296-I337 HydrophobicContact CE1-CD1 3.76Å; F296-I337 HydrophobicContact CE1-CG2 3.98Å; F296-I337 HydrophobicContact CE2-CG2 4.21Å; F296-I337 HydrophobicContact CG-CD1 4.5Å; F296-I337 HydrophobicContact CG-CG2 4.13Å; F296-I337 HydrophobicContact CZ-CG2 4.09Å; V305-I337 HydrophobicContact CG1-CD1 3.77Å; V305-I337 HydrophobicContact CG1-CG1 3.86Å; K306-I337 PolarHBondContact O-N 3.2Å; V307-I337 CarbonylContact C-O 3.26Å; V307-I337 WeakPolarHBondContact CA-O 3.23Å; V307-I337 HydrophobicContact CG1-CB 4.3Å; V307-I337 HydrophobicContact CG1-CG2 4.34Å; V307-I337 HydrophobicContact CG2-CB 4.31Å; V307-I337 HydrophobicContact CG2-CD1 4.35Å; V308-I337 PolarHBondContact N-O 2.93Å; I337-V339 HydrophobicContact CG2-CG2 4.39Å
338	V	97.4	Very high	89.8	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	126.7	175.5	173.2	0	0	0	0	110.3	I277 A279 L280 A281 V308 L310 L323 A335 V340 F355	I277-V338 HydrophobicContact CD1-CG2 4.05Å; I277-V338 HydrophobicContact CG1-CG2 4.19Å; I277-V338 HydrophobicContact CG2-CB 4.48Å; I277-V338 HydrophobicContact CG2-CG2 3.99Å; A279-V338 PolarHBondContact O-N 2.59Å; L280-V338 WeakPolarHBondContact CA-O 3.26Å; L280-V338 HydrophobicContact CD1-CB 3.78Å; L280-V338 HydrophobicContact CD1-CG1 3.7Å; A281-V338 PolarHBondContact N-O 2.78Å; V308-V338 WeakPolarHBondContact O-CA 3.2Å; L310-V338 HydrophobicContact CD1-CG1 3.45Å; L310-V338 VanDerWaalsContact CD1-CG1 3.45Å; L310-V338 HydrophobicContact CG-CG1 3.91Å; L323-V338 HydrophobicContact CD2-CG2 3.89Å; A335-V338 HydrophobicContact CB-CG2 3.93Å; V338-V340 HydrophobicContact CG1-CB 4.23Å; V338-F355 HydrophobicContact CG1-CE2 4.23Å; V338-F355 HydrophobicContact CG2-CE2 4.45Å
339	V	97.5	Very high	90.4	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	114.7	179.4	-171.6	0	0	0	0	109.3	A281 L283 A289 F296 V307 V308 M309 L310 I337	A281-V339 HydrophobicContact CB-CG2 4.42Å; L283-V339 HydrophobicContact CD1-CG1 3.6Å; A289-V339 HydrophobicContact CB-CG1 4.21Å; A289-V339 WeakPolarHBondContact O-CG1 3.3Å; F296-V339 HydrophobicContact CD2-CG2 3.82Å; F296-V339 HydrophobicContact CE2-CG2 4.27Å; V307-V339 HydrophobicContact CG1-CG2 4.29Å; V308-V339 PolarHBondContact O-N 2.88Å; M309-V339 CarbonylContact C-O 3.47Å; M309-V339 WeakPolarHBondContact CA-O 3.24Å; L310-V339 PolarHBondContact N-O 3.2Å; I337-V339 HydrophobicContact CG2-CG2 4.39Å
340	V	95.6	Very high	91.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	155.5	-159.9	64.8	0	0	0	0	113.2	L280 A281 V282 L283 L310 V338 R344 L345	L280-V340 HydrophobicContact CD1-CG1 3.67Å; L280-V340 HydrophobicContact CG-CG1 4.33Å; A281-V340 PolarHBondContact O-N 2.91Å; V282-V340 WeakPolarHBondContact CA-O 3.15Å; V282-V340 HydrophobicContact CG2-CG1 4.08Å; L283-V340 PolarHBondContact N-O 2.88Å; L283-V340 VanDerWaalsContact N-O 3.1Å; L310-V340 HydrophobicContact CB-CB 4.04Å; L310-V340 HydrophobicContact CB-CG2 3.72Å; L310-V340 HydrophobicContact CD1-CG2 4.28Å; L310-V340 WeakPolarHBondContact O-CG2 3.41Å; V338-V340 HydrophobicContact CG1-CB 4.23Å; V340-R344 HydrophobicContact CG2-CB 4.36Å; V340-L345 HydrophobicContact CG1-CB 4.15Å; V340-L345 HydrophobicContact CG1-CD1 4.31Å; V340-L345 HydrophobicContact CG1-CD2 4.02Å; V340-L345 HydrophobicContact CG1-CG 4.41Å; V340-L345 HydrophobicContact CG2-CB 3.69Å
341	T	93	Very high	91.9	Very high	16 Å²	16	33.6 Å²	33.6	10%	0.098	18%	0.179	C	C	.	.			trans	-101.9	151.2	169.9	61.9	0	0	0	0	111.7	K286 A289 G343 R344 L345	K286-T341 HydrophobicContact CG-CG2 4.12Å; A289-T341 HydrophobicContact CB-CG2 4.14Å; T341-G343 PolarHBondContact O-N 2.99Å; T341-R344 WeakPolarHBondContact O-CA 3.43Å; T341-R344 PolarHBondContact O-N 3.24Å; T341-L345 PolarHBondContact O-N 3.07Å
342	P	91.8	Very high	92.5	Very high	13 Å²	13	29.7 Å²	29.7	8%	0.084	17%	0.165	C	C	.	.	H	α-helix	trans	-63.3	-44.2	-159.6	-25	36.1	0	0	0	114.7	V282 R344 L345 V346 M371 W379	V282-P342 HydrophobicContact CG1-CB 4.46Å; V282-P342 HydrophobicContact CG1-CG 3.94Å; P342-R344 VanDerWaalsContact C-N 3.26Å; P342-R344 PolarHBondContact O-N 3.15Å; P342-L345 WeakPolarHBondContact O-CB 3.27Å; P342-L345 PolarHBondContact O-N 3.24Å; P342-V346 PolarHBondContact O-N 3.11Å; P342-V346 VanDerWaalsContact O-N 3.17Å; P342-M371 HydrophobicContact CB-CE 4.23Å; P342-M371 HydrophobicContact CG-CE 3.46Å; P342-M371 VanDerWaalsContact CG-CE 3.46Å; P342-M371 HydrophobicContact CG-SD 3.75Å; P342-W379 HydrophobicContact CB-CB 4.12Å; P342-W379 HydrophobicContact CB-CD2 4.25Å; P342-W379 HydrophobicContact CB-CG 3.9Å
343	G	90.1	Very high	92.4	Very high	47 Å²	47	33.2 Å²	33.2	49%	0.485	19%	0.188	S	C	.	.	H	α-helix	trans	-63.1	-33.1	175.2	0	0	0	0	0	112.9	T341 D347	T341-G343 PolarHBondContact O-N 2.99Å; G343-D347 PolarHBondContact O-N 2.81Å; G343-D347 VanDerWaalsContact O-N 3.09Å
344	R	91.8	Very high	92.1	Very high	39 Å²	39	33.5 Å²	33.5	15%	0.147	19%	0.193	C	C	.	.	H	α-helix	trans	-77.1	-29	178.1	-166.4	46.5	157.2	-155	-8.7	112.8	L310 E319 V340 T341 P342 D347 H348	L310-R344 HydrophobicContact CB-CG 4.37Å; L310-R344 WeakPolarHBondContact O-CG 3.42Å; E319-R344 IonicContact OE2-CZ 2.71Å; E319-R344 IonicContact OE2-NE 2.74Å; E319-R344 PolarHBondContact OE2-NE 3.06Å; E319-R344 IonicContact OE2-NH2 3.73Å; E319-R344 PolarHBondContact OE2-NH2 2.8Å; V340-R344 HydrophobicContact CG2-CB 4.36Å; T341-R344 WeakPolarHBondContact O-CA 3.43Å; T341-R344 PolarHBondContact O-N 3.24Å; P342-R344 VanDerWaalsContact C-N 3.26Å; P342-R344 PolarHBondContact O-N 3.15Å; R344-D347 IonicContact CZ-OD2 2.64Å; R344-D347 IonicContact NH1-OD2 3.69Å; R344-D347 PolarHBondContact NH1-OD2 3.38Å; R344-D347 WeakPolarHBondContact O-CB 3.27Å; R344-D347 PolarHBondContact O-N 3.33Å; R344-H348 PolarHBondContact O-CD2 3.16Å; R344-H348 VanDerWaalsContact O-CD2 3.26Å; R344-H348 PolarHBondContact O-N 3.3Å; R344-H348 VanDerWaalsContact O-N 3.12Å
345	L	93.7	Very high	92.1	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.9	-46.9	170.2	-179.8	49.3	0	0	0	111.2	L280 V282 V340 T341 P342 H348 I349 F355 W379 V383	L280-L345 HydrophobicContact CD1-CD1 4.21Å; L280-L345 HydrophobicContact CD2-CD1 3.94Å; L280-L345 HydrophobicContact CD2-CD2 3.94Å; V282-L345 HydrophobicContact CG1-CD2 4.37Å; V282-L345 HydrophobicContact CG2-CD2 3.67Å; V340-L345 HydrophobicContact CG1-CB 4.15Å; V340-L345 HydrophobicContact CG1-CD1 4.31Å; V340-L345 HydrophobicContact CG1-CD2 4.02Å; V340-L345 HydrophobicContact CG1-CG 4.41Å; V340-L345 HydrophobicContact CG2-CB 3.69Å; T341-L345 PolarHBondContact O-N 3.07Å; P342-L345 WeakPolarHBondContact O-CB 3.27Å; P342-L345 PolarHBondContact O-N 3.24Å; L345-H348 PolarHBondContact O-N 3.15Å; L345-I349 HydrophobicContact CD1-CD1 3.81Å; L345-I349 HydrophobicContact CD1-CG1 4.18Å; L345-I349 HydrophobicContact CG-CD1 3.92Å; L345-I349 WeakPolarHBondContact O-CG1 3.35Å; L345-I349 PolarHBondContact O-N 3.16Å; L345-F355 HydrophobicContact CD1-CE1 3.56Å; L345-F355 HydrophobicContact CD1-CZ 3.56Å; L345-W379 HydrophobicContact CD2-CE3 4.24Å; L345-W379 HydrophobicContact CD2-CZ3 4.43Å; L345-V383 HydrophobicContact CD1-CG2 4.46Å; L345-V383 HydrophobicContact CD2-CG2 3.42Å; L345-V383 VanDerWaalsContact CD2-CG2 3.42Å; L345-V383 HydrophobicContact CG-CG2 3.84Å
346	V	92.4	Very high	91.8	Very high	39 Å²	39	31.3 Å²	31.3	24%	0.236	19%	0.192	C	C	.	.	H	α-helix	trans	-63.2	-41.9	176.3	178.7	0	0	0	0	111.3	P342 H348 I349 S350 W379 Q382	P342-V346 PolarHBondContact O-N 3.11Å; P342-V346 VanDerWaalsContact O-N 3.17Å; V346-H348 PolarHBondContact O-N 2.83Å; V346-I349 PolarHBondContact O-N 3.08Å; V346-S350 WeakPolarHBondContact O-CB 3.17Å; V346-S350 PolarHBondContact O-N 3.05Å; V346-S350 PolarHBondContact O-OG 3.09Å; V346-W379 HydrophobicContact CG2-CB 3.97Å; V346-Q382 HydrophobicContact CG2-CB 4.49Å
347	D	92.6	Very high	91.5	Very high	42 Å²	42	31.5 Å²	31.5	23%	0.225	19%	0.193	C	C	.	.	H	α-helix	trans	-50.1	-52	171.1	-104.7	-11.8	0	0	0	112.2	F316 G343 R344 S350 K351	F316-D347 HydrophobicContact CE2-CB 4.37Å; G343-D347 PolarHBondContact O-N 2.81Å; G343-D347 VanDerWaalsContact O-N 3.09Å; R344-D347 IonicContact CZ-OD2 2.64Å; R344-D347 IonicContact NH1-OD2 3.69Å; R344-D347 PolarHBondContact NH1-OD2 3.38Å; R344-D347 WeakPolarHBondContact O-CB 3.27Å; R344-D347 PolarHBondContact O-N 3.33Å; D347-S350 PolarHBondContact O-N 3.36Å; D347-K351 WeakPolarHBondContact O-CB 3.48Å; D347-K351 PolarHBondContact O-N 3.12Å; D347-K351 WeakPolarHBondContact OD1-CE 3.47Å; D347-K351 IonicContact OD1-NZ 3.56Å; D347-K351 PolarHBondContact OD1-NZ 3.07Å
348	H	93.1	Very high	91	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-70.5	-39	-178.9	-78	-73.4	0	0	0	112.6	F316 E319 R344 L345 V346 S350 N352 F355	F316-H348 AromaticContact CD2-CE1 3.57Å; F316-H348 AromaticContact CD2-NE2 3.89Å; F316-H348 AromaticContact CE2-CE1 3.32Å; F316-H348 WeakPolarHBondContact CE2-CE1 3.46Å; F316-H348 AromaticContact CE2-CG 3.84Å; F316-H348 AromaticContact CE2-ND1 3.33Å; F316-H348 VanDerWaalsContact CE2-ND1 3.33Å; F316-H348 WeakPolarHBondContact CE2-ND1 3.36Å; F316-H348 AromaticContact CE2-NE2 3.8Å; F316-H348 AromaticContact CZ-ND1 3.94Å; E319-H348 IonicContact OE2-NE2 3.06Å; R344-H348 PolarHBondContact O-CD2 3.16Å; R344-H348 VanDerWaalsContact O-CD2 3.26Å; R344-H348 PolarHBondContact O-N 3.3Å; R344-H348 VanDerWaalsContact O-N 3.12Å; L345-H348 PolarHBondContact O-N 3.15Å; V346-H348 PolarHBondContact O-N 2.83Å; H348-S350 VanDerWaalsContact C-N 3.31Å; H348-S350 PolarHBondContact O-N 3.38Å; H348-N352 HydrophobicContact CB-CB 4.39Å; H348-N352 WeakPolarHBondContact O-CB 3.34Å; H348-N352 PolarHBondContact O-N 3.41Å; H348-F355 HydrophobicContact CB-CB 4.23Å; H348-F355 HydrophobicContact CB-CD1 4.05Å; H348-F355 HydrophobicContact CB-CD2 4.34Å; H348-F355 HydrophobicContact CB-CG 3.95Å
349	I	92.1	Very high	90.5	Very high	37 Å²	37	35.6 Å²	35.6	19%	0.19	21%	0.212	C	C	.	.	H	α-helix	trans	-59.8	-40.4	174.9	-70.6	168.8	0	0	0	111.6	L345 V346 F355 L357 V383 A386	L345-I349 HydrophobicContact CD1-CD1 3.81Å; L345-I349 HydrophobicContact CD1-CG1 4.18Å; L345-I349 HydrophobicContact CG-CD1 3.92Å; L345-I349 WeakPolarHBondContact O-CG1 3.35Å; L345-I349 PolarHBondContact O-N 3.16Å; V346-I349 PolarHBondContact O-N 3.08Å; I349-F355 HydrophobicContact CD1-CE1 4.43Å; I349-F355 HydrophobicContact CG1-CD1 3.84Å; I349-F355 HydrophobicContact CG1-CE1 3.66Å; I349-L357 HydrophobicContact CD1-CD1 4.21Å; I349-L357 HydrophobicContact CG1-CD1 4.39Å; I349-V383 HydrophobicContact CD1-CB 4.49Å; I349-V383 HydrophobicContact CD1-CG2 3.8Å; I349-A386 HydrophobicContact CD1-CB 4.37Å; I349-A386 HydrophobicContact CG1-CB 4.37Å; I349-A386 HydrophobicContact CG2-CB 3.88Å
350	S	90.8	Very high	90.3	Very high	82 Å²	82	35.6 Å²	35.6	57%	0.573	21%	0.212	S	C	*	.	H	α-helix	trans	-89.9	-22.4	-176.1	-59.9	0	0	0	0	114.9	V346 D347 H348	V346-S350 WeakPolarHBondContact O-CB 3.17Å; V346-S350 PolarHBondContact O-N 3.05Å; V346-S350 PolarHBondContact O-OG 3.09Å; D347-S350 PolarHBondContact O-N 3.36Å; H348-S350 VanDerWaalsContact C-N 3.31Å; H348-S350 PolarHBondContact O-N 3.38Å
351	K	91.1	Very high	90.1	Very high	132 Å²	132	35.6 Å²	35.6	57%	0.574	21%	0.212	S	C	*	.	H	α-helix	trans	-126.3	-9.1	-169	-55.3	167.1	-177.3	167.6	0	115	F316 D347	F316-K351 HydrophobicContact CE1-CB 3.88Å; F316-K351 HydrophobicContact CZ-CB 3.59Å; D347-K351 WeakPolarHBondContact O-CB 3.48Å; D347-K351 PolarHBondContact O-N 3.12Å; D347-K351 WeakPolarHBondContact OD1-CE 3.47Å; D347-K351 IonicContact OD1-NZ 3.56Å; D347-K351 PolarHBondContact OD1-NZ 3.07Å
352	N	88.8	Confident	90.2	Very high	9 Å²	9	34.8 Å²	34.8	5%	0.048	21%	0.207	C	C	.	.			trans	-109.5	102.3	176.1	-176.8	9.5	0	0	0	110.3	F316 R331 H348 G354 F355	F316-N352 HydrophobicContact CZ-CB 4.12Å; R331-N352 PolarHBondContact NH2-OD1 2.71Å; H348-N352 HydrophobicContact CB-CB 4.39Å; H348-N352 WeakPolarHBondContact O-CB 3.34Å; H348-N352 PolarHBondContact O-N 3.41Å; N352-G354 PolarHBondContact O-N 2.86Å; N352-F355 HydrophobicContact CB-CB 4.07Å; N352-F355 PolarHBondContact O-N 2.99Å; N352-F355 VanDerWaalsContact O-N 3.07Å
353	P	81.9	Confident	90.4	Very high	118 Å²	118	34.2 Å²	34.2	77%	0.766	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.6	31.6	-172.5	30.9	-36.5	0	0	0	114.7	R331	R331-P353 PolarHBondContact NH1-O 2.96Å; R331-P353 VanDerWaalsContact NH1-O 3.11Å
354	G	83	Confident	90.8	Very high	22 Å²	22	32 Å²	32	23%	0.227	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-174.3	35.5	171.2	0	0	0	0	0	111.1	N352	N352-G354 PolarHBondContact O-N 2.86Å
355	F	89.6	Confident	91	Very high	17 Å²	17	30.1 Å²	30.1	8%	0.075	17%	0.173	C	C	.	.			trans	-84.2	91.5	145.6	178.4	-105.1	0	0	0	106.7	I277 L280 L310 L323 V338 L345 H348 I349 N352 L357	I277-F355 HydrophobicContact CD1-CD2 3.78Å; I277-F355 HydrophobicContact CD1-CE2 3.83Å; L280-F355 HydrophobicContact CD1-CZ 4.24Å; L310-F355 HydrophobicContact CD1-CE2 4.03Å; L323-F355 HydrophobicContact CD1-CD2 3.92Å; L323-F355 HydrophobicContact CD2-CD2 4.25Å; L323-F355 HydrophobicContact CD2-CE2 4.45Å; V338-F355 HydrophobicContact CG1-CE2 4.23Å; V338-F355 HydrophobicContact CG2-CE2 4.45Å; L345-F355 HydrophobicContact CD1-CE1 3.56Å; L345-F355 HydrophobicContact CD1-CZ 3.56Å; H348-F355 HydrophobicContact CB-CB 4.23Å; H348-F355 HydrophobicContact CB-CD1 4.05Å; H348-F355 HydrophobicContact CB-CD2 4.34Å; H348-F355 HydrophobicContact CB-CG 3.95Å; I349-F355 HydrophobicContact CD1-CE1 4.43Å; I349-F355 HydrophobicContact CG1-CD1 3.84Å; I349-F355 HydrophobicContact CG1-CE1 3.66Å; N352-F355 HydrophobicContact CB-CB 4.07Å; N352-F355 PolarHBondContact O-N 2.99Å; N352-F355 VanDerWaalsContact O-N 3.07Å; F355-L357 HydrophobicContact CD1-CG 4.4Å; F355-L357 HydrophobicContact CE1-CD1 3.83Å; F355-L357 HydrophobicContact CE1-CD2 3.91Å; F355-L357 HydrophobicContact CE1-CG 3.84Å; F355-L357 HydrophobicContact CE2-CD2 4.5Å; F355-L357 HydrophobicContact CZ-CD1 4.4Å; F355-L357 HydrophobicContact CZ-CD2 3.8Å; F355-L357 HydrophobicContact CZ-CG 4.26Å
356	C	88.1	Confident	90.9	Very high	45 Å²	45	30.7 Å²	30.7	30%	0.304	18%	0.176	S	C	.	.			trans	-92.1	143	-178.4	-171.5	0	0	0	0	111.1
357	L	90.8	Very high	90.7	Very high	3 Å²	3	29.9 Å²	29.9	2%	0.016	17%	0.17	C	C	.	.			trans	-126	9.5	176.7	-65.7	-178	0	0	0	113.7	I277 L280 I349 F355 H359 L360 V383 A386 V387	I277-L357 HydrophobicContact CG2-CD2 3.92Å; L280-L357 HydrophobicContact CD2-CD1 4.15Å; L280-L357 HydrophobicContact CD2-CD2 4.13Å; I349-L357 HydrophobicContact CD1-CD1 4.21Å; I349-L357 HydrophobicContact CG1-CD1 4.39Å; F355-L357 HydrophobicContact CD1-CG 4.4Å; F355-L357 HydrophobicContact CE1-CD1 3.83Å; F355-L357 HydrophobicContact CE1-CD2 3.91Å; F355-L357 HydrophobicContact CE1-CG 3.84Å; F355-L357 HydrophobicContact CE2-CD2 4.5Å; F355-L357 HydrophobicContact CZ-CD1 4.4Å; F355-L357 HydrophobicContact CZ-CD2 3.8Å; F355-L357 HydrophobicContact CZ-CG 4.26Å; L357-H359 VanDerWaalsContact C-N 3.26Å; L357-H359 PolarHBondContact O-N 2.92Å; L357-L360 HydrophobicContact CB-CB 4.38Å; L357-L360 HydrophobicContact CD2-CD1 4.46Å; L357-L360 HydrophobicContact CD2-CD2 4.37Å; L357-L360 WeakPolarHBondContact O-CB 3.44Å; L357-L360 PolarHBondContact O-N 2.85Å; L357-L360 VanDerWaalsContact O-N 3.07Å; L357-V383 HydrophobicContact CD1-CG1 4.39Å; L357-A386 HydrophobicContact CD1-CB 4.27Å; L357-V387 HydrophobicContact CB-CG2 3.71Å; L357-V387 HydrophobicContact CD1-CG2 4.13Å
358	E	86.2	Confident	90.5	Very high	44 Å²	44	27.9 Å²	27.9	21%	0.206	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-36.1	-179.6	-64.9	-177.3	173.8	0	0	112	L360 S390	E358-L360 VanDerWaalsContact C-N 3.32Å; E358-L360 PolarHBondContact O-N 3.06Å; E358-S390 WeakPolarHBondContact OE1-CA 3.44Å; E358-S390 WeakPolarHBondContact OE1-CB 3.38Å; E358-S390 PolarHBondContact OE1-OG 3Å
359	H	87.8	Confident	90.1	Very high	42 Å²	42	28.3 Å²	28.3	19%	0.194	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	5.5	177.4	-57.9	-52.6	0	0	0	114.6	E276 I277 R278 L357 R361 F400	E276-H359 HydrophobicContact CB-CB 4.41Å; I277-H359 CarbonylContact O-C 3.37Å; R278-H359 HydrophobicContact CG-CB 4.5Å; R278-H359 WeakPolarHBondContact CG-O 3.36Å; L357-H359 VanDerWaalsContact C-N 3.26Å; L357-H359 PolarHBondContact O-N 2.92Å; H359-R361 PolarHBondContact O-N 3.48Å; H359-F400 AromaticContact CE1-CG 3.93Å
360	L	92.1	Very high	89.5	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.163	C	C	.	.			trans	-65.9	105.5	-171.7	-176.8	68.1	0	0	0	112.6	I277 L280 L357 E358 F362 V387 R402 L420	I277-L360 WeakPolarHBondContact O-CA 3.46Å; I277-L360 PolarHBondContact O-N 3.27Å; L280-L360 HydrophobicContact CB-CD1 3.51Å; L280-L360 HydrophobicContact CB-CD2 4.18Å; L280-L360 HydrophobicContact CB-CG 4.49Å; L280-L360 HydrophobicContact CD2-CD2 4.16Å; L357-L360 HydrophobicContact CB-CB 4.38Å; L357-L360 HydrophobicContact CD2-CD1 4.46Å; L357-L360 HydrophobicContact CD2-CD2 4.37Å; L357-L360 WeakPolarHBondContact O-CB 3.44Å; L357-L360 PolarHBondContact O-N 2.85Å; L357-L360 VanDerWaalsContact O-N 3.07Å; E358-L360 VanDerWaalsContact C-N 3.32Å; E358-L360 PolarHBondContact O-N 3.06Å; L360-F362 WeakPolarHBondContact CD1-O 3.45Å; L360-V387 HydrophobicContact CB-CG2 4.37Å; L360-V387 HydrophobicContact CD2-CG2 3.75Å; L360-R402 VanDerWaalsContact O-CZ 3.24Å; L360-R402 PolarHBondContact O-NH1 2.96Å; L360-R402 PolarHBondContact O-NH2 3.1Å; L360-L420 HydrophobicContact CD2-CD1 3.92Å; L360-L420 HydrophobicContact CG-CD1 4.01Å; L360-L420 WeakPolarHBondContact O-CD1 3.17Å
361	R	91.1	Very high	89.2	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.136	C	C	.	.			trans	-85.2	-35.9	-179.1	-179.8	57.4	176.8	73.9	6.3	113.5	G230 F235 R278 H359 M418 P419 Q421	G230-R361 PolarHBondContact O-NH2 2.92Å; F235-R361 PolarHBondContact O-NE 3.5Å; R278-R361 HydrophobicContact CB-CB 4.36Å; R278-R361 WeakPolarHBondContact O-CA 3.36Å; R278-R361 PolarHBondContact O-N 2.88Å; H359-R361 PolarHBondContact O-N 3.48Å; R361-M418 HydrophobicContact CB-CG 4.47Å; R361-M418 HydrophobicContact CB-SD 3.94Å; R361-M418 HydrophobicContact CG-SD 4.22Å; R361-P419 WeakPolarHBondContact CD-O 3.25Å; R361-Q421 PolarHBondContact O-N 3.23Å
362	F	95.8	Very high	88.9	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	125.8	-176.3	-59.6	-73.2	0	0	0	112	I227 V265 V268 R278 A279 L280 L360 Q421 L423	I227-F362 HydrophobicContact CG2-CE1 4.13Å; V265-F362 HydrophobicContact CG1-CD2 4.03Å; V265-F362 HydrophobicContact CG2-CD1 4.29Å; V265-F362 HydrophobicContact CG2-CD2 4.12Å; V265-F362 HydrophobicContact CG2-CE2 4.37Å; V265-F362 HydrophobicContact CG2-CG 4.08Å; V268-F362 HydrophobicContact CB-CE2 4.17Å; V268-F362 HydrophobicContact CB-CZ 4.26Å; V268-F362 HydrophobicContact CG1-CE2 3.87Å; V268-F362 HydrophobicContact CG1-CZ 3.99Å; V268-F362 HydrophobicContact CG2-CZ 4.4Å; R278-F362 PolarHBondContact O-N 2.98Å; A279-F362 WeakPolarHBondContact CA-O 3.43Å; A279-F362 HydrophobicContact CB-CB 4.21Å; L280-F362 PolarHBondContact N-O 2.8Å; L360-F362 WeakPolarHBondContact CD1-O 3.45Å; F362-Q421 WeakPolarHBondContact CA-O 3.41Å; F362-Q421 HydrophobicContact CD1-CB 4.39Å; F362-L423 HydrophobicContact CD1-CD1 3.96Å
363	L	96.8	Very high	88.3	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	101.9	169.4	175.2	58.3	0	0	0	109.3	L280 V282 I365 L380 V383 L420 Q421 K422 L423	L280-L363 HydrophobicContact CB-CD1 4.32Å; L280-L363 HydrophobicContact CD2-CD1 4.16Å; L280-L363 HydrophobicContact CG-CD1 4.34Å; V282-L363 HydrophobicContact CG2-CD1 3.89Å; L363-I365 HydrophobicContact CG-CG1 4.38Å; L363-L380 HydrophobicContact CD2-CD1 3.8Å; L363-V383 HydrophobicContact CD2-CG1 4.18Å; L363-L420 HydrophobicContact CB-CD1 4.1Å; L363-Q421 PolarHBondContact N-O 3.28Å; L363-K422 HydrophobicContact CB-CG 4.42Å; L363-K422 HydrophobicContact CD2-CD 4.23Å; L363-K422 HydrophobicContact CD2-CG 4.36Å; L363-K422 CarbonylContact O-C 3.58Å; L363-K422 VanDerWaalsContact O-CA 3.31Å; L363-K422 WeakPolarHBondContact O-CA 3.37Å; L363-L423 PolarHBondContact O-N 3.03Å
364	I	97.5	Very high	87.7	Confident	1 Å²	1	19.6 Å²	19.6	1%	0.005	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	131.7	-179.5	-57.8	154.1	0	0	0	109	F261 V265 L280 A281 V282 F296 L423 F425	F261-I364 HydrophobicContact CB-CD1 4.43Å; F261-I364 HydrophobicContact CD1-CG2 4.12Å; F261-I364 HydrophobicContact CD2-CD1 3.78Å; F261-I364 HydrophobicContact CD2-CG1 4.46Å; F261-I364 HydrophobicContact CD2-CG2 3.95Å; F261-I364 HydrophobicContact CE1-CG2 4.17Å; F261-I364 HydrophobicContact CE2-CD1 4.4Å; F261-I364 HydrophobicContact CE2-CG2 4.04Å; F261-I364 HydrophobicContact CG-CD1 4.38Å; F261-I364 HydrophobicContact CG-CG2 3.99Å; F261-I364 HydrophobicContact CZ-CG2 4.13Å; V265-I364 HydrophobicContact CG2-CD1 4.25Å; L280-I364 PolarHBondContact O-N 3.08Å; A281-I364 HydrophobicContact CB-CB 4.2Å; A281-I364 HydrophobicContact CB-CD1 4.34Å; V282-I364 PolarHBondContact N-O 3.22Å; F296-I364 HydrophobicContact CZ-CD1 3.93Å; I364-L423 CarbonylContact C-O 3.47Å; I364-L423 WeakPolarHBondContact CA-O 3.14Å; I364-L423 HydrophobicContact CG1-CB 4.3Å; I364-L423 HydrophobicContact CG1-CD1 4.14Å; I364-F425 HydrophobicContact CG2-CD2 4.21Å; I364-F425 HydrophobicContact CG2-CE2 4.4Å
365	I	95.3	Very high	86.8	Confident	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	109.8	177.4	-51.5	177.8	0	0	0	107.8	L363 A368 M371 W379 L423 F425 L439	L363-I365 HydrophobicContact CG-CG1 4.38Å; I365-A368 HydrophobicContact CG2-CB 4.1Å; I365-M371 HydrophobicContact CG2-CB 3.58Å; I365-M371 HydrophobicContact CG2-CG 3.66Å; I365-W379 HydrophobicContact CD1-CH2 3.89Å; I365-W379 HydrophobicContact CD1-CZ2 4.37Å; I365-W379 HydrophobicContact CG1-CH2 4.22Å; I365-L423 PolarHBondContact N-O 3.37Å; I365-F425 PolarHBondContact O-N 3.36Å; I365-L439 HydrophobicContact CD1-CD2 4.05Å
366	D	92.8	Very high	85.3	Confident	11 Å²	11	25.6 Å²	25.6	6%	0.059	13%	0.134	C	C	.	.	S	Bend	trans	-108.7	153.4	179.8	-166.5	13.4	0	0	0	111.4	V282 L283 P284 A368	V282-D366 PolarHBondContact O-N 3.4Å; L283-D366 HydrophobicContact CD2-CB 4.01Å; L283-D366 HydrophobicContact CG-CB 4.33Å; P284-D366 VanDerWaalsContact CD-O 3.23Å; P284-D366 WeakPolarHBondContact CD-O 3.05Å; D366-A368 PolarHBondContact O-N 2.76Å
367	E	88.6	Confident	84.2	Confident	22 Å²	22	30 Å²	30	10%	0.103	15%	0.15	C	C	.	.	S	Bend	trans	46.2	47.3	-155.9	-74.5	-169.6	176.1	0	0	111.1	P284 L288 D369 R370 M371 F425 G564	P284-E367 HydrophobicContact CG-CB 3.7Å; L288-E367 HydrophobicContact CD2-CB 4.49Å; L288-E367 HydrophobicContact CD2-CG 4.03Å; E367-D369 PolarHBondContact O-N 2.95Å; E367-D369 VanDerWaalsContact O-N 3.1Å; E367-R370 WeakPolarHBondContact O-CB 3.41Å; E367-R370 PolarHBondContact O-N 2.91Å; E367-R370 WeakPolarHBondContact OE2-CD 3.24Å; E367-R370 IonicContact OE2-CZ 3.8Å; E367-R370 IonicContact OE2-NE 3.51Å; E367-R370 IonicContact OE2-NH1 2.66Å; E367-R370 PolarHBondContact OE2-NH1 3.33Å; E367-M371 PolarHBondContact O-N 3.32Å; E367-F425 PolarHBondContact N-O 3.03Å; E367-G564 WeakPolarHBondContact OE1-CA 3.39Å; E367-G564 PolarHBondContact OE1-N 3.27Å
368	A	87.6	Confident	83.8	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-56.7	-29.8	-168.4	0	0	0	0	0	115.1	I365 D366 R370 M371 I372 L424 F425 L429	I365-A368 HydrophobicContact CG2-CB 4.1Å; D366-A368 PolarHBondContact O-N 2.76Å; A368-R370 VanDerWaalsContact C-N 3.34Å; A368-R370 PolarHBondContact O-N 3.08Å; A368-M371 WeakPolarHBondContact O-CB 3.49Å; A368-M371 PolarHBondContact O-N 3.3Å; A368-I372 VanDerWaalsContact O-CG1 3.28Å; A368-I372 WeakPolarHBondContact O-CG1 3.43Å; A368-I372 PolarHBondContact O-N 3.11Å; A368-L424 HydrophobicContact CB-CB 4.3Å; A368-F425 WeakPolarHBondContact CB-O 3.48Å; A368-F425 PolarHBondContact N-O 3.24Å; A368-L429 HydrophobicContact CB-CD1 4.49Å
369	D	83.9	Confident	83.9	Confident	10 Å²	10	33 Å²	33	5%	0.053	17%	0.166	C	C	.	.	H	α-helix	trans	-62.4	-38.5	174.6	53.8	-45.3	0	0	0	112.5	E367 I372 D373 S426 T428 R583 H587	E367-D369 PolarHBondContact O-N 2.95Å; E367-D369 VanDerWaalsContact O-N 3.1Å; D369-I372 PolarHBondContact O-N 3.49Å; D369-D373 PolarHBondContact O-N 3.08Å; D369-D373 VanDerWaalsContact O-N 3.15Å; D369-S426 PolarHBondContact OD1-OG 3.44Å; D369-T428 WeakPolarHBondContact CB-O 3.48Å; D369-T428 PolarHBondContact OD2-OG1 3.44Å; D369-R583 IonicContact OD2-NH1 3.67Å; D369-H587 IonicContact OD2-CE1 3.4Å; D369-H587 PolarHBondContact OD2-CE1 3.27Å; D369-H587 IonicContact OD2-NE2 3.07Å
370	R	80.9	Confident	84	Confident	61 Å²	61	31.4 Å²	31.4	23%	0.23	16%	0.159	C	C	.	.	H	α-helix	trans	-74.5	-31	173.9	-58.6	-179	66	-149.1	-4.8	112.2	E367 A368 I372 D373 S374	E367-R370 WeakPolarHBondContact O-CB 3.41Å; E367-R370 PolarHBondContact O-N 2.91Å; E367-R370 WeakPolarHBondContact OE2-CD 3.24Å; E367-R370 IonicContact OE2-CZ 3.8Å; E367-R370 IonicContact OE2-NE 3.51Å; E367-R370 IonicContact OE2-NH1 2.66Å; E367-R370 PolarHBondContact OE2-NH1 3.33Å; A368-R370 VanDerWaalsContact C-N 3.34Å; A368-R370 PolarHBondContact O-N 3.08Å; R370-I372 VanDerWaalsContact C-N 3.31Å; R370-D373 PolarHBondContact O-N 3.29Å; R370-S374 PolarHBondContact O-N 3.21Å; R370-S374 VanDerWaalsContact O-N 3.17Å; R370-S374 PolarHBondContact O-OG 3.44Å
371	M	83.6	Confident	83.9	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-69.2	-29.9	175.4	-71.2	-59.3	-47.6	0	0	112.4	V282 P284 P342 I365 E367 A368 S374 M375 W379	V282-M371 HydrophobicContact CG1-CE 3.85Å; P284-M371 HydrophobicContact CB-SD 3.88Å; P284-M371 HydrophobicContact CG-SD 4.41Å; P342-M371 HydrophobicContact CB-CE 4.23Å; P342-M371 HydrophobicContact CG-CE 3.46Å; P342-M371 VanDerWaalsContact CG-CE 3.46Å; P342-M371 HydrophobicContact CG-SD 3.75Å; I365-M371 HydrophobicContact CG2-CB 3.58Å; I365-M371 HydrophobicContact CG2-CG 3.66Å; E367-M371 PolarHBondContact O-N 3.32Å; A368-M371 WeakPolarHBondContact O-CB 3.49Å; A368-M371 PolarHBondContact O-N 3.3Å; M371-S374 WeakPolarHBondContact CA-OG 3.24Å; M371-S374 PolarHBondContact O-OG 2.93Å; M371-M375 WeakPolarHBondContact O-CG 3.42Å; M371-M375 PolarHBondContact O-N 3.05Å; M371-W379 HydrophobicContact CE-CD2 4.02Å; M371-W379 HydrophobicContact CE-CH2 3.97Å; M371-W379 HydrophobicContact CE-CZ2 3.2Å
372	I	83.8	Confident	83.8	Confident	5 Å²	5	37.3 Å²	37.3	3%	0.026	19%	0.193	C	C	.	.	H	α-helix	trans	-69.9	-51.9	168.9	-68.1	161.3	0	0	0	110.6	A368 D369 R370 S374 M375 T430 K435 L439	A368-I372 VanDerWaalsContact O-CG1 3.28Å; A368-I372 WeakPolarHBondContact O-CG1 3.43Å; A368-I372 PolarHBondContact O-N 3.11Å; D369-I372 PolarHBondContact O-N 3.49Å; R370-I372 VanDerWaalsContact C-N 3.31Å; I372-S374 PolarHBondContact O-N 3.42Å; I372-M375 VanDerWaalsContact O-CB 3.26Å; I372-M375 WeakPolarHBondContact O-CB 3.31Å; I372-M375 WeakPolarHBondContact O-CG 3.36Å; I372-M375 PolarHBondContact O-N 2.8Å; I372-T430 HydrophobicContact CD1-CG2 4.02Å; I372-K435 HydrophobicContact CG2-CB 3.97Å; I372-K435 HydrophobicContact CG2-CD 4.04Å; I372-K435 HydrophobicContact CG2-CG 4.19Å; I372-L439 HydrophobicContact CD1-CD1 3.68Å; I372-L439 HydrophobicContact CG1-CD1 3.77Å; I372-L439 HydrophobicContact CG1-CD2 4.28Å; I372-L439 HydrophobicContact CG1-CG 4.23Å
373	D	76.7	Confident	83.6	Confident	97 Å²	97	37.3 Å²	37.3	52%	0.519	19%	0.193	S	C	.	.	H	α-helix	trans	-62.6	-15.9	-179.3	-73	-19.1	0	0	0	113.7	D369 R370 K435	D369-D373 PolarHBondContact O-N 3.08Å; D369-D373 VanDerWaalsContact O-N 3.15Å; R370-D373 PolarHBondContact O-N 3.29Å; D373-K435 IonicContact OD1-NZ 2.73Å; D373-K435 PolarHBondContact OD1-NZ 2.75Å
374	S	68.8	Low	83.3	Confident	30 Å²	30	39.4 Å²	39.4	21%	0.21	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101	5.9	173.4	51.2	0	0	0	0	114.7	R370 M371 I372 N376 Q377	R370-S374 PolarHBondContact O-N 3.21Å; R370-S374 VanDerWaalsContact O-N 3.17Å; R370-S374 PolarHBondContact O-OG 3.44Å; M371-S374 WeakPolarHBondContact CA-OG 3.24Å; M371-S374 PolarHBondContact O-OG 2.93Å; I372-S374 PolarHBondContact O-N 3.42Å; S374-N376 PolarHBondContact O-N 2.8Å; S374-N376 VanDerWaalsContact O-N 3.1Å; S374-Q377 WeakPolarHBondContact O-CB 3.5Å; S374-Q377 PolarHBondContact O-N 2.9Å
375	M	64.1	Low	82.9	Confident	16 Å²	16	45.5 Å²	45.5	8%	0.079	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-61.5	-18.2	177.7	-79.6	-172.8	154.7	0	0	114.7	M371 I372 Q377 L378 L380 Q438 L439	M371-M375 WeakPolarHBondContact O-CG 3.42Å; M371-M375 PolarHBondContact O-N 3.05Å; I372-M375 VanDerWaalsContact O-CB 3.26Å; I372-M375 WeakPolarHBondContact O-CB 3.31Å; I372-M375 WeakPolarHBondContact O-CG 3.36Å; I372-M375 PolarHBondContact O-N 2.8Å; M375-Q377 PolarHBondContact O-N 3.38Å; M375-L378 PolarHBondContact O-N 3.16Å; M375-L380 HydrophobicContact CE-CB 4.22Å; M375-L380 HydrophobicContact CE-CD2 3.36Å; M375-L380 HydrophobicContact CE-CG 4.41Å; M375-Q438 HydrophobicContact SD-CB 3.63Å; M375-L439 HydrophobicContact CE-CB 4.47Å; M375-L439 HydrophobicContact CE-CD2 3.31Å; M375-L439 HydrophobicContact CE-CG 3.69Å
376	N	59.8	Low	82.6	Confident	149 Å²	149	46.9 Å²	46.9	80%	0.797	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-55	-19.5	169.7	-62.7	-11.8	0	0	0	112.9	S374 L378	S374-N376 PolarHBondContact O-N 2.8Å; S374-N376 VanDerWaalsContact O-N 3.1Å; N376-L378 VanDerWaalsContact C-N 3.29Å
377	Q	64.4	Low	82.4	Confident	138 Å²	138	46.6 Å²	46.6	65%	0.645	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-82.5	1.9	173.7	-59.7	-176.1	-5	0	0	114	S374 M375 W379	S374-Q377 WeakPolarHBondContact O-CB 3.5Å; S374-Q377 PolarHBondContact O-N 2.9Å; M375-Q377 PolarHBondContact O-N 3.38Å; Q377-W379 PolarHBondContact O-N 3.04Å
378	L	81.3	Confident	82.1	Confident	108 Å²	108	46.9 Å²	46.9	57%	0.565	24%	0.241	S	C	*	.			trans	55.8	13.7	175.5	-62	174.6	0	0	0	116.1	M375 N376 L380 S381 Q382	M375-L378 PolarHBondContact O-N 3.16Å; N376-L378 VanDerWaalsContact C-N 3.29Å; L378-L380 VanDerWaalsContact C-N 3.27Å; L378-L380 PolarHBondContact O-N 3.25Å; L378-S381 PolarHBondContact O-N 3.3Å; L378-S381 PolarHBondContact O-OG 3.12Å; L378-Q382 PolarHBondContact O-N 3.37Å
379	W	89.3	Confident	81.3	Confident	1 Å²	1	49.5 Å²	49.5	0%	0.004	26%	0.259	C	S	.	.	H	α-helix	trans	-55.5	-40.6	-175.8	73.9	-92.4	0	0	0	112.4	V282 P342 L345 V346 I365 M371 Q377 Q382 V383	V282-W379 HydrophobicContact CB-CH2 4.35Å; V282-W379 HydrophobicContact CB-CZ3 4.24Å; V282-W379 HydrophobicContact CG1-CE3 4.19Å; V282-W379 HydrophobicContact CG1-CH2 4.12Å; V282-W379 HydrophobicContact CG1-CZ3 3.88Å; V282-W379 HydrophobicContact CG2-CZ3 4.01Å; P342-W379 HydrophobicContact CB-CB 4.12Å; P342-W379 HydrophobicContact CB-CD2 4.25Å; P342-W379 HydrophobicContact CB-CG 3.9Å; L345-W379 HydrophobicContact CD2-CE3 4.24Å; L345-W379 HydrophobicContact CD2-CZ3 4.43Å; V346-W379 HydrophobicContact CG2-CB 3.97Å; I365-W379 HydrophobicContact CD1-CH2 3.89Å; I365-W379 HydrophobicContact CD1-CZ2 4.37Å; I365-W379 HydrophobicContact CG1-CH2 4.22Å; M371-W379 HydrophobicContact CE-CD2 4.02Å; M371-W379 HydrophobicContact CE-CH2 3.97Å; M371-W379 HydrophobicContact CE-CZ2 3.2Å; Q377-W379 PolarHBondContact O-N 3.04Å; W379-Q382 PolarHBondContact O-N 3.07Å; W379-V383 HydrophobicContact CE3-CG2 3.98Å; W379-V383 HydrophobicContact CZ3-CG2 4.16Å; W379-V383 WeakPolarHBondContact O-CG2 3.29Å; W379-V383 PolarHBondContact O-N 3.07Å
380	L	89.9	Confident	80.2	Confident	9 Å²	9	50.3 Å²	50.3	5%	0.047	27%	0.266	C	S	.	.	H	α-helix	trans	-68.4	-35.8	-179.6	-178.5	61.8	0	0	0	111.7	L363 M375 L378 Q382 V383 L384 L439	L363-L380 HydrophobicContact CD2-CD1 3.8Å; M375-L380 HydrophobicContact CE-CB 4.22Å; M375-L380 HydrophobicContact CE-CD2 3.36Å; M375-L380 HydrophobicContact CE-CG 4.41Å; L378-L380 VanDerWaalsContact C-N 3.27Å; L378-L380 PolarHBondContact O-N 3.25Å; L380-Q382 VanDerWaalsContact C-N 3.31Å; L380-Q382 PolarHBondContact O-N 2.89Å; L380-V383 PolarHBondContact O-N 3.47Å; L380-L384 HydrophobicContact CD1-CD1 4.24Å; L380-L384 HydrophobicContact CD1-CD2 4.5Å; L380-L384 HydrophobicContact CD1-CG 4.06Å; L380-L384 HydrophobicContact CD2-CD1 4.38Å; L380-L384 HydrophobicContact CG-CD1 3.87Å; L380-L384 HydrophobicContact CG-CG 4.18Å; L380-L384 WeakPolarHBondContact O-CB 3.39Å; L380-L384 VanDerWaalsContact O-CG 3.25Å; L380-L384 WeakPolarHBondContact O-CG 3.49Å; L380-L384 PolarHBondContact O-N 3.16Å; L380-L439 HydrophobicContact CD2-CD2 4.35Å
381	S	89	Confident	78.8	Confident	59 Å²	59	52.8 Å²	52.8	41%	0.413	30%	0.299	S	S	.	.	H	α-helix	trans	-69.6	-31.8	178.2	72.6	0	0	0	0	111.6	L378 K385	L378-S381 PolarHBondContact O-N 3.3Å; L378-S381 PolarHBondContact O-OG 3.12Å; S381-K385 VanDerWaalsContact O-CB 3.25Å; S381-K385 WeakPolarHBondContact O-CB 3.21Å; S381-K385 PolarHBondContact O-N 3.12Å
382	Q	90.8	Very high	77.2	Confident	65 Å²	65	54.3 Å²	54.3	30%	0.304	31%	0.311	S	S	.	.	H	α-helix	trans	-68.4	-40.8	171	-59	-61.4	-12	0	0	112.2	V346 L378 W379 L380 K385 A386	V346-Q382 HydrophobicContact CG2-CB 4.49Å; L378-Q382 PolarHBondContact O-N 3.37Å; W379-Q382 PolarHBondContact O-N 3.07Å; L380-Q382 VanDerWaalsContact C-N 3.31Å; L380-Q382 PolarHBondContact O-N 2.89Å; Q382-K385 PolarHBondContact O-N 3.34Å; Q382-A386 WeakPolarHBondContact O-CB 3.48Å; Q382-A386 PolarHBondContact O-N 2.9Å
383	V	91.1	Very high	75.3	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-61.3	-50.5	173.2	173	0	0	0	0	110.7	L280 L345 I349 L357 L363 W379 L380 K385 A386 V387	L280-V383 HydrophobicContact CD2-CG1 4.36Å; L345-V383 HydrophobicContact CD1-CG2 4.46Å; L345-V383 HydrophobicContact CD2-CG2 3.42Å; L345-V383 VanDerWaalsContact CD2-CG2 3.42Å; L345-V383 HydrophobicContact CG-CG2 3.84Å; I349-V383 HydrophobicContact CD1-CB 4.49Å; I349-V383 HydrophobicContact CD1-CG2 3.8Å; L357-V383 HydrophobicContact CD1-CG1 4.39Å; L363-V383 HydrophobicContact CD2-CG1 4.18Å; W379-V383 HydrophobicContact CE3-CG2 3.98Å; W379-V383 HydrophobicContact CZ3-CG2 4.16Å; W379-V383 WeakPolarHBondContact O-CG2 3.29Å; W379-V383 PolarHBondContact O-N 3.07Å; L380-V383 PolarHBondContact O-N 3.47Å; V383-K385 VanDerWaalsContact C-N 3.3Å; V383-K385 PolarHBondContact O-N 3.46Å; V383-A386 PolarHBondContact O-N 3.13Å; V383-V387 HydrophobicContact CG1-CG2 4.25Å; V383-V387 WeakPolarHBondContact O-CB 3.46Å; V383-V387 WeakPolarHBondContact O-CG2 3.35Å; V383-V387 PolarHBondContact O-N 3.3Å
384	L	90.1	Very high	74.1	Confident	44 Å²	44	56.6 Å²	56.6	23%	0.23	34%	0.338	C	S	.	.	H	α-helix	trans	-62.3	-37.7	177.9	-64.6	170.8	0	0	0	111	L380 V387 Y388 L420	L380-L384 HydrophobicContact CD1-CD1 4.24Å; L380-L384 HydrophobicContact CD1-CD2 4.5Å; L380-L384 HydrophobicContact CD1-CG 4.06Å; L380-L384 HydrophobicContact CD2-CD1 4.38Å; L380-L384 HydrophobicContact CG-CD1 3.87Å; L380-L384 HydrophobicContact CG-CG 4.18Å; L380-L384 WeakPolarHBondContact O-CB 3.39Å; L380-L384 VanDerWaalsContact O-CG 3.25Å; L380-L384 WeakPolarHBondContact O-CG 3.49Å; L380-L384 PolarHBondContact O-N 3.16Å; L384-V387 PolarHBondContact O-N 2.92Å; L384-Y388 HydrophobicContact CB-CD2 4.33Å; L384-Y388 HydrophobicContact CD2-CD2 4.35Å; L384-Y388 HydrophobicContact CD2-CE2 3.84Å; L384-Y388 WeakPolarHBondContact O-CB 3.29Å; L384-Y388 VanDerWaalsContact O-CD2 3.26Å; L384-Y388 WeakPolarHBondContact O-CD2 3.44Å; L384-Y388 PolarHBondContact O-N 3.42Å; L384-L420 HydrophobicContact CD2-CD2 3.87Å
385	K	88.8	Confident	73	Confident	130 Å²	130	63.4 Å²	63.4	57%	0.565	37%	0.367	S	S	*	.	H	α-helix	trans	-60.3	-50.1	172.6	-174.1	-176.8	177.4	-173	0	111.5	S381 Q382 V383 V387 Y388 C389	S381-K385 VanDerWaalsContact O-CB 3.25Å; S381-K385 WeakPolarHBondContact O-CB 3.21Å; S381-K385 PolarHBondContact O-N 3.12Å; Q382-K385 PolarHBondContact O-N 3.34Å; V383-K385 VanDerWaalsContact C-N 3.3Å; V383-K385 PolarHBondContact O-N 3.46Å; K385-V387 PolarHBondContact O-N 3.49Å; K385-Y388 PolarHBondContact O-N 3Å; K385-C389 HydrophobicContact CG-CB 4.45Å; K385-C389 WeakPolarHBondContact O-CA 3.49Å; K385-C389 VanDerWaalsContact O-CB 3.26Å; K385-C389 WeakPolarHBondContact O-CB 3.4Å; K385-C389 PolarHBondContact O-N 3.38Å
386	A	88.7	Confident	72.1	Confident	29 Å²	29	67 Å²	67	24%	0.24	39%	0.386	C	S	.	.	H	α-helix	trans	-66.6	-19.2	178.7	0	0	0	0	0	114.1	I349 L357 Q382 V383	I349-A386 HydrophobicContact CD1-CB 4.37Å; I349-A386 HydrophobicContact CG1-CB 4.37Å; I349-A386 HydrophobicContact CG2-CB 3.88Å; L357-A386 HydrophobicContact CD1-CB 4.27Å; Q382-A386 WeakPolarHBondContact O-CB 3.48Å; Q382-A386 PolarHBondContact O-N 2.9Å; V383-A386 PolarHBondContact O-N 3.13Å
387	V	88.7	Confident	71.6	Confident	4 Å²	4	70.6 Å²	70.6	2%	0.024	39%	0.389	C	S	.	.	H	α-helix	trans	-91.2	-31.8	178.9	167.8	0	0	0	0	113.2	L357 L360 V383 L384 K385 L420	L357-V387 HydrophobicContact CB-CG2 3.71Å; L357-V387 HydrophobicContact CD1-CG2 4.13Å; L360-V387 HydrophobicContact CB-CG2 4.37Å; L360-V387 HydrophobicContact CD2-CG2 3.75Å; V383-V387 HydrophobicContact CG1-CG2 4.25Å; V383-V387 WeakPolarHBondContact O-CB 3.46Å; V383-V387 WeakPolarHBondContact O-CG2 3.35Å; V383-V387 PolarHBondContact O-N 3.3Å; L384-V387 PolarHBondContact O-N 2.92Å; K385-V387 PolarHBondContact O-N 3.49Å; V387-L420 HydrophobicContact CG1-CD2 4.26Å
388	Y	83.6	Confident	71.1	Confident	29 Å²	29	66.6 Å²	66.6	11%	0.114	37%	0.374	C	S	.	.	H	α-helix	trans	-112.5	-5.8	-175.3	-69.2	-76.9	0	0	0	114.3	L384 K385 R402 T403 K404 P405 L420	L384-Y388 HydrophobicContact CB-CD2 4.33Å; L384-Y388 HydrophobicContact CD2-CD2 4.35Å; L384-Y388 HydrophobicContact CD2-CE2 3.84Å; L384-Y388 WeakPolarHBondContact O-CB 3.29Å; L384-Y388 VanDerWaalsContact O-CD2 3.26Å; L384-Y388 WeakPolarHBondContact O-CD2 3.44Å; L384-Y388 PolarHBondContact O-N 3.42Å; K385-Y388 PolarHBondContact O-N 3Å; Y388-R402 HydrophobicContact CD1-CB 4.33Å; Y388-R402 HydrophobicContact CD1-CG 3.6Å; Y388-R402 HydrophobicContact CE1-CG 3.48Å; Y388-R402 VanDerWaalsContact CE1-CG 3.48Å; Y388-T403 VanDerWaalsContact CD1-O 3.24Å; Y388-T403 WeakPolarHBondContact CD1-O 3.45Å; Y388-T403 WeakPolarHBondContact CE1-O 3.33Å; Y388-K404 HydrophobicContact CD1-CG 4.27Å; Y388-K404 HydrophobicContact CG-CG 4.14Å; Y388-P405 HydrophobicContact CE1-CG 4.14Å; Y388-L420 HydrophobicContact CE2-CD2 4.05Å
389	C	70.4	Confident	69.9	Low	54 Å²	54	68.2 Å²	68.2	37%	0.365	38%	0.383	S	S	.	.			trans	-124.9	99.6	173.8	-60.3	0	0	0	0	109.5	K385	K385-C389 HydrophobicContact CG-CB 4.45Å; K385-C389 WeakPolarHBondContact O-CA 3.49Å; K385-C389 VanDerWaalsContact O-CB 3.26Å; K385-C389 WeakPolarHBondContact O-CB 3.4Å; K385-C389 PolarHBondContact O-N 3.38Å
390	S	60.4	Low	68.4	Low	28 Å²	28	73 Å²	73	20%	0.196	40%	0.403	C	S	.	.			trans	-59.6	155	164.8	-171.2	0	0	0	0	110.8	E358 A392	E358-S390 WeakPolarHBondContact OE1-CA 3.44Å; E358-S390 WeakPolarHBondContact OE1-CB 3.38Å; E358-S390 PolarHBondContact OE1-OG 3Å; S390-A392 VanDerWaalsContact C-N 3.25Å; S390-A392 PolarHBondContact OG-N 3.06Å
391	A	51.1	Low	67.3	Low	113 Å²	113	76.4 Å²	76.4	93%	0.934	42%	0.416	S	S	*	.	S	Bend	trans	-76.3	-13.2	173	0	0	0	0	0	113.1
392	A	49.3	Very low	66.7	Low	32 Å²	32	74.2 Å²	74.2	26%	0.264	40%	0.398	S	S	.	.	S	Bend	trans	-77.4	155.5	177.3	0	0	0	0	0	112.8	S390 D396	S390-A392 VanDerWaalsContact C-N 3.25Å; S390-A392 PolarHBondContact OG-N 3.06Å; A392-D396 HydrophobicContact CB-CB 3.65Å
393	G	45.4	Very low	65.7	Low	36 Å²	36	75 Å²	75	37%	0.371	41%	0.408	S	S	.	.			trans	-64.4	176.3	-175.1	0	0	0	0	0	114.6	E395 D396 R401	G393-E395 PolarHBondContact O-N 3.25Å; G393-D396 PolarHBondContact O-N 3.23Å; G393-R401 PolarHBondContact O-NH1 3.27Å
394	P	50.5	Low	64.9	Low	114 Å²	114	81.4 Å²	81.4	74%	0.74	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-27	174.1	27.8	-34.3	0	0	0	112.9	D396	P394-D396 VanDerWaalsContact C-N 3.32Å
395	E	45.7	Very low	63.9	Low	174 Å²	174	83 Å²	83	81%	0.813	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-34.4	175.7	-57	-70.8	99.8	0	0	112.6	G393 R397	G393-E395 PolarHBondContact O-N 3.25Å; E395-R397 PolarHBondContact O-N 2.64Å
396	D	46.3	Very low	62.9	Low	90 Å²	90	80.8 Å²	80.8	48%	0.481	46%	0.455	S	S	.	.			trans	-82.7	89.7	-167.3	-136.8	-23.4	0	0	0	111.1	A392 G393 P394 T398 R401	A392-D396 HydrophobicContact CB-CB 3.65Å; G393-D396 PolarHBondContact O-N 3.23Å; P394-D396 VanDerWaalsContact C-N 3.32Å; D396-T398 VanDerWaalsContact C-N 3.29Å; D396-T398 PolarHBondContact O-N 2.83Å; D396-T398 VanDerWaalsContact O-N 3.11Å; D396-R401 PolarHBondContact O-NH1 3.45Å
397	R	47.8	Very low	62	Low	225 Å²	225	84.8 Å²	84.8	85%	0.849	48%	0.479	S	S	*	.			trans	-84.8	63.1	-179	-67.9	-174.3	176.4	-168.5	0.4	111.7	E395 L399	E395-R397 PolarHBondContact O-N 2.64Å; R397-L399 PolarHBondContact O-N 3.18Å
398	T	55.5	Low	61.2	Low	54 Å²	54	89 Å²	89	33%	0.331	50%	0.501	S	S	.	.			trans	-60.2	132.9	172.4	62.4	0	0	0	0	110.4	D396 F400 R401	D396-T398 VanDerWaalsContact C-N 3.29Å; D396-T398 PolarHBondContact O-N 2.83Å; D396-T398 VanDerWaalsContact O-N 3.11Å; T398-F400 PolarHBondContact O-N 2.83Å; T398-R401 VanDerWaalsContact O-CB 3.3Å; T398-R401 WeakPolarHBondContact O-CB 3.48Å; T398-R401 PolarHBondContact O-N 2.92Å
399	L	55.3	Low	60.8	Low	143 Å²	143	91.2 Å²	91.2	75%	0.749	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-15.5	-174	-68.6	172	0	0	0	114.3	R397	R397-L399 PolarHBondContact O-N 3.18Å
400	F	58.2	Low	60.9	Low	100 Å²	100	92.6 Å²	92.6	44%	0.439	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.9	5	-178.6	-53.1	-67.2	0	0	0	113.6	H359 T398 R402	H359-F400 AromaticContact CE1-CG 3.93Å; T398-F400 PolarHBondContact O-N 2.83Å; F400-R402 PolarHBondContact O-N 3.44Å; F400-R402 VanDerWaalsContact O-N 3.16Å
401	R	65.8	Low	61.4	Low	82 Å²	82	95 Å²	95	31%	0.309	56%	0.555	S	S	.	*			trans	-63.7	113.4	-178.9	-170.3	175.5	-172.3	146.6	4.9	111.3	G393 D396 T398	G393-R401 PolarHBondContact O-NH1 3.27Å; D396-R401 PolarHBondContact O-NH1 3.45Å; T398-R401 VanDerWaalsContact O-CB 3.3Å; T398-R401 WeakPolarHBondContact O-CB 3.48Å; T398-R401 PolarHBondContact O-N 2.92Å
402	R	77.6	Confident	62.2	Low	12 Å²	12	91.8 Å²	91.8	5%	0.045	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-79.2	119.3	180	-173	179.4	-75.3	162.7	-5	111.9	L360 Y388 F400 M418 P419	L360-R402 VanDerWaalsContact O-CZ 3.24Å; L360-R402 PolarHBondContact O-NH1 2.96Å; L360-R402 PolarHBondContact O-NH2 3.1Å; Y388-R402 HydrophobicContact CD1-CB 4.33Å; Y388-R402 HydrophobicContact CD1-CG 3.6Å; Y388-R402 HydrophobicContact CE1-CG 3.48Å; Y388-R402 VanDerWaalsContact CE1-CG 3.48Å; F400-R402 PolarHBondContact O-N 3.44Å; F400-R402 VanDerWaalsContact O-N 3.16Å; R402-M418 PolarHBondContact NE-O 2.64Å; R402-M418 VanDerWaalsContact NH2-CG 3.28Å; R402-M418 PolarHBondContact NH2-O 2.9Å; R402-P419 VanDerWaalsContact NH2-C 3.27Å; R402-P419 PolarHBondContact NH2-O 2.82Å; R402-P419 VanDerWaalsContact NH2-O 3.08Å
403	T	70.3	Confident	63.1	Low	83 Å²	83	94 Å²	94	51%	0.509	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-72.4	147.4	169.5	53.9	0	0	0	0	111.4	Y388 Q417	Y388-T403 VanDerWaalsContact CD1-O 3.24Å; Y388-T403 WeakPolarHBondContact CD1-O 3.45Å; Y388-T403 WeakPolarHBondContact CE1-O 3.33Å; T403-Q417 PolarHBondContact OG1-NE2 2.91Å; T403-Q417 PolarHBondContact OG1-OE1 3.2Å
404	K	73.4	Confident	64.2	Low	134 Å²	134	96.1 Å²	96.1	58%	0.583	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-62.2	148.9	175.1	-71.9	176.8	-178.1	173.4	0	110.8	Y388 A406	Y388-K404 HydrophobicContact CD1-CG 4.27Å; Y388-K404 HydrophobicContact CG-CG 4.14Å; K404-A406 PolarHBondContact O-N 2.74Å
405	P	68.4	Low	65	Low	78 Å²	78	95 Å²	95	51%	0.506	53%	0.534	S	S	.	.	P	Polyproline II helix	trans	-60.2	126.3	177.3	-20.8	34.1	0	0	0	110.6	Y388	Y388-P405 HydrophobicContact CE1-CG 4.14Å
406	A	68.3	Low	66	Low	83 Å²	83	88.5 Å²	88.5	69%	0.686	51%	0.514	S	S	*	.			trans	-135.1	-176.4	178.2	0	0	0	0	0	109.4	K404	K404-A406 PolarHBondContact O-N 2.74Å
407	C	70.4	Confident	67.3	Low	112 Å²	112	86.1 Å²	86.1	76%	0.757	50%	0.5	S	S	*	.			trans	-58.3	137.2	169.6	-59.6	0	0	0	0	110.3	T409	C407-T409 PolarHBondContact O-N 3.4Å
408	I	71.5	Confident	68.8	Low	92 Å²	92	75.9 Å²	75.9	47%	0.472	46%	0.462	S	S	.	.			trans	-72.1	114.4	179.5	-57.8	174.7	0	0	0	108.6	L413	I408-L413 HydrophobicContact CG2-CD1 4.49Å; I408-L413 HydrophobicContact CG2-CD2 4.25Å; I408-L413 HydrophobicContact CG2-CG 4.43Å
409	T	75	Confident	70.3	Confident	77 Å²	77	73.8 Å²	73.8	47%	0.472	45%	0.449	S	S	.	.			trans	-121.5	163.3	172	65.7	0	0	0	0	109.6	C407 A411 S412	C407-T409 PolarHBondContact O-N 3.4Å; T409-A411 PolarHBondContact O-N 3.22Å; T409-S412 PolarHBondContact N-OG 3.07Å; T409-S412 WeakPolarHBondContact O-CB 3.38Å; T409-S412 PolarHBondContact O-N 3.02Å; T409-S412 PolarHBondContact O-OG 3.48Å; T409-S412 PolarHBondContact OG1-N 2.73Å
410	A	73.6	Confident	71.9	Confident	83 Å²	83	67 Å²	67	69%	0.686	41%	0.414	S	S	*	.	G	3₁₀ helix	trans	-54.2	-42.5	174.8	0	0	0	0	0	112.1	S412 L413 S414	A410-S412 PolarHBondContact O-N 3.29Å; A410-L413 PolarHBondContact O-N 3.48Å; A410-L413 VanDerWaalsContact O-N 3.15Å; A410-S414 PolarHBondContact O-OG 3.46Å
411	A	69.9	Low	73.6	Confident	79 Å²	79	62.4 Å²	62.4	65%	0.653	39%	0.394	S	S	*	.	G	3₁₀ helix	trans	-69	-13.9	175.9	0	0	0	0	0	114.6	T409 S414	T409-A411 PolarHBondContact O-N 3.22Å; A411-S414 VanDerWaalsContact O-O 3.13Å
412	S	67.7	Low	74.9	Confident	45 Å²	45	58.6 Å²	58.6	32%	0.315	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-83.6	-13.8	172.6	75.4	0	0	0	0	113.4	T409 A410	T409-S412 PolarHBondContact N-OG 3.07Å; T409-S412 WeakPolarHBondContact O-CB 3.38Å; T409-S412 PolarHBondContact O-N 3.02Å; T409-S412 PolarHBondContact O-OG 3.48Å; T409-S412 PolarHBondContact OG1-N 2.73Å; A410-S412 PolarHBondContact O-N 3.29Å
413	L	68.6	Low	75.8	Confident	79 Å²	79	58 Å²	58	41%	0.414	38%	0.377	S	S	.	.	S	Bend	trans	-95.4	-10.9	179.6	-59.7	173.4	0	0	0	112.5	I408 A410	I408-L413 HydrophobicContact CG2-CD1 4.49Å; I408-L413 HydrophobicContact CG2-CD2 4.25Å; I408-L413 HydrophobicContact CG2-CG 4.43Å; A410-L413 PolarHBondContact O-N 3.48Å; A410-L413 VanDerWaalsContact O-N 3.15Å
414	S	68.6	Low	77	Confident	80 Å²	80	54.1 Å²	54.1	56%	0.559	35%	0.353	S	S	*	.	S	Bend	trans	-132.8	125.7	-178.2	55.8	0	0	0	0	111.6	A410 A411	A410-S414 PolarHBondContact O-OG 3.46Å; A411-S414 VanDerWaalsContact O-O 3.13Å
415	P	67.3	Low	78	Confident	90 Å²	90	47.7 Å²	47.7	58%	0.584	33%	0.325	S	S	*	.	S	Bend	cis	-69.4	158	-3	31.8	-36.9	0	0	0	112.9	Q417	P415-Q417 PolarHBondContact O-N 3.15Å
416	G	66.7	Low	79.1	Confident	38 Å²	38	44 Å²	44	39%	0.392	30%	0.301	S	S	.	.			trans	-66.2	123	175.3	0	0	0	0	0	111.6
417	Q	73.9	Confident	79.9	Confident	39 Å²	39	40.6 Å²	40.6	18%	0.182	27%	0.273	C	S	.	.			trans	-110.9	143.7	-177.6	-62.3	167.7	30.2	0	0	110.4	T403 P415 P419	T403-Q417 PolarHBondContact OG1-NE2 2.91Å; T403-Q417 PolarHBondContact OG1-OE1 3.2Å; P415-Q417 PolarHBondContact O-N 3.15Å; Q417-P419 VanDerWaalsContact O-CD 3.28Å; Q417-P419 WeakPolarHBondContact O-CD 3.44Å; Q417-P419 VanDerWaalsContact O-N 3.08Å
418	M	79.8	Confident	80.6	Confident	10 Å²	10	35.3 Å²	35.3	5%	0.049	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-51.2	118.3	167.3	-175.9	76.3	72.9	0	0	109	F235 L236 R361 R402	F235-M418 HydrophobicContact CB-CE 3.95Å; F235-M418 HydrophobicContact CB-SD 3.86Å; L236-M418 HydrophobicContact CD2-CB 4.11Å; L236-M418 HydrophobicContact CD2-CE 4.28Å; R361-M418 HydrophobicContact CB-CG 4.47Å; R361-M418 HydrophobicContact CB-SD 3.94Å; R361-M418 HydrophobicContact CG-SD 4.22Å; R402-M418 PolarHBondContact NE-O 2.64Å; R402-M418 VanDerWaalsContact NH2-CG 3.28Å; R402-M418 PolarHBondContact NH2-O 2.9Å
419	P	85.2	Confident	81.2	Confident	11 Å²	11	31.1 Å²	31.1	7%	0.071	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-79.1	151.1	-179.8	30.1	-31.9	0	0	0	111.2	F235 R243 P244 R361 R402 Q417	F235-P419 VanDerWaalsContact O-CD 3.25Å; F235-P419 WeakPolarHBondContact O-CD 3.39Å; R243-P419 HydrophobicContact CG-CB 3.92Å; P244-P419 HydrophobicContact CG-CB 4.42Å; P244-P419 HydrophobicContact CG-CG 4.1Å; R361-P419 WeakPolarHBondContact CD-O 3.25Å; R402-P419 VanDerWaalsContact NH2-C 3.27Å; R402-P419 PolarHBondContact NH2-O 2.82Å; R402-P419 VanDerWaalsContact NH2-O 3.08Å; Q417-P419 VanDerWaalsContact O-CD 3.28Å; Q417-P419 WeakPolarHBondContact O-CD 3.44Å; Q417-P419 VanDerWaalsContact O-N 3.08Å
420	L	89.8	Confident	81.6	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-91.2	122.8	163.6	-174.4	67.8	0	0	0	108.9	R243 L360 L363 L384 V387 Y388	R243-L420 VanDerWaalsContact CZ-O 3.27Å; R243-L420 PolarHBondContact NE-O 3.2Å; R243-L420 PolarHBondContact NH2-O 3.45Å; L360-L420 HydrophobicContact CD2-CD1 3.92Å; L360-L420 HydrophobicContact CG-CD1 4.01Å; L360-L420 WeakPolarHBondContact O-CD1 3.17Å; L363-L420 HydrophobicContact CB-CD1 4.1Å; L384-L420 HydrophobicContact CD2-CD2 3.87Å; V387-L420 HydrophobicContact CG1-CD2 4.26Å; Y388-L420 HydrophobicContact CE2-CD2 4.05Å
421	Q	92.9	Very high	81.9	Confident	3 Å²	3	27.1 Å²	27.1	1%	0.014	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	124	169.5	-166.5	176.8	7.7	0	0	109.2	R245 R361 F362 L363 L423	R245-Q421 VanDerWaalsContact O-CG 3.27Å; R245-Q421 WeakPolarHBondContact O-CG 3.38Å; R245-Q421 PolarHBondContact O-NE2 2.91Å; R361-Q421 PolarHBondContact O-N 3.23Å; F362-Q421 WeakPolarHBondContact CA-O 3.41Å; F362-Q421 HydrophobicContact CD1-CB 4.39Å; L363-Q421 PolarHBondContact N-O 3.28Å; Q421-L423 HydrophobicContact CG-CD2 4.12Å
422	K	94.9	Very high	82.5	Confident	2 Å²	2	25.8 Å²	25.8	1%	0.009	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	136.4	174	-49.6	-165.7	-142.1	80.4	0	109.8	D246 L247 L363 L424 L439 G440 L441	D246-K422 CarbonylContact C-O 3.57Å; D246-K422 VanDerWaalsContact CA-O 3.31Å; D246-K422 WeakPolarHBondContact CA-O 3.33Å; D246-K422 HydrophobicContact CB-CB 4.23Å; D246-K422 PolarHBondContact OD1-N 3.3Å; D246-K422 IonicContact OD2-NZ 2.7Å; D246-K422 PolarHBondContact OD2-NZ 2.9Å; L247-K422 PolarHBondContact N-O 3.34Å; L363-K422 HydrophobicContact CB-CG 4.42Å; L363-K422 HydrophobicContact CD2-CD 4.23Å; L363-K422 HydrophobicContact CD2-CG 4.36Å; L363-K422 CarbonylContact O-C 3.58Å; L363-K422 VanDerWaalsContact O-CA 3.31Å; L363-K422 WeakPolarHBondContact O-CA 3.37Å; K422-L424 HydrophobicContact CB-CD1 3.71Å; K422-L439 WeakPolarHBondContact CE-O 3.25Å; K422-L439 PolarHBondContact NZ-O 2.84Å; K422-G440 VanDerWaalsContact NZ-C 3.3Å; K422-G440 PolarHBondContact NZ-O 3.44Å; K422-L441 HydrophobicContact CD-CD2 4.39Å
423	L	96.4	Very high	83.2	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	106.4	179.9	-54.2	175.1	0	0	0	108.4	I227 L247 V265 F362 L363 I364 I365 Q421 F425	I227-L423 HydrophobicContact CD1-CD1 3.98Å; I227-L423 HydrophobicContact CD1-CD2 4.34Å; I227-L423 HydrophobicContact CG1-CD1 4.42Å; I227-L423 HydrophobicContact CG1-CD2 4.19Å; L247-L423 HydrophobicContact CB-CD2 3.82Å; L247-L423 HydrophobicContact CD1-CD2 3.95Å; L247-L423 HydrophobicContact CG-CD2 3.82Å; V265-L423 HydrophobicContact CG2-CD1 4.26Å; F362-L423 HydrophobicContact CD1-CD1 3.96Å; L363-L423 PolarHBondContact O-N 3.03Å; I364-L423 CarbonylContact C-O 3.47Å; I364-L423 WeakPolarHBondContact CA-O 3.14Å; I364-L423 HydrophobicContact CG1-CB 4.3Å; I364-L423 HydrophobicContact CG1-CD1 4.14Å; I365-L423 PolarHBondContact N-O 3.37Å; Q421-L423 HydrophobicContact CG-CD2 4.12Å; L423-F425 HydrophobicContact CB-CE2 3.78Å
424	L	95.1	Very high	83.9	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	120	-171.3	-71.1	72.8	0	0	0	110.1	L247 C248 V249 A368 K422 L439 L441	L247-L424 PolarHBondContact O-N 3.29Å; C248-L424 CarbonylContact C-O 3.58Å; V249-L424 PolarHBondContact N-O 2.92Å; A368-L424 HydrophobicContact CB-CB 4.3Å; K422-L424 HydrophobicContact CB-CD1 3.71Å; L424-L439 HydrophobicContact CD2-CB 4.48Å; L424-L439 HydrophobicContact CD2-CD1 3.49Å; L424-L439 VanDerWaalsContact CD2-CD1 3.49Å; L424-L439 HydrophobicContact CD2-CD2 3.88Å; L424-L439 HydrophobicContact CD2-CG 4.15Å; L424-L441 HydrophobicContact CD1-CD2 3.75Å; L424-L441 HydrophobicContact CD2-CD1 4.42Å; L424-L441 HydrophobicContact CD2-CD2 4.04Å
425	F	93.9	Very high	84.7	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	129.7	179.2	-65.9	-92	0	0	0	110.7	V223 V249 K257 A260 F261 I364 I365 E367 A368 L423	V223-F425 HydrophobicContact CG1-CE1 4.25Å; V223-F425 HydrophobicContact CG1-CZ 4.18Å; V249-F425 HydrophobicContact CB-CD1 3.62Å; V249-F425 HydrophobicContact CB-CE1 3.78Å; V249-F425 HydrophobicContact CB-CG 4.4Å; V249-F425 HydrophobicContact CG1-CD1 3.9Å; V249-F425 HydrophobicContact CG1-CE1 4.03Å; V249-F425 HydrophobicContact CG2-CD1 3.96Å; V249-F425 HydrophobicContact CG2-CE1 3.58Å; V249-F425 HydrophobicContact CG2-CZ 4.12Å; K257-F425 HydrophobicContact CB-CD1 4.01Å; K257-F425 HydrophobicContact CD-CB 4.32Å; K257-F425 HydrophobicContact CD-CD1 4.1Å; K257-F425 HydrophobicContact CG-CD1 4.24Å; A260-F425 HydrophobicContact CB-CE1 4.29Å; F261-F425 HydrophobicContact CB-CE2 3.62Å; F261-F425 HydrophobicContact CB-CZ 3.7Å; F261-F425 HydrophobicContact CD1-CD1 4.18Å; F261-F425 AromaticContact CD1-CD2 3.53Å; F261-F425 HydrophobicContact CD1-CD2 3.53Å; F261-F425 HydrophobicContact CD1-CE1 4.1Å; F261-F425 AromaticContact CD1-CE2 3.43Å; F261-F425 HydrophobicContact CD1-CE2 3.43Å; F261-F425 VanDerWaalsContact CD1-CE2 3.43Å; F261-F425 AromaticContact CD1-CG 3.93Å; F261-F425 HydrophobicContact CD1-CG 3.93Å; F261-F425 AromaticContact CD1-CZ 3.75Å; F261-F425 HydrophobicContact CD1-CZ 3.75Å; F261-F425 HydrophobicContact CE1-CD2 4.04Å; F261-F425 HydrophobicContact CE1-CE2 4.37Å; F261-F425 HydrophobicContact CE1-CG 4.24Å; F261-F425 HydrophobicContact CG-CD2 4.36Å; F261-F425 AromaticContact CG-CE2 3.89Å; F261-F425 HydrophobicContact CG-CE2 3.89Å; F261-F425 HydrophobicContact CG-CZ 4.21Å; I364-F425 HydrophobicContact CG2-CD2 4.21Å; I364-F425 HydrophobicContact CG2-CE2 4.4Å; I365-F425 PolarHBondContact O-N 3.36Å; E367-F425 PolarHBondContact N-O 3.03Å; A368-F425 WeakPolarHBondContact CB-O 3.48Å; A368-F425 PolarHBondContact N-O 3.24Å; L423-F425 HydrophobicContact CB-CE2 3.78Å
426	S	90.7	Very high	85.5	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	163.2	170.3	179.5	0	0	0	0	110.8	V249 A251 K257 D369 T428	V249-S426 PolarHBondContact O-N 3.28Å; A251-S426 PolarHBondContact N-O 2.97Å; K257-S426 WeakPolarHBondContact CD-O 3.41Å; K257-S426 WeakPolarHBondContact CE-O 3.34Å; K257-S426 PolarHBondContact NZ-O 3.28Å; D369-S426 PolarHBondContact OD1-OG 3.44Å; S426-T428 VanDerWaalsContact OG-C 3.28Å; S426-T428 PolarHBondContact OG-N 3.01Å; S426-T428 PolarHBondContact OG-O 2.79Å
427	A	85.3	Confident	86.4	Confident	11 Å²	11	29.4 Å²	29.4	9%	0.091	15%	0.146	C	C	.	.	S	Bend	trans	-83.6	-19.8	164.3	0	0	0	0	0	112.9	A251 T253	A251-A427 WeakPolarHBondContact O-CA 3.29Å; T253-A427 HydrophobicContact CG2-CB 3.64Å
428	T	84.9	Confident	86.9	Confident	1 Å²	1	32.9 Å²	32.9	1%	0.006	16%	0.162	C	C	.	.	S	Bend	trans	-152.6	68.2	-167.7	47.3	0	0	0	0	107.9	D369 S426 F469 R583 I586 H587	D369-T428 WeakPolarHBondContact CB-O 3.48Å; D369-T428 PolarHBondContact OD2-OG1 3.44Å; S426-T428 VanDerWaalsContact OG-C 3.28Å; S426-T428 PolarHBondContact OG-N 3.01Å; S426-T428 PolarHBondContact OG-O 2.79Å; T428-F469 HydrophobicContact CG2-CD1 3.66Å; T428-F469 HydrophobicContact CG2-CE1 4.07Å; T428-R583 PolarHBondContact O-NH1 2.67Å; T428-I586 HydrophobicContact CG2-CB 4.34Å; T428-I586 HydrophobicContact CG2-CD1 4.01Å; T428-I586 HydrophobicContact CG2-CG2 3.9Å; T428-H587 PolarHBondContact OG1-NE2 2.92Å
429	L	85.4	Confident	87.3	Confident	5 Å²	5	32.4 Å²	32.4	3%	0.026	16%	0.16	C	C	.	.			trans	-61.7	153.9	178.8	-165.7	61.3	0	0	0	110.1	C248 S250 A368 L436 L446 R583	C248-L429 HydrophobicContact CB-CD2 3.9Å; S250-L429 PolarHBondContact OG-N 3.16Å; A368-L429 HydrophobicContact CB-CD1 4.49Å; L429-L436 HydrophobicContact CD1-CD2 4.35Å; L429-L436 HydrophobicContact CD2-CD2 4.47Å; L429-L436 HydrophobicContact CG-CD2 4.33Å; L429-L446 HydrophobicContact CD2-CD1 3.9Å; L429-R583 PolarHBondContact O-NH2 3.38Å; L429-R583 VanDerWaalsContact O-NH2 3.11Å
430	T	83.1	Confident	87.4	Confident	13 Å²	13	34.2 Å²	34.2	8%	0.08	18%	0.181	C	C	.	.			trans	-84.9	137.3	176.6	-175	0	0	0	0	110.6	I372 N432 K435 L436	I372-T430 HydrophobicContact CD1-CG2 4.02Å; T430-N432 VanDerWaalsContact C-N 3.32Å; T430-N432 PolarHBondContact OG1-N 2.94Å; T430-K435 HydrophobicContact CG2-CB 3.78Å; T430-K435 HydrophobicContact CG2-CD 4.14Å; T430-L436 HydrophobicContact CG2-CD2 4.23Å; T430-L436 HydrophobicContact CG2-CG 4.29Å; T430-L436 WeakPolarHBondContact O-CD1 3.19Å
431	Q	78.9	Confident	87.4	Confident	63 Å²	63	35.8 Å²	35.8	29%	0.294	19%	0.189	S	C	.	.			trans	-91.5	7.3	176.2	-62.8	-66.6	-10.9	0	0	112.3	P433 E467	Q431-P433 WeakPolarHBondContact O-CD 3.42Å; Q431-E467 PolarHBondContact N-OE1 3.49Å; Q431-E467 VanDerWaalsContact N-OE1 3.15Å
432	N	83	Confident	87.2	Confident	51 Å²	51	37.3 Å²	37.3	27%	0.273	20%	0.196	S	C	.	.			trans	-81.6	115.2	172.9	-177	-7.2	0	0	0	110.4	T430 E434 K435 L436	T430-N432 VanDerWaalsContact C-N 3.32Å; T430-N432 PolarHBondContact OG1-N 2.94Å; N432-E434 VanDerWaalsContact C-N 3.27Å; N432-E434 PolarHBondContact ND2-OE2 3.33Å; N432-E434 PolarHBondContact O-N 3.43Å; N432-E434 VanDerWaalsContact OD1-CB 3.31Å; N432-E434 WeakPolarHBondContact OD1-CB 3.43Å; N432-E434 WeakPolarHBondContact OD1-CG 3.43Å; N432-E434 PolarHBondContact OD1-N 2.94Å; N432-E434 PolarHBondContact OD1-OE2 3.07Å; N432-K435 HydrophobicContact CB-CB 4.39Å; N432-K435 PolarHBondContact O-N 3.4Å; N432-L436 WeakPolarHBondContact O-CG 3.32Å; N432-L436 PolarHBondContact O-N 3.45Å
433	P	82	Confident	86.9	Confident	44 Å²	44	41.8 Å²	41.8	29%	0.286	22%	0.217	S	C	.	.	H	α-helix	trans	-61.8	-30	178.5	26.5	-35.4	0	0	0	113.6	P174 Q431 K435 L436 Q437	P174-P433 HydrophobicContact CG-CB 4.16Å; Q431-P433 WeakPolarHBondContact O-CD 3.42Å; P433-K435 PolarHBondContact O-N 2.88Å; P433-L436 PolarHBondContact O-N 3.01Å; P433-Q437 WeakPolarHBondContact O-CB 3.37Å; P433-Q437 PolarHBondContact O-N 3.32Å
434	E	84.3	Confident	86.6	Confident	131 Å²	131	42.7 Å²	42.7	61%	0.612	22%	0.222	S	C	*	.	H	α-helix	trans	-61.5	-44.3	178.4	-56.9	163.4	159.6	0	0	111.2	N432 Q437	N432-E434 VanDerWaalsContact C-N 3.27Å; N432-E434 PolarHBondContact ND2-OE2 3.33Å; N432-E434 PolarHBondContact O-N 3.43Å; N432-E434 VanDerWaalsContact OD1-CB 3.31Å; N432-E434 WeakPolarHBondContact OD1-CB 3.43Å; N432-E434 WeakPolarHBondContact OD1-CG 3.43Å; N432-E434 PolarHBondContact OD1-N 2.94Å; N432-E434 PolarHBondContact OD1-OE2 3.07Å; E434-Q437 PolarHBondContact O-N 3.22Å
435	K	84.3	Confident	86.5	Confident	72 Å²	72	45.2 Å²	45.2	31%	0.313	23%	0.234	S	C	.	.	H	α-helix	trans	-67.6	-36.5	176	-81.6	-163.7	173.7	-167	0	111.8	I372 D373 T430 N432 P433	I372-K435 HydrophobicContact CG2-CB 3.97Å; I372-K435 HydrophobicContact CG2-CD 4.04Å; I372-K435 HydrophobicContact CG2-CG 4.19Å; D373-K435 IonicContact OD1-NZ 2.73Å; D373-K435 PolarHBondContact OD1-NZ 2.75Å; T430-K435 HydrophobicContact CG2-CB 3.78Å; T430-K435 HydrophobicContact CG2-CD 4.14Å; N432-K435 HydrophobicContact CB-CB 4.39Å; N432-K435 PolarHBondContact O-N 3.4Å; P433-K435 PolarHBondContact O-N 2.88Å
436	L	85.3	Confident	86.3	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-71.8	-34.7	178	-66.4	167.3	0	0	0	112.2	W176 L177 L429 T430 N432 P433 Q438 L439	W176-L436 HydrophobicContact CH2-CD1 3.81Å; W176-L436 HydrophobicContact CH2-CD2 4.45Å; W176-L436 HydrophobicContact CH2-CG 4.5Å; W176-L436 HydrophobicContact CZ2-CD1 4.11Å; L177-L436 HydrophobicContact CD1-CD1 3.76Å; L177-L436 HydrophobicContact CD2-CD1 3.94Å; L429-L436 HydrophobicContact CD1-CD2 4.35Å; L429-L436 HydrophobicContact CD2-CD2 4.47Å; L429-L436 HydrophobicContact CG-CD2 4.33Å; T430-L436 HydrophobicContact CG2-CD2 4.23Å; T430-L436 HydrophobicContact CG2-CG 4.29Å; T430-L436 WeakPolarHBondContact O-CD1 3.19Å; N432-L436 WeakPolarHBondContact O-CG 3.32Å; N432-L436 PolarHBondContact O-N 3.45Å; P433-L436 PolarHBondContact O-N 3.01Å; L436-Q438 PolarHBondContact O-N 3.22Å; L436-L439 HydrophobicContact CD2-CD1 4.24Å; L436-L439 WeakPolarHBondContact O-CB 3.22Å; L436-L439 PolarHBondContact O-N 3.43Å; L436-L439 VanDerWaalsContact O-N 3.09Å
437	Q	85.8	Confident	86.3	Confident	156 Å²	156	45.7 Å²	45.7	73%	0.729	24%	0.236	S	C	*	.	H	α-helix	trans	-61.7	-31	179	-175.2	173.8	-14.3	0	0	112.6	P433 E434 L439 G440	P433-Q437 WeakPolarHBondContact O-CB 3.37Å; P433-Q437 PolarHBondContact O-N 3.32Å; E434-Q437 PolarHBondContact O-N 3.22Å; Q437-L439 PolarHBondContact O-N 2.99Å; Q437-L439 VanDerWaalsContact O-N 3.16Å; Q437-G440 PolarHBondContact O-N 3.41Å
438	Q	85.1	Confident	86.4	Confident	112 Å²	112	45.3 Å²	45.3	52%	0.523	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-19.5	175.8	-62.2	179.5	4.7	0	0	113.7	M375 L436 G440	M375-Q438 HydrophobicContact SD-CB 3.63Å; L436-Q438 PolarHBondContact O-N 3.22Å; Q438-G440 VanDerWaalsContact C-N 3.32Å
439	L	86.2	Confident	86.1	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-7.2	175.4	-65.3	146.8	0	0	0	113.3	I365 I372 M375 L380 K422 L424 L436 Q437 L441	I365-L439 HydrophobicContact CD1-CD2 4.05Å; I372-L439 HydrophobicContact CD1-CD1 3.68Å; I372-L439 HydrophobicContact CG1-CD1 3.77Å; I372-L439 HydrophobicContact CG1-CD2 4.28Å; I372-L439 HydrophobicContact CG1-CG 4.23Å; M375-L439 HydrophobicContact CE-CB 4.47Å; M375-L439 HydrophobicContact CE-CD2 3.31Å; M375-L439 HydrophobicContact CE-CG 3.69Å; L380-L439 HydrophobicContact CD2-CD2 4.35Å; K422-L439 WeakPolarHBondContact CE-O 3.25Å; K422-L439 PolarHBondContact NZ-O 2.84Å; L424-L439 HydrophobicContact CD2-CB 4.48Å; L424-L439 HydrophobicContact CD2-CD1 3.49Å; L424-L439 VanDerWaalsContact CD2-CD1 3.49Å; L424-L439 HydrophobicContact CD2-CD2 3.88Å; L424-L439 HydrophobicContact CD2-CG 4.15Å; L436-L439 HydrophobicContact CD2-CD1 4.24Å; L436-L439 WeakPolarHBondContact O-CB 3.22Å; L436-L439 PolarHBondContact O-N 3.43Å; L436-L439 VanDerWaalsContact O-N 3.09Å; Q437-L439 PolarHBondContact O-N 2.99Å; Q437-L439 VanDerWaalsContact O-N 3.16Å; L439-L441 VanDerWaalsContact C-N 3.32Å; L439-L441 HydrophobicContact CB-CD2 3.72Å; L439-L441 HydrophobicContact CB-CG 3.88Å; L439-L441 PolarHBondContact O-N 3.34Å
440	G	88	Confident	85.2	Confident	49 Å²	49	46.3 Å²	46.3	51%	0.505	24%	0.24	S	C	.	.			trans	55.1	42.9	177.1	0	0	0	0	0	113.5	K422 Q437 Q438	K422-G440 VanDerWaalsContact NZ-C 3.3Å; K422-G440 PolarHBondContact NZ-O 3.44Å; Q437-G440 PolarHBondContact O-N 3.41Å; Q438-G440 VanDerWaalsContact C-N 3.32Å
441	L	90.2	Very high	84	Confident	33 Å²	33	51.4 Å²	51.4	17%	0.173	26%	0.262	C	S	.	.			trans	-66.3	140.5	-171.5	-57.3	179.5	0	0	0	112.7	W176 D246 K422 L424 L439 P444	W176-L441 HydrophobicContact CH2-CD1 4.1Å; W176-L441 HydrophobicContact CZ2-CD1 4.44Å; D246-L441 HydrophobicContact CB-CB 4.49Å; D246-L441 HydrophobicContact CB-CD2 4.28Å; D246-L441 WeakPolarHBondContact OD2-CA 3.5Å; K422-L441 HydrophobicContact CD-CD2 4.39Å; L424-L441 HydrophobicContact CD1-CD2 3.75Å; L424-L441 HydrophobicContact CD2-CD1 4.42Å; L424-L441 HydrophobicContact CD2-CD2 4.04Å; L439-L441 VanDerWaalsContact C-N 3.32Å; L439-L441 HydrophobicContact CB-CD2 3.72Å; L439-L441 HydrophobicContact CB-CG 3.88Å; L439-L441 PolarHBondContact O-N 3.34Å; L441-P444 HydrophobicContact CB-CB 3.93Å; L441-P444 HydrophobicContact CB-CG 3.92Å; L441-P444 HydrophobicContact CD1-CB 3.9Å; L441-P444 HydrophobicContact CD1-CG 4.32Å
442	H	88.1	Confident	82.3	Confident	36 Å²	36	50.8 Å²	50.8	17%	0.167	27%	0.265	C	S	.	.	S	Bend	trans	-105.2	114.3	177.2	-179.6	73.7	0	0	0	111	R243 D246 P444	R243-H442 VanDerWaalsContact CZ-CB 3.49Å; D246-H442 PolarHBondContact N-O 3.32Å; D246-H442 PolarHBondContact OD2-N 3.03Å; H442-P444 VanDerWaalsContact C-N 3.34Å
443	Q	88.5	Confident	80.4	Confident	96 Å²	96	53.1 Å²	53.1	45%	0.449	28%	0.283	S	S	.	.	S	Bend	trans	40.5	55.4	-174.6	-66.8	-167.8	-10.6	0	0	113	R245	R245-Q443 VanDerWaalsContact CB-O 3.32Å; R245-Q443 WeakPolarHBondContact CB-O 3.38Å; R245-Q443 WeakPolarHBondContact CD-O 3.38Å; R245-Q443 HydrophobicContact CG-CB 3.97Å; R245-Q443 WeakPolarHBondContact CG-O 3.4Å
444	P	91.4	Very high	78.2	Confident	18 Å²	18	55.1 Å²	55.1	12%	0.117	30%	0.298	C	S	.	.			trans	-57.5	141.9	-173.6	23.1	-34.2	0	0	0	113	W176 D246 L441 H442	W176-P444 VanDerWaalsContact CB-O 3.24Å; W176-P444 WeakPolarHBondContact CB-O 3.32Å; W176-P444 HydrophobicContact CD2-CB 3.86Å; W176-P444 HydrophobicContact CD2-CG 3.57Å; W176-P444 HydrophobicContact CE3-CB 3.84Å; W176-P444 HydrophobicContact CE3-CG 4.09Å; W176-P444 HydrophobicContact CG-CB 4.46Å; W176-P444 HydrophobicContact CG-CG 3.91Å; W176-P444 HydrophobicContact CH2-CB 4.11Å; W176-P444 HydrophobicContact CH2-CG 4.23Å; W176-P444 HydrophobicContact CZ2-CB 4.15Å; W176-P444 HydrophobicContact CZ2-CG 3.76Å; W176-P444 HydrophobicContact CZ3-CB 3.96Å; W176-P444 HydrophobicContact CZ3-CG 4.39Å; D246-P444 VanDerWaalsContact O-CA 3.27Å; D246-P444 WeakPolarHBondContact O-CA 3.45Å; L441-P444 HydrophobicContact CB-CB 3.93Å; L441-P444 HydrophobicContact CB-CG 3.92Å; L441-P444 HydrophobicContact CD1-CB 3.9Å; L441-P444 HydrophobicContact CD1-CG 4.32Å; H442-P444 VanDerWaalsContact C-N 3.34Å
445	Q	91.4	Very high	75.8	Confident	53 Å²	53	55 Å²	55	25%	0.248	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.3	172.7	-179.5	173.9	-6	0	0	108.6	D181 D246 L247 C248 F447	D181-Q445 WeakPolarHBondContact OD2-CG 3.43Å; D181-Q445 PolarHBondContact OD2-NE2 3.24Å; D246-Q445 PolarHBondContact O-N 3.18Å; L247-Q445 HydrophobicContact CD2-CB 3.96Å; C248-Q445 PolarHBondContact N-O 3.29Å; Q445-F447 HydrophobicContact CG-CE2 4.18Å; Q445-F447 HydrophobicContact CG-CZ 4.49Å
446	L	91.4	Very high	73.4	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.01	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	112.4	-174.8	173.9	58.8	0	0	0	111.4	W176 L177 P180 D181 C248 L429	W176-L446 HydrophobicContact CE3-CB 3.77Å; W176-L446 HydrophobicContact CZ3-CB 3.95Å; W176-L446 HydrophobicContact CZ3-CD2 4.46Å; L177-L446 HydrophobicContact CD1-CD2 3.81Å; P180-L446 CarbonylContact C-O 3.51Å; P180-L446 VanDerWaalsContact CA-O 3.28Å; P180-L446 WeakPolarHBondContact CA-O 3.35Å; P180-L446 HydrophobicContact CB-CB 4.2Å; P180-L446 HydrophobicContact CB-CD2 4.05Å; P180-L446 HydrophobicContact CB-CG 3.89Å; P180-L446 VanDerWaalsContact CB-O 3.26Å; P180-L446 WeakPolarHBondContact CB-O 3.48Å; D181-L446 PolarHBondContact N-O 3.28Å; C248-L446 HydrophobicContact CB-CB 4.44Å; C248-L446 HydrophobicContact CB-CD1 3.78Å; C248-L446 WeakPolarHBondContact O-CA 3.36Å; L429-L446 HydrophobicContact CD2-CD1 3.9Å
447	F	90.3	Very high	70.9	Confident	8 Å²	8	63.7 Å²	63.7	4%	0.035	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	121.9	164.2	-59.7	-92.6	0	0	0	109.5	D181 I183 E222 V223 A226 L247 C248 V249 S250 Q445	D181-F447 HydrophobicContact CB-CD1 3.63Å; D181-F447 HydrophobicContact CB-CE1 3.94Å; D181-F447 HydrophobicContact CB-CG 4.25Å; D181-F447 CarbonylContact O-C 3.53Å; D181-F447 WeakPolarHBondContact O-CA 3.43Å; I183-F447 HydrophobicContact CD1-CB 3.73Å; I183-F447 HydrophobicContact CG1-CB 3.95Å; E222-F447 HydrophobicContact CB-CD1 4.05Å; E222-F447 HydrophobicContact CB-CE1 4.08Å; V223-F447 HydrophobicContact CG2-CB 4.31Å; V223-F447 HydrophobicContact CG2-CD1 4.3Å; V223-F447 HydrophobicContact CG2-CD2 4.07Å; V223-F447 HydrophobicContact CG2-CE2 4.48Å; V223-F447 HydrophobicContact CG2-CG 3.97Å; A226-F447 HydrophobicContact CB-CE2 4.25Å; A226-F447 HydrophobicContact CB-CZ 3.69Å; L247-F447 HydrophobicContact CD1-CE2 4.29Å; L247-F447 HydrophobicContact CD2-CE2 4.28Å; C248-F447 PolarHBondContact O-N 3.1Å; V249-F447 WeakPolarHBondContact CA-O 3.25Å; V249-F447 HydrophobicContact CG2-CB 4.41Å; V249-F447 HydrophobicContact CG2-CD2 4.31Å; S250-F447 PolarHBondContact N-O 2.8Å; Q445-F447 HydrophobicContact CG-CE2 4.18Å; Q445-F447 HydrophobicContact CG-CZ 4.49Å
448	S	87.4	Confident	68.3	Low	3 Å²	3	61.9 Å²	61.9	2%	0.021	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	132.2	-173.7	176.1	0	0	0	0	111.7	D181 V182 I183 S250 V450	D181-S448 PolarHBondContact O-N 3.35Å; V182-S448 WeakPolarHBondContact CA-O 3.39Å; I183-S448 PolarHBondContact N-O 2.79Å; S250-S448 WeakPolarHBondContact O-CA 3.42Å; S448-V450 PolarHBondContact OG-N 3.39Å; S448-V450 PolarHBondContact OG-O 2.98Å
449	S	78.2	Confident	65.8	Low	3 Å²	3	63.4 Å²	63.4	2%	0.021	38%	0.383	C	S	.	.	S	Bend	trans	-85	-5.9	166.5	46.4	0	0	0	0	114	I183 R185 S250 A251 P252 D470	I183-S449 WeakPolarHBondContact O-CA 3.33Å; R185-S449 VanDerWaalsContact CG-O 3.24Å; R185-S449 WeakPolarHBondContact CG-O 3.38Å; R185-S449 PolarHBondContact NE-O 2.96Å; S250-S449 PolarHBondContact O-N 2.95Å; S250-S449 VanDerWaalsContact O-N 3.13Å; S250-S449 PolarHBondContact O-OG 2.95Å; A251-S449 WeakPolarHBondContact CA-OG 3.17Å; P252-S449 WeakPolarHBondContact CD-OG 3.37Å; S449-D470 VanDerWaalsContact C-OD2 3.27Å; S449-D470 WeakPolarHBondContact CB-OD2 3.26Å; S449-D470 PolarHBondContact OG-OD2 2.94Å
450	V	67.1	Low	63.2	Low	25 Å²	25	67.2 Å²	67.2	15%	0.152	42%	0.415	C	S	.	.	S	Bend	trans	-78.3	132.6	169.7	-174.1	0	0	0	0	109	S448 S452 R468 D470	S448-V450 PolarHBondContact OG-N 3.39Å; S448-V450 PolarHBondContact OG-O 2.98Å; V450-S452 PolarHBondContact O-N 3.21Å; V450-R468 HydrophobicContact CG1-CB 4.32Å; V450-D470 VanDerWaalsContact CG2-OD2 3.3Å; V450-D470 WeakPolarHBondContact CG2-OD2 3.48Å; V450-D470 PolarHBondContact N-OD2 3.33Å
451	H	56.7	Low	60.5	Low	120 Å²	120	72.6 Å²	72.6	56%	0.556	43%	0.427	S	S	*	.	P	Polyproline II helix	trans	-54.6	133.3	178.3	-61.6	-13.6	0	0	0	112.3	R185	R185-H451 PolarHBondContact NH1-CE1 3.44Å
452	S	43.8	Very low	58	Low	50 Å²	50	75.8 Å²	75.8	35%	0.35	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-54.9	143.7	159	177.8	0	0	0	0	109.8	V450 S454	V450-S452 PolarHBondContact O-N 3.21Å; S452-S454 VanDerWaalsContact C-N 3.35Å; S452-S454 PolarHBondContact O-N 2.87Å
453	P	42.3	Very low	55.4	Low	99 Å²	99	79 Å²	79	64%	0.643	47%	0.472	S	S	*	.			trans	-70.4	88.4	-179.3	29.5	-35.7	0	0	0	111.1	S455	P453-S455 PolarHBondContact O-N 3.11Å
454	S	36.2	Very low	53	Low	86 Å²	86	82.2 Å²	82.2	60%	0.601	49%	0.487	S	S	*	.			trans	-55.6	100.2	174.7	56	0	0	0	0	111.5	S452 S456	S452-S454 VanDerWaalsContact C-N 3.35Å; S452-S454 PolarHBondContact O-N 2.87Å; S454-S456 PolarHBondContact O-N 3.49Å
455	S	34.2	Very low	50.9	Low	128 Å²	128	91 Å²	91	90%	0.895	52%	0.523	S	S	*	.	S	Bend		36.4	-2.5	125.6	53.1	0	0	0	0	122.5	P453	P453-S455 PolarHBondContact O-N 3.11Å
456	S	34.1	Very low	49.1	Very low	79 Å²	79	93.4 Å²	93.4	55%	0.552	53%	0.534	S	S	*	.			trans	-145.3	65.2	-168.6	64.7	0	0	0	0	112	S454	S454-S456 PolarHBondContact O-N 3.49Å
457	M	33	Very low	47.7	Very low	180 Å²	180	96.5 Å²	96.5	89%	0.887	55%	0.548	S	S	*	.			trans	-146.8	137.6	157.1	-86.9	-64.2	102.1	0	0	109
458	T	30.3	Very low	46.9	Very low	118 Å²	118	104.9 Å²	104.9	72%	0.724	58%	0.58	S	S	*	*			trans	-65.8	154.3	-178.9	42	0	0	0	0	112.2	A460	T458-A460 PolarHBondContact O-N 2.96Å
459	P	33.5	Very low	46.5	Very low	144 Å²	144	105.4 Å²	105.4	94%	0.935	58%	0.582	S	S	*	*			trans	-78.8	60.9	-174.9	33.8	-37.3	0	0	0	112.9
460	A	32	Very low	46.3	Very low	81 Å²	81	105.7 Å²	105.7	67%	0.669	58%	0.583	S	S	*	*			trans	-100.5	120.3	171.6	0	0	0	0	0	110.8	T458	T458-A460 PolarHBondContact O-N 2.96Å
461	E	31.4	Very low	47	Very low	162 Å²	162	105.7 Å²	105.7	76%	0.757	58%	0.581	S	S	*	*			trans	52.4	117.6	168	-60	-121.5	127.9	0	0	119.4	T463	E461-T463 VanDerWaalsContact C-N 3.25Å; E461-T463 PolarHBondContact O-N 3.36Å
462	P	35.9	Very low	48	Very low	101 Å²	101	100.5 Å²	100.5	66%	0.656	56%	0.558	S	S	*	*			trans	-81.1	70	169.4	35.7	-34.6	0	0	0	111	K168	K168-P462 HydrophobicContact CD-CG 4.12Å
463	T	33.6	Very low	49.5	Very low	102 Å²	102	101.3 Å²	101.3	63%	0.626	56%	0.556	S	S	*	*			trans	-63.9	158.3	155.5	52.3	0	0	0	0	109.2	E461 K465	E461-T463 VanDerWaalsContact C-N 3.25Å; E461-T463 PolarHBondContact O-N 3.36Å; T463-K465 PolarHBondContact O-N 3.19Å
464	H	39.4	Very low	51.4	Low	165 Å²	165	98.8 Å²	98.8	76%	0.764	55%	0.548	S	S	*	.			trans	-59.7	116.2	-178.4	-75.3	-110.5	0	0	0	109.6	H466	H464-H466 VanDerWaalsContact C-N 3.31Å; H464-H466 PolarHBondContact O-CD2 3.3Å; H464-H466 PolarHBondContact O-N 3.26Å
465	K	46	Very low	53.9	Low	201 Å²	201	95.6 Å²	95.6	87%	0.874	53%	0.525	S	S	*	.			trans	-69.5	93.1	168.3	-73.6	-170.4	176	-175.6	0	108.1	T463	T463-K465 PolarHBondContact O-N 3.19Å
466	H	53.5	Low	56.6	Low	104 Å²	104	92.1 Å²	92.1	48%	0.481	50%	0.498	S	S	.	.			trans	-57	143.3	179.8	-70.4	-105.4	0	0	0	110.6	H464 R468 D619	H464-H466 VanDerWaalsContact C-N 3.31Å; H464-H466 PolarHBondContact O-CD2 3.3Å; H464-H466 PolarHBondContact O-N 3.26Å; H466-R468 PolarHBondContact O-N 3.06Å; H466-D619 HydrophobicContact CB-CB 4.2Å; H466-D619 WeakPolarHBondContact CB-O 3.25Å; H466-D619 IonicContact CE1-OD2 3.23Å; H466-D619 PolarHBondContact CE1-OD2 2.8Å; H466-D619 IonicContact ND1-OD2 3.93Å; H466-D619 PolarHBondContact ND1-OD2 2.91Å
467	E	63.3	Low	59.4	Low	68 Å²	68	88.6 Å²	88.6	32%	0.318	47%	0.472	S	S	.	.			trans	-61.8	105.3	174.7	-69.1	-170.1	131.5	0	0	108.5	Q431 F469 R583	Q431-E467 PolarHBondContact N-OE1 3.49Å; Q431-E467 VanDerWaalsContact N-OE1 3.15Å; E467-F469 HydrophobicContact CB-CD2 4.5Å; E467-F469 HydrophobicContact CB-CE1 4.4Å; E467-F469 HydrophobicContact CB-CE2 3.69Å; E467-F469 HydrophobicContact CB-CZ 3.64Å; E467-F469 WeakPolarHBondContact O-CD2 3.38Å; E467-F469 WeakPolarHBondContact O-CE2 3.33Å; E467-F469 WeakPolarHBondContact OE2-CZ 3.34Å; E467-R583 IonicContact OE1-NH2 3.29Å; E467-R583 PolarHBondContact OE1-NH2 3.28Å; E467-R583 IonicContact OE2-CZ 2.7Å; E467-R583 IonicContact OE2-NE 3.02Å; E467-R583 PolarHBondContact OE2-NE 2.7Å; E467-R583 IonicContact OE2-NH2 3.74Å; E467-R583 PolarHBondContact OE2-NH2 3Å
468	R	72.9	Confident	62.2	Low	183 Å²	183	81.5 Å²	81.5	69%	0.691	44%	0.437	S	S	*	.			trans	-72.2	136.2	169.7	-75	-178.2	174.3	171.7	-2.8	109.3	V450 H466 A620	V450-R468 HydrophobicContact CG1-CB 4.32Å; H466-R468 PolarHBondContact O-N 3.06Å; R468-A620 WeakPolarHBondContact CA-O 3.4Å
469	F	79.1	Confident	65.3	Low	15 Å²	15	77.1 Å²	77.1	7%	0.066	41%	0.407	C	S	.	.			trans	-120.6	156.9	-178.7	-64.7	-80.8	0	0	0	112	T428 E467 I582 R583 I586 A620	T428-F469 HydrophobicContact CG2-CD1 3.66Å; T428-F469 HydrophobicContact CG2-CE1 4.07Å; E467-F469 HydrophobicContact CB-CD2 4.5Å; E467-F469 HydrophobicContact CB-CE1 4.4Å; E467-F469 HydrophobicContact CB-CE2 3.69Å; E467-F469 HydrophobicContact CB-CZ 3.64Å; E467-F469 WeakPolarHBondContact O-CD2 3.38Å; E467-F469 WeakPolarHBondContact O-CE2 3.33Å; E467-F469 WeakPolarHBondContact OE2-CZ 3.34Å; F469-I582 HydrophobicContact CD2-CG1 3.9Å; F469-I582 HydrophobicContact CD2-CG2 4.24Å; F469-I582 HydrophobicContact CE2-CB 4.47Å; F469-I582 HydrophobicContact CE2-CG1 4.06Å; F469-I582 HydrophobicContact CE2-CG2 3.53Å; F469-I582 HydrophobicContact CZ-CG2 4.11Å; F469-R583 HydrophobicContact CE1-CG 3.97Å; F469-R583 HydrophobicContact CZ-CG 3.83Å; F469-I586 HydrophobicContact CB-CD1 3.36Å; F469-I586 HydrophobicContact CD1-CD1 3.85Å; F469-I586 HydrophobicContact CD2-CD1 3.8Å; F469-I586 HydrophobicContact CG-CD1 3.39Å; F469-A620 HydrophobicContact CD2-CB 4.11Å; F469-A620 PolarHBondContact N-O 3.1Å
470	D	74.7	Confident	68.2	Low	9 Å²	9	70.3 Å²	70.3	5%	0.048	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-88	116	174.5	-64.4	-46	0	0	0	111.1	R185 P252 S449 V450	R185-D470 IonicContact CZ-OD1 3.88Å; R185-D470 VanDerWaalsContact CZ-OD1 3.26Å; R185-D470 IonicContact NE-OD1 3.66Å; R185-D470 PolarHBondContact NE-OD1 3.02Å; R185-D470 VanDerWaalsContact NE-OD1 3.08Å; R185-D470 IonicContact NH2-OD1 3.48Å; R185-D470 PolarHBondContact NH2-OD1 2.73Å; P252-D470 HydrophobicContact CB-CB 4.2Å; P252-D470 HydrophobicContact CG-CB 4.19Å; S449-D470 VanDerWaalsContact C-OD2 3.27Å; S449-D470 WeakPolarHBondContact CB-OD2 3.26Å; S449-D470 PolarHBondContact OG-OD2 2.94Å; V450-D470 VanDerWaalsContact CG2-OD2 3.3Å; V450-D470 WeakPolarHBondContact CG2-OD2 3.48Å; V450-D470 PolarHBondContact N-OD2 3.33Å
471	F	81.3	Confident	71.1	Confident	25 Å²	25	67.8 Å²	67.8	11%	0.11	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-84	146.2	173.3	-72.9	-106.8	0	0	0	110.5	Q473 E477 I582 Y585 I589 A620	F471-Q473 PolarHBondContact O-N 3.48Å; F471-E477 WeakPolarHBondContact CD1-OE2 3.43Å; F471-E477 WeakPolarHBondContact CE1-OE2 3.21Å; F471-I582 HydrophobicContact CZ-CD1 4.25Å; F471-Y585 HydrophobicContact CE1-CD1 4.41Å; F471-Y585 HydrophobicContact CE1-CE1 4.15Å; F471-I589 HydrophobicContact CD1-CD1 3.78Å; F471-I589 HydrophobicContact CE1-CD1 3.98Å; F471-A620 HydrophobicContact CE2-CB 4.09Å; F471-A620 HydrophobicContact CZ-CB 4.04Å
472	P	77.4	Confident	73.9	Confident	10 Å²	10	60.9 Å²	60.9	7%	0.065	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-59.3	132.3	175.9	-23.3	33.5	0	0	0	112.5	L475 A593	P472-L475 HydrophobicContact CB-CB 4.39Å; P472-L475 HydrophobicContact CG-CD2 4.38Å; P472-L475 WeakPolarHBondContact O-CB 3.28Å; P472-L475 PolarHBondContact O-N 3.39Å; P472-A593 HydrophobicContact CB-CB 3.74Å
473	Q	76.3	Confident	76.5	Confident	67 Å²	67	60 Å²	60	31%	0.313	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	140.3	178.6	-63.6	-171.3	-51.1	0	0	112	R185 I187 F471	R185-Q473 PolarHBondContact O-NE2 3.48Å; R185-Q473 PolarHBondContact O-OE1 3.07Å; R185-Q473 VanDerWaalsContact O-OE1 3.12Å; I187-Q473 VanDerWaalsContact N-OE1 3.12Å; F471-Q473 PolarHBondContact O-N 3.48Å
474	G	81.2	Confident	78.9	Confident	47 Å²	47	58 Å²	58	49%	0.485	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.1	8.5	-174.7	0	0	0	0	0	114	P598 G599	G474-P598 WeakPolarHBondContact O-CA 3.36Å; G474-G599 PolarHBondContact O-N 3.31Å
475	L	87.9	Confident	81.2	Confident	19 Å²	19	54.6 Å²	54.6	10%	0.099	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	131.6	169.2	-174.7	64.6	0	0	0	110.6	P472 E477 I589 T592 A593 G599 A601	P472-L475 HydrophobicContact CB-CB 4.39Å; P472-L475 HydrophobicContact CG-CD2 4.38Å; P472-L475 WeakPolarHBondContact O-CB 3.28Å; P472-L475 PolarHBondContact O-N 3.39Å; L475-E477 HydrophobicContact CD2-CG 3.65Å; L475-E477 HydrophobicContact CG-CG 3.79Å; L475-I589 HydrophobicContact CD2-CB 3.84Å; L475-I589 HydrophobicContact CD2-CD1 3.72Å; L475-I589 HydrophobicContact CD2-CG1 3.84Å; L475-T592 HydrophobicContact CD1-CG2 3.6Å; L475-A593 HydrophobicContact CB-CB 3.91Å; L475-A593 HydrophobicContact CD1-CB 4.13Å; L475-G599 CarbonylContact C-O 3.59Å; L475-G599 WeakPolarHBondContact CA-O 3.44Å; L475-A601 HydrophobicContact CD1-CB 3.81Å
476	T	90.8	Very high	83.1	Confident	54 Å²	54	48.5 Å²	48.5	33%	0.331	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	118.7	164.6	-41	0	0	0	0	109	F478 G599 A601	T476-F478 HydrophobicContact CG2-CD2 4.29Å; T476-F478 HydrophobicContact CG2-CE2 3.42Å; T476-F478 VanDerWaalsContact CG2-CE2 3.42Å; T476-F478 HydrophobicContact CG2-CZ 3.55Å; T476-G599 PolarHBondContact N-O 2.95Å; T476-A601 PolarHBondContact O-N 3.07Å
477	E	92.9	Very high	84.9	Confident	5 Å²	5	43.7 Å²	43.7	2%	0.023	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	128.2	-174.7	-58.4	-171.3	-78.1	0	0	110.8	F471 L475 Y585 I589 S622 I625 Q626	F471-E477 WeakPolarHBondContact CD1-OE2 3.43Å; F471-E477 WeakPolarHBondContact CE1-OE2 3.21Å; L475-E477 HydrophobicContact CD2-CG 3.65Å; L475-E477 HydrophobicContact CG-CG 3.79Å; E477-Y585 VanDerWaalsContact OE2-CE1 3.25Å; E477-Y585 WeakPolarHBondContact OE2-CE1 3.39Å; E477-Y585 PolarHBondContact OE2-OH 2.92Å; E477-Y585 VanDerWaalsContact OE2-OH 3.07Å; E477-I589 WeakPolarHBondContact OE2-CD1 3.4Å; E477-S622 PolarHBondContact OE1-OG 3.15Å; E477-I625 HydrophobicContact CB-CB 4.15Å; E477-I625 HydrophobicContact CB-CG1 3.93Å; E477-Q626 PolarHBondContact O-N 2.87Å
478	F	93.6	Very high	86.3	Confident	32 Å²	32	40.4 Å²	40.4	14%	0.14	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	145.4	178.7	-65.3	-82.3	0	0	0	111.6	T476 L600 A601 F602 T603 Q626 Q628	T476-F478 HydrophobicContact CG2-CD2 4.29Å; T476-F478 HydrophobicContact CG2-CE2 3.42Å; T476-F478 VanDerWaalsContact CG2-CE2 3.42Å; T476-F478 HydrophobicContact CG2-CZ 3.55Å; F478-L600 HydrophobicContact CE2-CD2 4.28Å; F478-A601 PolarHBondContact N-O 3.39Å; F478-F602 HydrophobicContact CB-CD1 3.48Å; F478-F602 VanDerWaalsContact CB-CD1 3.48Å; F478-F602 HydrophobicContact CB-CE1 3.73Å; F478-F602 HydrophobicContact CB-CG 4.4Å; F478-F602 HydrophobicContact CD2-CD1 4.06Å; F478-F602 AromaticContact CD2-CE1 3.51Å; F478-F602 HydrophobicContact CD2-CE1 3.51Å; F478-F602 AromaticContact CD2-CZ 3.96Å; F478-F602 HydrophobicContact CD2-CZ 3.96Å; F478-F602 HydrophobicContact CE2-CE1 4.25Å; F478-F602 HydrophobicContact CE2-CZ 4.41Å; F478-F602 HydrophobicContact CG-CD1 4Å; F478-F602 AromaticContact CG-CE1 3.7Å; F478-F602 HydrophobicContact CG-CE1 3.7Å; F478-F602 CarbonylContact O-C 3.53Å; F478-F602 WeakPolarHBondContact O-CA 3.4Å; F478-T603 PolarHBondContact O-N 3.02Å; F478-Q626 CarbonylContact C-O 3.5Å; F478-Q626 VanDerWaalsContact CA-O 3.26Å; F478-Q626 WeakPolarHBondContact CA-O 3.41Å; F478-Q626 HydrophobicContact CD1-CB 3.73Å; F478-Q626 HydrophobicContact CE1-CB 3.88Å; F478-Q628 HydrophobicContact CD1-CB 4.16Å
479	Y	94.7	Very high	87.1	Confident	25 Å²	25	31.9 Å²	31.9	10%	0.098	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.1	164.3	82.3	-86.4	0	0	0	111.6	T603 L605 E610 L614 I625 Q626 R627 Q628	Y479-T603 CarbonylContact C-O 3.59Å; Y479-T603 WeakPolarHBondContact CA-O 3.4Å; Y479-L605 HydrophobicContact CD2-CD1 3.72Å; Y479-L605 HydrophobicContact CD2-CG 4.46Å; Y479-L605 HydrophobicContact CG-CD1 4Å; Y479-E610 HydrophobicContact CE2-CG 4.26Å; Y479-E610 WeakPolarHBondContact CE2-OE2 3.32Å; Y479-L614 HydrophobicContact CD1-CD2 3.9Å; Y479-L614 HydrophobicContact CE1-CD1 4.29Å; Y479-L614 HydrophobicContact CE1-CD2 3.85Å; Y479-L614 HydrophobicContact CG-CD2 4.45Å; Y479-I625 HydrophobicContact CD1-CG1 4.28Å; Y479-Q626 WeakPolarHBondContact CD1-O 3.43Å; Y479-Q626 PolarHBondContact N-O 3.22Å; Y479-R627 HydrophobicContact CD1-CB 4.23Å; Y479-R627 HydrophobicContact CE1-CB 3.53Å; Y479-R627 HydrophobicContact CE1-CG 3.92Å; Y479-R627 HydrophobicContact CE2-CB 4.47Å; Y479-R627 HydrophobicContact CE2-CG 3.94Å; Y479-R627 WeakPolarHBondContact OH-CD 3.42Å; Y479-Q628 PolarHBondContact O-N 3.01Å
480	V	94.1	Very high	87.7	Confident	1 Å²	1	31.4 Å²	31.4	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	109.9	-178.8	-174.6	0	0	0	0	108	L490 F494 F602 T603 F604 L605 Q628 V630	V480-L490 HydrophobicContact CG1-CD1 4.14Å; V480-L490 HydrophobicContact CG1-CD2 4.37Å; V480-F494 HydrophobicContact CG2-CE2 4.42Å; V480-F494 HydrophobicContact CG2-CZ 3.95Å; V480-F602 HydrophobicContact CG2-CD1 4.45Å; V480-T603 PolarHBondContact N-O 2.9Å; V480-F604 HydrophobicContact CB-CD1 3.9Å; V480-F604 HydrophobicContact CB-CE1 4.28Å; V480-F604 HydrophobicContact CG2-CD1 4.12Å; V480-F604 HydrophobicContact CG2-CE1 4.14Å; V480-L605 PolarHBondContact O-N 3.28Å; V480-Q628 HydrophobicContact CG2-CB 4.44Å; V480-V630 HydrophobicContact CG1-CG2 4.23Å
481	P	92.6	Very high	88.5	Confident	29 Å²	29	31 Å²	31	19%	0.188	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	128.5	174.8	30.6	-34.5	0	0	0	109.6	L605 E610 L629	P481-L605 CarbonylContact C-O 3.52Å; P481-L605 WeakPolarHBondContact CA-O 3.38Å; P481-E610 WeakPolarHBondContact CB-OE1 3.41Å; P481-L629 HydrophobicContact CG-CD1 4.26Å
482	C	90.7	Very high	88.9	Confident	17 Å²	17	29.9 Å²	29.9	12%	0.115	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	168.1	-170.7	67.3	0	0	0	0	113.1	L490 L605 L606	C482-L490 HydrophobicContact CB-CD1 3.45Å; C482-L490 VanDerWaalsContact CB-CD1 3.45Å; C482-L605 PolarHBondContact N-O 3.34Å; C482-L605 PolarHBondContact SG-O 3.05Å; C482-L606 WeakPolarHBondContact O-CD2 3.32Å
483	T	89.8	Confident	89.5	Confident	83 Å²	83	30 Å²	30	51%	0.509	17%	0.169	S	C	.	.			trans	-108.3	152.9	165.1	60.8	0	0	0	0	109.6	N485 K486 K487	T483-N485 VanDerWaalsContact C-N 3.28Å; T483-N485 PolarHBondContact O-N 3.31Å; T483-K486 PolarHBondContact O-N 3.14Å; T483-K487 PolarHBondContact O-N 3.23Å
484	M	85.8	Confident	90.1	Very high	58 Å²	58	26.9 Å²	26.9	29%	0.286	15%	0.154	S	C	.	.	G	3₁₀ helix	trans	-51.8	-46.2	-176.6	-75.4	-64.8	-73.6	0	0	112.6	K486 K487 L606	M484-K486 PolarHBondContact O-N 3.05Å; M484-K487 PolarHBondContact O-N 2.92Å; M484-K487 HydrophobicContact SD-CD 4.19Å; M484-L606 HydrophobicContact CG-CD1 3.98Å; M484-L606 HydrophobicContact CG-CD2 3.85Å; M484-L606 HydrophobicContact SD-CD1 3.85Å; M484-L606 HydrophobicContact SD-CD2 3.95Å; M484-L606 HydrophobicContact SD-CG 4.36Å
485	N	85.9	Confident	90.5	Very high	95 Å²	95	25.1 Å²	25.1	51%	0.508	13%	0.134	S	C	.	.	G	3₁₀ helix	trans	-65.6	-23.5	-177.1	-60.8	6.5	0	0	0	113.3	T483 Y642	T483-N485 VanDerWaalsContact C-N 3.28Å; T483-N485 PolarHBondContact O-N 3.31Å; N485-Y642 WeakPolarHBondContact O-CE1 3.44Å; N485-Y642 PolarHBondContact O-OH 2.99Å
486	K	87.4	Confident	90.5	Very high	73 Å²	73	26.9 Å²	26.9	32%	0.317	14%	0.143	S	C	.	.	G	3₁₀ helix	trans	-97.6	-4.8	179.4	-59.7	-158.4	-178.6	-149.8	0	113.9	T483 M484 L489 L490 L635 E639	T483-K486 PolarHBondContact O-N 3.14Å; M484-K486 PolarHBondContact O-N 3.05Å; K486-L489 HydrophobicContact CG-CD1 4.43Å; K486-L489 PolarHBondContact O-N 2.52Å; K486-L490 WeakPolarHBondContact O-CG 3.47Å; K486-L490 PolarHBondContact O-N 3.45Å; K486-L635 HydrophobicContact CD-CD1 4.38Å; K486-E639 WeakPolarHBondContact CE-OE1 3.32Å; K486-E639 IonicContact NZ-OE1 3.55Å; K486-E639 PolarHBondContact NZ-OE1 2.92Å
487	K	91	Very high	90.2	Very high	2 Å²	2	30.5 Å²	30.5	1%	0.009	15%	0.152	C	C	.	.	H	α-helix	trans	-57.1	-43.8	176.5	-73.9	-170.1	176.1	-163.7	0	113.8	T483 M484 L490 I491 Y576 D577 F604	T483-K487 PolarHBondContact O-N 3.23Å; M484-K487 PolarHBondContact O-N 2.92Å; M484-K487 HydrophobicContact SD-CD 4.19Å; K487-L490 PolarHBondContact O-N 2.96Å; K487-I491 PolarHBondContact O-N 3.41Å; K487-Y576 HydrophobicContact CB-CD2 4.33Å; K487-Y576 HydrophobicContact CB-CE1 4.41Å; K487-Y576 HydrophobicContact CB-CE2 3.56Å; K487-Y576 HydrophobicContact CD-CD1 4.38Å; K487-Y576 HydrophobicContact CD-CE1 3.98Å; K487-Y576 HydrophobicContact CD-CE2 4.43Å; K487-Y576 WeakPolarHBondContact CE-O 3.39Å; K487-Y576 PolarHBondContact NZ-O 3.21Å; K487-D577 IonicContact NZ-OD1 3.01Å; K487-D577 PolarHBondContact NZ-OD1 3.05Å; K487-F604 HydrophobicContact CB-CD2 4.38Å; K487-F604 HydrophobicContact CG-CD2 4.34Å
488	P	91.3	Very high	89.8	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-66.3	-38.4	177.1	-24.3	36.8	0	0	0	113.1	F4 L490 I491 L492 L516 L519 Y576 Y642	F4-P488 HydrophobicContact CE2-CG 3.87Å; F4-P488 HydrophobicContact CZ-CG 3.93Å; P488-L490 VanDerWaalsContact C-N 3.31Å; P488-L490 PolarHBondContact O-N 2.95Å; P488-I491 WeakPolarHBondContact O-CG2 3.27Å; P488-I491 PolarHBondContact O-N 3.07Å; P488-L492 WeakPolarHBondContact O-CG 3.43Å; P488-L492 PolarHBondContact O-N 3.21Å; P488-L516 HydrophobicContact CB-CD1 4.18Å; P488-L516 HydrophobicContact CG-CD1 4.39Å; P488-L519 HydrophobicContact CB-CD1 4.13Å; P488-L519 HydrophobicContact CB-CD2 4.07Å; P488-L519 HydrophobicContact CG-CD1 4.36Å; P488-Y576 WeakPolarHBondContact CG-OH 3.28Å; P488-Y642 HydrophobicContact CB-CE2 3.66Å; P488-Y642 WeakPolarHBondContact CD-OH 3.45Å; P488-Y642 HydrophobicContact CG-CE2 4.13Å; P488-Y642 VanDerWaalsContact CG-OH 3.3Å; P488-Y642 WeakPolarHBondContact CG-OH 3.47Å
489	L	90.6	Very high	89.4	Confident	3 Å²	3	39.9 Å²	39.9	2%	0.016	20%	0.195	C	C	.	.	H	α-helix	trans	-60.3	-40.4	174.5	-71	169.9	0	0	0	111.8	K486 L492 H493 L635 M638 E639 Y642	K486-L489 HydrophobicContact CG-CD1 4.43Å; K486-L489 PolarHBondContact O-N 2.52Å; L489-L492 PolarHBondContact O-N 3.04Å; L489-H493 VanDerWaalsContact O-CB 3.28Å; L489-H493 WeakPolarHBondContact O-CB 3.34Å; L489-H493 PolarHBondContact O-N 2.86Å; L489-L635 HydrophobicContact CB-CD2 4.39Å; L489-M638 HydrophobicContact CD2-CB 3.81Å; L489-E639 HydrophobicContact CD1-CG 3.67Å; L489-Y642 HydrophobicContact CD1-CD1 3.74Å; L489-Y642 HydrophobicContact CD1-CE1 3.86Å; L489-Y642 HydrophobicContact CD1-CG 4.38Å; L489-Y642 HydrophobicContact CD2-CD1 3.82Å; L489-Y642 HydrophobicContact CD2-CD2 4.08Å; L489-Y642 HydrophobicContact CD2-CE1 4.44Å; L489-Y642 HydrophobicContact CD2-CG 3.59Å; L489-Y642 HydrophobicContact CG-CD1 3.73Å; L489-Y642 HydrophobicContact CG-CD2 4.27Å; L489-Y642 HydrophobicContact CG-CE1 3.87Å; L489-Y642 HydrophobicContact CG-CE2 4.42Å; L489-Y642 HydrophobicContact CG-CG 3.91Å
490	L	91.4	Very high	88.9	Confident	6 Å²	6	40.4 Å²	40.4	3%	0.031	20%	0.2	C	C	.	.	H	α-helix	trans	-64.8	-42.3	178.2	-70.9	167.9	0	0	0	112.9	V480 C482 K486 K487 P488 H493 F494 F604 V630 L635	V480-L490 HydrophobicContact CG1-CD1 4.14Å; V480-L490 HydrophobicContact CG1-CD2 4.37Å; C482-L490 HydrophobicContact CB-CD1 3.45Å; C482-L490 VanDerWaalsContact CB-CD1 3.45Å; K486-L490 WeakPolarHBondContact O-CG 3.47Å; K486-L490 PolarHBondContact O-N 3.45Å; K487-L490 PolarHBondContact O-N 2.96Å; P488-L490 VanDerWaalsContact C-N 3.31Å; P488-L490 PolarHBondContact O-N 2.95Å; L490-H493 PolarHBondContact O-N 2.88Å; L490-F494 VanDerWaalsContact O-CD1 3.25Å; L490-F494 WeakPolarHBondContact O-CD1 3.31Å; L490-F494 WeakPolarHBondContact O-CG 3.34Å; L490-F494 PolarHBondContact O-N 2.88Å; L490-F604 HydrophobicContact CB-CE1 4.36Å; L490-F604 HydrophobicContact CB-CE2 3.74Å; L490-F604 HydrophobicContact CB-CZ 3.64Å; L490-V630 HydrophobicContact CD2-CB 3.74Å; L490-V630 HydrophobicContact CD2-CG1 3.93Å; L490-V630 HydrophobicContact CD2-CG2 3.72Å; L490-L635 HydrophobicContact CD2-CD1 4.14Å; L490-L635 HydrophobicContact CD2-CD2 4.5Å
491	I	91.4	Very high	88.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-70.1	-37.9	177.2	-172.7	65.5	0	0	0	111.7	K487 P488 F494 V495 I503 L516 L554 V574 Y576 F604	K487-I491 PolarHBondContact O-N 3.41Å; P488-I491 WeakPolarHBondContact O-CG2 3.27Å; P488-I491 PolarHBondContact O-N 3.07Å; I491-F494 PolarHBondContact O-N 3.31Å; I491-V495 WeakPolarHBondContact O-CG2 3.35Å; I491-V495 PolarHBondContact O-N 3.01Å; I491-V495 VanDerWaalsContact O-N 3.15Å; I491-I503 HydrophobicContact CD1-CG2 4.45Å; I491-L516 HydrophobicContact CG2-CD1 4.19Å; I491-L554 HydrophobicContact CD1-CD1 3.89Å; I491-L554 HydrophobicContact CG1-CD1 4Å; I491-L554 HydrophobicContact CG1-CD2 4.01Å; I491-V574 HydrophobicContact CD1-CB 4.1Å; I491-V574 HydrophobicContact CD1-CG1 4.06Å; I491-V574 HydrophobicContact CD1-CG2 3.96Å; I491-Y576 HydrophobicContact CG2-CD2 4.45Å; I491-Y576 HydrophobicContact CG2-CE2 4.46Å; I491-F604 HydrophobicContact CB-CE2 4.14Å; I491-F604 HydrophobicContact CB-CZ 4.4Å
492	L	90.3	Very high	88.3	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.005	23%	0.228	C	C	.	.	H	α-helix	trans	-63.1	-42.7	173.2	-71.1	168.3	0	0	0	111.5	P488 L489 F494 V495 L496 L519 V520 F523 V526 M638	P488-L492 WeakPolarHBondContact O-CG 3.43Å; P488-L492 PolarHBondContact O-N 3.21Å; L489-L492 PolarHBondContact O-N 3.04Å; L492-F494 VanDerWaalsContact C-N 3.32Å; L492-F494 PolarHBondContact O-N 2.76Å; L492-V495 PolarHBondContact O-N 3.43Å; L492-L496 WeakPolarHBondContact O-CB 3.49Å; L492-L496 WeakPolarHBondContact O-CG 3.15Å; L492-L496 PolarHBondContact O-N 2.99Å; L492-L519 HydrophobicContact CD1-CD2 4.08Å; L492-V520 HydrophobicContact CD2-CB 4.33Å; L492-V520 HydrophobicContact CD2-CG1 3.95Å; L492-V520 HydrophobicContact CD2-CG2 3.94Å; L492-V520 HydrophobicContact CG-CG2 4.44Å; L492-F523 HydrophobicContact CD1-CB 4.28Å; L492-F523 HydrophobicContact CD1-CD1 3.96Å; L492-F523 HydrophobicContact CD1-CD2 3.91Å; L492-F523 HydrophobicContact CD1-CE1 4.31Å; L492-F523 HydrophobicContact CD1-CE2 4.24Å; L492-F523 HydrophobicContact CD1-CG 3.77Å; L492-F523 HydrophobicContact CD1-CZ 4.44Å; L492-F523 HydrophobicContact CD2-CB 4.46Å; L492-F523 HydrophobicContact CD2-CD1 4.01Å; L492-F523 HydrophobicContact CD2-CG 4.33Å; L492-V526 HydrophobicContact CD2-CG2 4.17Å; L492-M638 HydrophobicContact CB-CE 3.6Å; L492-M638 HydrophobicContact CD1-CE 4.47Å
493	H	89.4	Confident	88.4	Confident	14 Å²	14	47.3 Å²	47.3	7%	0.065	22%	0.223	C	C	.	.	H	α-helix	trans	-60.1	-40.7	175	178.8	72	0	0	0	112.2	L489 L490 V495 Y497 L498 L635 M638	L489-H493 VanDerWaalsContact O-CB 3.28Å; L489-H493 WeakPolarHBondContact O-CB 3.34Å; L489-H493 PolarHBondContact O-N 2.86Å; L490-H493 PolarHBondContact O-N 2.88Å; H493-V495 PolarHBondContact O-N 2.9Å; H493-Y497 AromaticContact CE1-CG 3.83Å; H493-Y497 AromaticContact ND1-CD2 3.49Å; H493-Y497 WeakPolarHBondContact ND1-CD2 3.37Å; H493-Y497 AromaticContact ND1-CG 3.54Å; H493-Y497 WeakPolarHBondContact O-CB 3.45Å; H493-Y497 PolarHBondContact O-N 2.77Å; H493-L498 PolarHBondContact O-N 2.7Å; H493-L635 HydrophobicContact CB-CD2 3.84Å; H493-M638 HydrophobicContact CB-SD 4.38Å
494	F	89.6	Confident	88.6	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-66.4	-34.9	178.6	-80	20.2	0	0	0	113.1	V480 L490 I491 L492 L498 L500 V574 F602 F604 V630	V480-F494 HydrophobicContact CG2-CE2 4.42Å; V480-F494 HydrophobicContact CG2-CZ 3.95Å; L490-F494 VanDerWaalsContact O-CD1 3.25Å; L490-F494 WeakPolarHBondContact O-CD1 3.31Å; L490-F494 WeakPolarHBondContact O-CG 3.34Å; L490-F494 PolarHBondContact O-N 2.88Å; I491-F494 PolarHBondContact O-N 3.31Å; L492-F494 VanDerWaalsContact C-N 3.32Å; L492-F494 PolarHBondContact O-N 2.76Å; F494-L498 HydrophobicContact CD1-CD1 3.53Å; F494-L498 HydrophobicContact CD1-CG 4.39Å; F494-L498 HydrophobicContact CE1-CD1 3.74Å; F494-L498 HydrophobicContact CG-CD1 4.08Å; F494-L498 HydrophobicContact CZ-CD1 4.45Å; F494-L500 HydrophobicContact CB-CD1 4.41Å; F494-L500 HydrophobicContact CD2-CD1 4.45Å; F494-L500 WeakPolarHBondContact O-CB 3.33Å; F494-L500 PolarHBondContact O-N 3.47Å; F494-V574 HydrophobicContact CD2-CG2 4.4Å; F494-F602 HydrophobicContact CD2-CD2 4.39Å; F494-F602 HydrophobicContact CD2-CG 4.38Å; F494-F602 HydrophobicContact CE2-CB 3.98Å; F494-F602 AromaticContact CE2-CD1 3.74Å; F494-F602 HydrophobicContact CE2-CD1 3.74Å; F494-F602 HydrophobicContact CE2-CD2 4.06Å; F494-F602 HydrophobicContact CE2-CE1 4.28Å; F494-F602 AromaticContact CE2-CG 3.64Å; F494-F602 HydrophobicContact CE2-CG 3.64Å; F494-F602 HydrophobicContact CZ-CD1 4.2Å; F494-F604 HydrophobicContact CD2-CE1 4.35Å; F494-F604 HydrophobicContact CD2-CZ 4.37Å; F494-F604 AromaticContact CE2-CE1 3.85Å; F494-F604 HydrophobicContact CE2-CE1 3.85Å; F494-F604 HydrophobicContact CE2-CZ 4.29Å; F494-F604 HydrophobicContact CZ-CE1 4.25Å; F494-V630 HydrophobicContact CE1-CG2 3.83Å; F494-V630 HydrophobicContact CZ-CG2 4.38Å
495	V	89.8	Confident	89	Confident	10 Å²	10	40.6 Å²	40.6	6%	0.061	19%	0.185	C	C	.	.	H	α-helix	trans	-77.3	-47.9	175.3	-177.9	0	0	0	0	111.6	I491 L492 H493 K499 I503 V526 Q553 L554	I491-V495 WeakPolarHBondContact O-CG2 3.35Å; I491-V495 PolarHBondContact O-N 3.01Å; I491-V495 VanDerWaalsContact O-N 3.15Å; L492-V495 PolarHBondContact O-N 3.43Å; H493-V495 PolarHBondContact O-N 2.9Å; V495-K499 VanDerWaalsContact O-CA 3.27Å; V495-K499 WeakPolarHBondContact O-CA 3.43Å; V495-K499 PolarHBondContact O-N 3.31Å; V495-I503 HydrophobicContact CG2-CD1 3.64Å; V495-V526 HydrophobicContact CB-CG1 4.49Å; V495-V526 HydrophobicContact CB-CG2 4.06Å; V495-V526 HydrophobicContact CG1-CB 4.36Å; V495-V526 HydrophobicContact CG1-CG1 3.86Å; V495-V526 HydrophobicContact CG1-CG2 3.71Å; V495-V526 HydrophobicContact CG2-CG1 4.45Å; V495-Q553 HydrophobicContact CG1-CB 4.4Å; V495-L554 HydrophobicContact CG2-CB 4.3Å; V495-L554 HydrophobicContact CG2-CD1 4.41Å; V495-L554 HydrophobicContact CG2-CD2 4.36Å
496	L	87	Confident	89.4	Confident	57 Å²	57	36.2 Å²	36.2	30%	0.298	16%	0.161	S	C	.	.	H	α-helix	trans	-82.9	-45	-169	-66.1	173.2	0	0	0	113.6	L492 F523 V526 M638	L492-L496 WeakPolarHBondContact O-CB 3.49Å; L492-L496 WeakPolarHBondContact O-CG 3.15Å; L492-L496 PolarHBondContact O-N 2.99Å; L496-F523 HydrophobicContact CD1-CE1 4.11Å; L496-V526 HydrophobicContact CD1-CG2 4.32Å; L496-V526 HydrophobicContact CD2-CG2 3.7Å; L496-V526 HydrophobicContact CG-CG2 3.86Å; L496-M638 HydrophobicContact CD1-CE 3.9Å
497	Y	84.4	Confident	89.7	Confident	130 Å²	130	32.7 Å²	32.7	51%	0.51	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-48	-173.4	-68.3	-100.2	0	0	0	112	H493 K499 M638	H493-Y497 AromaticContact CE1-CG 3.83Å; H493-Y497 AromaticContact ND1-CD2 3.49Å; H493-Y497 WeakPolarHBondContact ND1-CD2 3.37Å; H493-Y497 AromaticContact ND1-CG 3.54Å; H493-Y497 WeakPolarHBondContact O-CB 3.45Å; H493-Y497 PolarHBondContact O-N 2.77Å; Y497-K499 PolarHBondContact O-N 2.74Å; Y497-M638 HydrophobicContact CD2-SD 4.25Å; Y497-M638 HydrophobicContact CE2-CE 4.26Å; Y497-M638 HydrophobicContact CE2-CG 4.15Å; Y497-M638 HydrophobicContact CE2-SD 3.58Å; Y497-M638 VanDerWaalsContact CE2-SD 3.58Å
498	L	84.3	Confident	89.6	Confident	74 Å²	74	35.9 Å²	35.9	39%	0.387	16%	0.163	S	C	.	.	S	Bend	trans	-75.9	-7.8	174.6	-53.8	-175.9	0	0	0	112.7	H493 F494 L500	H493-L498 PolarHBondContact O-N 2.7Å; F494-L498 HydrophobicContact CD1-CD1 3.53Å; F494-L498 HydrophobicContact CD1-CG 4.39Å; F494-L498 HydrophobicContact CE1-CD1 3.74Å; F494-L498 HydrophobicContact CG-CD1 4.08Å; F494-L498 HydrophobicContact CZ-CD1 4.45Å; L498-L500 HydrophobicContact CB-CD1 4.18Å; L498-L500 HydrophobicContact CB-CG 3.91Å; L498-L500 HydrophobicContact CD1-CD1 4.33Å; L498-L500 PolarHBondContact O-N 2.85Å
499	K	85.8	Confident	89.5	Confident	160 Å²	160	37.2 Å²	37.2	70%	0.696	17%	0.173	S	C	*	.			trans	53.2	27.7	175.7	-63.2	177.3	-176.9	175.9	0	113.7	V495 Y497 R501	V495-K499 VanDerWaalsContact O-CA 3.27Å; V495-K499 WeakPolarHBondContact O-CA 3.43Å; V495-K499 PolarHBondContact O-N 3.31Å; Y497-K499 PolarHBondContact O-N 2.74Å; K499-R501 PolarHBondContact O-N 3.5Å
500	L	84.1	Confident	89.5	Confident	35 Å²	35	41.7 Å²	41.7	18%	0.183	19%	0.189	C	C	.	.			trans	-70.2	121.2	-179	-63.5	176.5	0	0	0	109.5	F494 L498 I503 L600 F602	F494-L500 HydrophobicContact CB-CD1 4.41Å; F494-L500 HydrophobicContact CD2-CD1 4.45Å; F494-L500 WeakPolarHBondContact O-CB 3.33Å; F494-L500 PolarHBondContact O-N 3.47Å; L498-L500 HydrophobicContact CB-CD1 4.18Å; L498-L500 HydrophobicContact CB-CG 3.91Å; L498-L500 HydrophobicContact CD1-CD1 4.33Å; L498-L500 PolarHBondContact O-N 2.85Å; L500-I503 HydrophobicContact CB-CD1 3.79Å; L500-I503 HydrophobicContact CB-CG1 4.09Å; L500-I503 WeakPolarHBondContact O-CD1 3.37Å; L500-I503 VanDerWaalsContact O-CG1 3.28Å; L500-I503 WeakPolarHBondContact O-CG1 3.43Å; L500-L600 HydrophobicContact CD2-CD1 4.29Å; L500-F602 HydrophobicContact CD1-CE2 3.98Å; L500-F602 HydrophobicContact CD1-CZ 4.42Å
501	R	84.4	Confident	89.4	Confident	166 Å²	166	45 Å²	45	63%	0.626	21%	0.205	S	C	*	.			trans	-157.3	141.3	178	58.4	-174.1	177.8	159.4	1.9	111.6	K499	K499-R501 PolarHBondContact O-N 3.5Å
502	P	89.9	Confident	89.4	Confident	26 Å²	26	45.6 Å²	45.6	17%	0.169	21%	0.208	C	C	.	.	S	Bend	cis	-75.3	148.5	-10.5	31.8	-34.7	0	0	0	112.3	F547 D569 C572	P502-F547 HydrophobicContact CB-CD2 4.36Å; P502-F547 HydrophobicContact CB-CE2 3.63Å; P502-F547 HydrophobicContact CB-CZ 3.78Å; P502-D569 WeakPolarHBondContact CG-O 3.19Å; P502-C572 PolarHBondContact O-N 3.17Å
503	I	92.8	Very high	89.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.6	174.5	-49.7	-172.7	0	0	0	110.6	I491 V495 L500 F547 Q553 L554 L555 C572 V574	I491-I503 HydrophobicContact CD1-CG2 4.45Å; V495-I503 HydrophobicContact CG2-CD1 3.64Å; L500-I503 HydrophobicContact CB-CD1 3.79Å; L500-I503 HydrophobicContact CB-CG1 4.09Å; L500-I503 WeakPolarHBondContact O-CD1 3.37Å; L500-I503 VanDerWaalsContact O-CG1 3.28Å; L500-I503 WeakPolarHBondContact O-CG1 3.43Å; I503-F547 WeakPolarHBondContact O-CZ 3.46Å; I503-Q553 PolarHBondContact N-O 2.98Å; I503-L554 HydrophobicContact CB-CD1 3.87Å; I503-L554 HydrophobicContact CG2-CD1 3.87Å; I503-L555 PolarHBondContact O-N 2.85Å; I503-C572 WeakPolarHBondContact CA-O 3.32Å; I503-C572 HydrophobicContact CG1-CB 4.14Å; I503-C572 HydrophobicContact CG2-CB 4.43Å; I503-V574 HydrophobicContact CG2-CB 4.27Å; I503-V574 HydrophobicContact CG2-CG2 3.62Å
504	L	93.4	Very high	89.7	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	115.7	165.1	-179.3	64.9	0	0	0	109.9	F506 L555 I567 V570 C572 V573 V574 R591	L504-F506 HydrophobicContact CD2-CE2 3.62Å; L504-F506 HydrophobicContact CD2-CZ 3.84Å; L504-F506 HydrophobicContact CG-CD2 4.36Å; L504-F506 HydrophobicContact CG-CE2 3.86Å; L504-F506 HydrophobicContact CG-CZ 4.34Å; L504-L555 HydrophobicContact CD1-CB 4.15Å; L504-L555 HydrophobicContact CD1-CD2 4.03Å; L504-L555 HydrophobicContact CD1-CG 4.18Å; L504-I567 HydrophobicContact CD1-CD1 4.31Å; L504-I567 HydrophobicContact CD2-CD1 4.37Å; L504-V570 HydrophobicContact CB-CG1 3.76Å; L504-C572 PolarHBondContact N-O 3.37Å; L504-V573 CarbonylContact O-C 3.59Å; L504-V573 WeakPolarHBondContact O-CA 3.42Å; L504-V574 PolarHBondContact O-N 3.31Å; L504-R591 HydrophobicContact CD2-CB 3.61Å; L504-R591 HydrophobicContact CD2-CG 3.67Å
505	C	94.8	Very high	89.8	Confident	0 Å²	0	49 Å²	49	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.7	-176.2	179.3	0	0	0	0	111.1	L554 L555 I556 S557 V574	C505-L554 HydrophobicContact CB-CD1 3.74Å; C505-L555 PolarHBondContact N-O 3Å; C505-I556 HydrophobicContact CB-CG1 4.26Å; C505-S557 PolarHBondContact O-N 2.83Å; C505-V574 CarbonylContact C-O 3.58Å; C505-V574 WeakPolarHBondContact CA-O 3.32Å
506	F	94.9	Very high	90	Very high	3 Å²	3	48.6 Å²	48.6	1%	0.013	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	126.8	-179.5	-77.2	-88	0	0	0	112.6	L504 S557 A562 V573 V574 Y576 D577 R588 R591	L504-F506 HydrophobicContact CD2-CE2 3.62Å; L504-F506 HydrophobicContact CD2-CZ 3.84Å; L504-F506 HydrophobicContact CG-CD2 4.36Å; L504-F506 HydrophobicContact CG-CE2 3.86Å; L504-F506 HydrophobicContact CG-CZ 4.34Å; F506-S557 WeakPolarHBondContact CA-O 3.36Å; F506-A562 HydrophobicContact CE1-CB 3.6Å; F506-A562 HydrophobicContact CZ-CB 3.91Å; F506-V573 HydrophobicContact CD2-CG1 3.86Å; F506-V573 HydrophobicContact CE2-CG1 3.91Å; F506-V574 PolarHBondContact N-O 2.85Å; F506-Y576 WeakPolarHBondContact O-CB 3.47Å; F506-Y576 PolarHBondContact O-N 3.09Å; F506-D577 PolarHBondContact O-N 3.16Å; F506-R588 HydrophobicContact CB-CG 4.48Å; F506-R588 HydrophobicContact CD1-CG 3.69Å; F506-R588 HydrophobicContact CD2-CB 3.91Å; F506-R588 HydrophobicContact CD2-CG 3.95Å; F506-R588 HydrophobicContact CE1-CB 4.35Å; F506-R588 HydrophobicContact CE1-CG 3.71Å; F506-R588 HydrophobicContact CE2-CB 3.73Å; F506-R588 HydrophobicContact CE2-CG 3.96Å; F506-R588 HydrophobicContact CG-CB 4.29Å; F506-R588 HydrophobicContact CG-CG 3.8Å; F506-R588 HydrophobicContact CZ-CB 3.96Å; F506-R588 HydrophobicContact CZ-CG 3.84Å; F506-R591 HydrophobicContact CE2-CG 4.19Å; F506-R591 HydrophobicContact CZ-CG 3.88Å
507	T	93.8	Very high	90.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	160.8	171.1	69	0	0	0	0	111.1	S509 T512 A513 L516 I556 S557 Y576	T507-S509 PolarHBondContact OG1-O 3.28Å; T507-T512 WeakPolarHBondContact CB-OG1 3.38Å; T507-T512 PolarHBondContact OG1-OG1 3.4Å; T507-A513 WeakPolarHBondContact OG1-CB 3.49Å; T507-A513 PolarHBondContact OG1-N 3.41Å; T507-L516 HydrophobicContact CG2-CD2 4.19Å; T507-I556 HydrophobicContact CG2-CG2 4.16Å; T507-S557 PolarHBondContact N-O 2.88Å; T507-Y576 HydrophobicContact CG2-CD1 3.97Å; T507-Y576 HydrophobicContact CG2-CG 4.27Å
508	N	88.8	Confident	90.7	Very high	68 Å²	68	43 Å²	43	36%	0.364	20%	0.195	S	C	.	.	S	Bend	trans	-84.6	-20.7	-176.3	-71.4	0.5	0	0	0	114.1	D577 A578 R588	N508-D577 HydrophobicContact CB-CB 4.11Å; N508-D577 VanDerWaalsContact CG-CB 3.42Å; N508-D577 PolarHBondContact N-OD2 3.28Å; N508-D577 WeakPolarHBondContact OD1-CB 3.18Å; N508-A578 PolarHBondContact ND2-O 3.18Å; N508-R588 PolarHBondContact OD1-NH2 3.31Å
509	S	89.4	Confident	91.1	Very high	29 Å²	29	39.5 Å²	39.5	20%	0.203	18%	0.177	C	C	.	.	S	Bend	trans	-130.7	155	-177.4	136.4	0	0	0	0	112.6	T507 E511 T512 A513 T558	T507-S509 PolarHBondContact OG1-O 3.28Å; S509-E511 VanDerWaalsContact C-N 3.26Å; S509-E511 PolarHBondContact O-N 2.9Å; S509-E511 WeakPolarHBondContact OG-CB 3.33Å; S509-E511 PolarHBondContact OG-N 3.46Å; S509-E511 PolarHBondContact OG-OE2 3.49Å; S509-T512 WeakPolarHBondContact CA-OG1 3.39Å; S509-T512 WeakPolarHBondContact CB-OG1 3.36Å; S509-T512 PolarHBondContact N-OG1 3.06Å; S509-T512 PolarHBondContact O-N 3.02Å; S509-T512 PolarHBondContact O-OG1 3.4Å; S509-T512 PolarHBondContact OG-N 2.99Å; S509-A513 PolarHBondContact O-N 3.18Å; S509-T558 WeakPolarHBondContact O-CG2 3.11Å
510	R	90.1	Very high	91.4	Very high	96 Å²	96	31.9 Å²	31.9	36%	0.362	14%	0.144	S	C	.	.	H	α-helix	trans	-65.5	-34.2	175.2	-65.8	168.7	68.1	-171.6	4.1	111.2	A513 H514 S533 R534 T558	R510-A513 PolarHBondContact O-N 2.89Å; R510-H514 VanDerWaalsContact O-CB 3.25Å; R510-H514 WeakPolarHBondContact O-CB 3.34Å; R510-H514 PolarHBondContact O-N 2.9Å; R510-S533 WeakPolarHBondContact CD-OG 3.11Å; R510-S533 PolarHBondContact NE-OG 3.04Å; R510-S533 VanDerWaalsContact NE-OG 3.14Å; R510-S533 PolarHBondContact NH2-O 3.13Å; R510-R534 VanDerWaalsContact NH2-N 3.16Å; R510-T558 HydrophobicContact CG-CG2 4.16Å
511	E	90.3	Very high	91.9	Very high	77 Å²	77	37 Å²	37	36%	0.36	16%	0.164	S	C	.	.	H	α-helix	trans	-70.9	-41.1	179.8	-59.8	52	-115.1	0	0	109.1	S509 H514 R515 R534	S509-E511 VanDerWaalsContact C-N 3.26Å; S509-E511 PolarHBondContact O-N 2.9Å; S509-E511 WeakPolarHBondContact OG-CB 3.33Å; S509-E511 PolarHBondContact OG-N 3.46Å; S509-E511 PolarHBondContact OG-OE2 3.49Å; E511-H514 PolarHBondContact O-N 3.34Å; E511-R515 WeakPolarHBondContact O-CB 3.23Å; E511-R515 VanDerWaalsContact O-CG 3.26Å; E511-R515 WeakPolarHBondContact O-CG 3.23Å; E511-R515 PolarHBondContact O-N 2.69Å; E511-R534 IonicContact OE1-NH2 2.76Å; E511-R534 PolarHBondContact OE1-NH2 3.08Å
512	T	90.9	Very high	92.2	Very high	11 Å²	11	32.2 Å²	32.2	7%	0.067	15%	0.151	C	C	.	.	H	α-helix	trans	-66.5	-39.4	172.9	52.1	0	0	0	0	112.4	V6 T507 S509 L516	V6-T512 HydrophobicContact CG2-CG2 3.6Å; T507-T512 WeakPolarHBondContact CB-OG1 3.38Å; T507-T512 PolarHBondContact OG1-OG1 3.4Å; S509-T512 WeakPolarHBondContact CA-OG1 3.39Å; S509-T512 WeakPolarHBondContact CB-OG1 3.36Å; S509-T512 PolarHBondContact N-OG1 3.06Å; S509-T512 PolarHBondContact O-N 3.02Å; S509-T512 PolarHBondContact O-OG1 3.4Å; S509-T512 PolarHBondContact OG-N 2.99Å; T512-L516 VanDerWaalsContact O-CB 3.27Å; T512-L516 WeakPolarHBondContact O-CB 3.49Å; T512-L516 PolarHBondContact O-N 2.89Å; T512-L516 VanDerWaalsContact O-N 3.1Å
513	A	92.4	Very high	92.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.2	-48.7	174.6	0	0	0	0	0	111.4	T507 S509 R510 L516 Y517 E530 I556 T558	T507-A513 WeakPolarHBondContact OG1-CB 3.49Å; T507-A513 PolarHBondContact OG1-N 3.41Å; S509-A513 PolarHBondContact O-N 3.18Å; R510-A513 PolarHBondContact O-N 2.89Å; A513-L516 PolarHBondContact O-N 2.94Å; A513-Y517 WeakPolarHBondContact O-CB 3.46Å; A513-Y517 PolarHBondContact O-N 2.94Å; A513-E530 HydrophobicContact CB-CG 4.42Å; A513-I556 HydrophobicContact CB-CG2 4.03Å; A513-T558 HydrophobicContact CB-CG2 4.05Å
514	H	92.8	Very high	91.9	Very high	29 Å²	29	33 Å²	33	13%	0.134	16%	0.16	C	C	.	.	H	α-helix	trans	-66.1	-48.7	-177.9	-170.1	66.7	0	0	0	112.4	R510 E511 L516 Y517 C518 E530 E656	R510-H514 VanDerWaalsContact O-CB 3.25Å; R510-H514 WeakPolarHBondContact O-CB 3.34Å; R510-H514 PolarHBondContact O-N 2.9Å; E511-H514 PolarHBondContact O-N 3.34Å; H514-L516 VanDerWaalsContact C-N 3.29Å; H514-L516 PolarHBondContact O-N 3.31Å; H514-Y517 PolarHBondContact O-N 2.99Å; H514-Y517 VanDerWaalsContact O-N 3.17Å; H514-C518 PolarHBondContact O-N 3.5Å; H514-C518 PolarHBondContact O-SG 2.85Å; H514-E530 IonicContact CE1-OE2 3.83Å; H514-E530 IonicContact CG-OE2 3.56Å; H514-E530 IonicContact ND1-OE2 3.69Å; H514-E530 PolarHBondContact ND1-OE2 2.91Å; H514-E656 IonicContact CD2-OE2 3.66Å; H514-E656 IonicContact NE2-OE1 3.17Å; H514-E656 IonicContact NE2-OE2 3.62Å; H514-E656 PolarHBondContact NE2-OE2 3.17Å
515	R	91.6	Very high	91.5	Very high	59 Å²	59	36.3 Å²	36.3	22%	0.223	20%	0.195	C	C	.	.	H	α-helix	trans	-57.7	-41.1	175.1	-71	-173.5	-165.2	156.2	14.6	112.1	L3 F4 L5 E511 L519 I653	L3-R515 PolarHBondContact O-NH1 2.7Å; F4-R515 HydrophobicContact CE1-CB 4.14Å; L5-R515 PolarHBondContact O-NH1 3.38Å; E511-R515 WeakPolarHBondContact O-CB 3.23Å; E511-R515 VanDerWaalsContact O-CG 3.26Å; E511-R515 WeakPolarHBondContact O-CG 3.23Å; E511-R515 PolarHBondContact O-N 2.69Å; R515-L519 WeakPolarHBondContact O-CB 3.43Å; R515-L519 PolarHBondContact O-N 3.19Å; R515-I653 HydrophobicContact CG-CD1 3.73Å
516	L	93.3	Very high	91.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-69.1	-39.3	178.2	-173.3	64.4	0	0	0	111.8	P488 I491 T507 T512 A513 H514 L519 V520 I556 Y576	P488-L516 HydrophobicContact CB-CD1 4.18Å; P488-L516 HydrophobicContact CG-CD1 4.39Å; I491-L516 HydrophobicContact CG2-CD1 4.19Å; T507-L516 HydrophobicContact CG2-CD2 4.19Å; T512-L516 VanDerWaalsContact O-CB 3.27Å; T512-L516 WeakPolarHBondContact O-CB 3.49Å; T512-L516 PolarHBondContact O-N 2.89Å; T512-L516 VanDerWaalsContact O-N 3.1Å; A513-L516 PolarHBondContact O-N 2.94Å; H514-L516 VanDerWaalsContact C-N 3.29Å; H514-L516 PolarHBondContact O-N 3.31Å; L516-L519 PolarHBondContact O-N 2.9Å; L516-V520 HydrophobicContact CD1-CG2 4.44Å; L516-V520 VanDerWaalsContact O-CG2 3.28Å; L516-V520 WeakPolarHBondContact O-CG2 3.47Å; L516-V520 PolarHBondContact O-N 3.39Å; L516-I556 HydrophobicContact CB-CD1 4.35Å; L516-I556 HydrophobicContact CD2-CD1 4.23Å; L516-I556 HydrophobicContact CD2-CG1 4.48Å; L516-I556 HydrophobicContact CD2-CG2 4.16Å; L516-I556 HydrophobicContact CG-CD1 3.96Å; L516-Y576 HydrophobicContact CD1-CD2 4.43Å; L516-Y576 HydrophobicContact CD1-CE2 3.76Å; L516-Y576 HydrophobicContact CD2-CD1 4.42Å; L516-Y576 HydrophobicContact CD2-CD2 3.65Å; L516-Y576 HydrophobicContact CD2-CE2 3.77Å; L516-Y576 HydrophobicContact CD2-CG 4Å; L516-Y576 HydrophobicContact CG-CE2 4.42Å
517	Y	94.6	Very high	91.1	Very high	59 Å²	59	42.4 Å²	42.4	23%	0.231	22%	0.224	C	C	.	.	H	α-helix	trans	-61.9	-48.7	173.9	163	-114.1	0	0	0	111.9	A513 H514 L519 V520 K521 A528 E530	A513-Y517 WeakPolarHBondContact O-CB 3.46Å; A513-Y517 PolarHBondContact O-N 2.94Å; H514-Y517 PolarHBondContact O-N 2.99Å; H514-Y517 VanDerWaalsContact O-N 3.17Å; Y517-L519 VanDerWaalsContact C-N 3.34Å; Y517-L519 PolarHBondContact O-N 3.13Å; Y517-V520 PolarHBondContact O-N 3.06Å; Y517-K521 VanDerWaalsContact O-CB 3.31Å; Y517-K521 WeakPolarHBondContact O-CB 3.39Å; Y517-K521 PolarHBondContact O-N 3.31Å; Y517-A528 HydrophobicContact CD2-CB 4.4Å; Y517-E530 HydrophobicContact CD1-CB 3.98Å; Y517-E530 HydrophobicContact CG-CB 3.94Å
518	C	92.4	Very high	91.1	Very high	12 Å²	12	43.3 Å²	43.3	8%	0.081	23%	0.231	C	C	.	.	H	α-helix	trans	-62.5	-40	177.3	-64.9	0	0	0	0	111.7	H514 K521 L522 L649	H514-C518 PolarHBondContact O-N 3.5Å; H514-C518 PolarHBondContact O-SG 2.85Å; C518-K521 PolarHBondContact O-N 3.2Å; C518-L522 WeakPolarHBondContact O-CB 3.46Å; C518-L522 WeakPolarHBondContact O-CG 3.47Å; C518-L522 PolarHBondContact O-N 2.82Å; C518-L649 HydrophobicContact CB-CD1 3.61Å
519	L	92.8	Very high	91.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.8	-50.9	174.2	-167.2	149.9	0	0	0	112.3	F4 P488 L492 R515 L516 Y517 K521 L522 F523 Y642 V645 L646 L649	F4-L519 HydrophobicContact CE2-CD1 3.94Å; F4-L519 HydrophobicContact CZ-CD1 3.66Å; P488-L519 HydrophobicContact CB-CD1 4.13Å; P488-L519 HydrophobicContact CB-CD2 4.07Å; P488-L519 HydrophobicContact CG-CD1 4.36Å; L492-L519 HydrophobicContact CD1-CD2 4.08Å; R515-L519 WeakPolarHBondContact O-CB 3.43Å; R515-L519 PolarHBondContact O-N 3.19Å; L516-L519 PolarHBondContact O-N 2.9Å; Y517-L519 VanDerWaalsContact C-N 3.34Å; Y517-L519 PolarHBondContact O-N 3.13Å; L519-K521 VanDerWaalsContact C-N 3.28Å; L519-K521 PolarHBondContact O-N 2.58Å; L519-L522 PolarHBondContact O-N 3.28Å; L519-F523 WeakPolarHBondContact O-CB 3.47Å; L519-F523 PolarHBondContact O-N 2.93Å; L519-Y642 HydrophobicContact CD1-CD2 4.36Å; L519-Y642 HydrophobicContact CD1-CE2 3.68Å; L519-Y642 HydrophobicContact CD2-CD2 4.23Å; L519-Y642 HydrophobicContact CD2-CE2 4.1Å; L519-Y642 HydrophobicContact CG-CE2 4.48Å; L519-V645 HydrophobicContact CG-CG1 4.22Å; L519-L646 HydrophobicContact CD1-CD2 3.74Å; L519-L649 HydrophobicContact CB-CD2 3.71Å; L519-L649 HydrophobicContact CD1-CD2 3.71Å; L519-L649 HydrophobicContact CG-CD2 4Å
520	V	93	Very high	91.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66.1	-33.6	-178.7	175.7	0	0	0	0	111.1	L492 L516 Y517 G524 V526 A528 L554	L492-V520 HydrophobicContact CD2-CB 4.33Å; L492-V520 HydrophobicContact CD2-CG1 3.95Å; L492-V520 HydrophobicContact CD2-CG2 3.94Å; L492-V520 HydrophobicContact CG-CG2 4.44Å; L516-V520 HydrophobicContact CD1-CG2 4.44Å; L516-V520 VanDerWaalsContact O-CG2 3.28Å; L516-V520 WeakPolarHBondContact O-CG2 3.47Å; L516-V520 PolarHBondContact O-N 3.39Å; Y517-V520 PolarHBondContact O-N 3.06Å; V520-G524 PolarHBondContact O-N 3.02Å; V520-V526 HydrophobicContact CG1-CB 3.67Å; V520-V526 HydrophobicContact CG1-CG1 3.64Å; V520-V526 HydrophobicContact CG1-CG2 4.35Å; V520-A528 HydrophobicContact CB-CB 4.21Å; V520-A528 HydrophobicContact CG1-CB 3.61Å; V520-L554 HydrophobicContact CG1-CD2 4.2Å; V520-L554 HydrophobicContact CG2-CD2 4.24Å
521	K	92.6	Very high	91.5	Very high	141 Å²	141	35.3 Å²	35.3	61%	0.613	20%	0.195	S	C	*	.	H	α-helix	trans	-66.6	-43.2	175	-173.7	-172.3	174.5	-164.3	0	112.3	Y517 C518 L519	Y517-K521 VanDerWaalsContact O-CB 3.31Å; Y517-K521 WeakPolarHBondContact O-CB 3.39Å; Y517-K521 PolarHBondContact O-N 3.31Å; C518-K521 PolarHBondContact O-N 3.2Å; L519-K521 VanDerWaalsContact C-N 3.28Å; L519-K521 PolarHBondContact O-N 2.58Å
522	L	91.3	Very high	91.3	Very high	66 Å²	66	31.7 Å²	31.7	35%	0.346	18%	0.177	S	C	.	.	H	α-helix	trans	-69.2	-40.9	176.9	-72.2	169.3	0	0	0	112	C518 L519 G524 V645 E648 L649 V652	C518-L522 WeakPolarHBondContact O-CB 3.46Å; C518-L522 WeakPolarHBondContact O-CG 3.47Å; C518-L522 PolarHBondContact O-N 2.82Å; L519-L522 PolarHBondContact O-N 3.28Å; L522-G524 PolarHBondContact O-N 3.35Å; L522-V645 HydrophobicContact CB-CG1 3.74Å; L522-E648 HydrophobicContact CD1-CB 4.31Å; L522-L649 HydrophobicContact CD1-CB 3.96Å; L522-L649 HydrophobicContact CD1-CD1 4.16Å; L522-V652 HydrophobicContact CD1-CG2 4.44Å
523	F	90.6	Very high	90.9	Very high	13 Å²	13	34.5 Å²	34.5	6%	0.057	20%	0.198	C	C	.	.	H	α-helix	trans	-62	-27.6	177	-166	-85.7	0	0	0	113.1	L492 L496 L519 M638 Q641 V645	L492-F523 HydrophobicContact CD1-CB 4.28Å; L492-F523 HydrophobicContact CD1-CD1 3.96Å; L492-F523 HydrophobicContact CD1-CD2 3.91Å; L492-F523 HydrophobicContact CD1-CE1 4.31Å; L492-F523 HydrophobicContact CD1-CE2 4.24Å; L492-F523 HydrophobicContact CD1-CG 3.77Å; L492-F523 HydrophobicContact CD1-CZ 4.44Å; L492-F523 HydrophobicContact CD2-CB 4.46Å; L492-F523 HydrophobicContact CD2-CD1 4.01Å; L492-F523 HydrophobicContact CD2-CG 4.33Å; L496-F523 HydrophobicContact CD1-CE1 4.11Å; L519-F523 WeakPolarHBondContact O-CB 3.47Å; L519-F523 PolarHBondContact O-N 2.93Å; F523-M638 HydrophobicContact CE1-CE 3.71Å; F523-M638 HydrophobicContact CZ-CB 4.23Å; F523-M638 HydrophobicContact CZ-CE 3.62Å; F523-Q641 HydrophobicContact CD2-CG 4.14Å; F523-Q641 HydrophobicContact CE2-CB 3.88Å; F523-Q641 HydrophobicContact CE2-CG 3.73Å; F523-Q641 HydrophobicContact CZ-CB 4.29Å; F523-Q641 HydrophobicContact CZ-CG 4.16Å; F523-Q641 VanDerWaalsContact CZ-OE1 3.3Å; F523-Q641 PolarHBondContact O-NE2 2.92Å; F523-V645 HydrophobicContact CB-CG1 4.35Å; F523-V645 HydrophobicContact CB-CG2 4.49Å; F523-V645 HydrophobicContact CD2-CG2 4.26Å
524	G	86.1	Confident	90.5	Very high	29 Å²	29	39.7 Å²	39.7	30%	0.299	22%	0.217	S	C	.	.			trans	74.4	-173.9	177.7	0	0	0	0	0	113.7	V520 L522 V526	V520-G524 PolarHBondContact O-N 3.02Å; L522-G524 PolarHBondContact O-N 3.35Å; G524-V526 PolarHBondContact O-N 2.85Å
525	G	84.2	Confident	90.1	Very high	71 Å²	71	40.3 Å²	40.3	73%	0.732	22%	0.221	S	C	*	.	S	Bend	trans	69.6	-23.2	-178.8	0	0	0	0	0	116.1
526	V	89.3	Confident	89.8	Confident	10 Å²	10	39.9 Å²	39.9	6%	0.061	23%	0.228	C	C	.	.	S	Bend	trans	-110.9	128.1	-177.2	176.5	0	0	0	0	111.5	L492 V495 L496 V520 G524 A528 L554	L492-V526 HydrophobicContact CD2-CG2 4.17Å; V495-V526 HydrophobicContact CB-CG1 4.49Å; V495-V526 HydrophobicContact CB-CG2 4.06Å; V495-V526 HydrophobicContact CG1-CB 4.36Å; V495-V526 HydrophobicContact CG1-CG1 3.86Å; V495-V526 HydrophobicContact CG1-CG2 3.71Å; V495-V526 HydrophobicContact CG2-CG1 4.45Å; L496-V526 HydrophobicContact CD1-CG2 4.32Å; L496-V526 HydrophobicContact CD2-CG2 3.7Å; L496-V526 HydrophobicContact CG-CG2 3.86Å; V520-V526 HydrophobicContact CG1-CB 3.67Å; V520-V526 HydrophobicContact CG1-CG1 3.64Å; V520-V526 HydrophobicContact CG1-CG2 4.35Å; G524-V526 PolarHBondContact O-N 2.85Å; V526-A528 HydrophobicContact CG1-CB 4.19Å; V526-A528 PolarHBondContact O-N 2.94Å; V526-A528 VanDerWaalsContact O-N 3.11Å; V526-L554 HydrophobicContact CG1-CB 4.07Å; V526-L554 HydrophobicContact CG1-CD2 4.43Å
527	Q	92.7	Very high	89	Confident	121 Å²	121	44.3 Å²	44.3	57%	0.565	26%	0.256	S	S	*	.			trans	-80.4	88.8	169	-66	-62.4	-35.7	0	0	109.8	K551 I552 Q553 L554	Q527-K551 VanDerWaalsContact CB-O 3.23Å; Q527-K551 WeakPolarHBondContact CB-O 3.42Å; Q527-I552 CarbonylContact O-C 3.6Å; Q527-Q553 HydrophobicContact CB-CG 4.16Å; Q527-Q553 PolarHBondContact O-N 2.89Å; Q527-L554 PolarHBondContact O-N 2.96Å
528	A	94	Very high	88.4	Confident	19 Å²	19	44 Å²	44	16%	0.157	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	155.7	179.3	0	0	0	0	0	113	Y517 V520 V526 L554	Y517-A528 HydrophobicContact CD2-CB 4.4Å; V520-A528 HydrophobicContact CB-CB 4.21Å; V520-A528 HydrophobicContact CG1-CB 3.61Å; V526-A528 HydrophobicContact CG1-CB 4.19Å; V526-A528 PolarHBondContact O-N 2.94Å; V526-A528 VanDerWaalsContact O-N 3.11Å; A528-L554 CarbonylContact C-O 3.48Å; A528-L554 VanDerWaalsContact CA-O 3.28Å; A528-L554 WeakPolarHBondContact CA-O 3.43Å; A528-L554 HydrophobicContact CB-CB 4.31Å; A528-L554 HydrophobicContact CB-CD2 4.42Å
529	A	93.7	Very high	88.2	Confident	12 Å²	12	47.8 Å²	47.8	10%	0.099	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	147	168.3	0	0	0	0	0	111.9	T543 I552 L554 L555 I556	A529-T543 HydrophobicContact CB-CG2 3.64Å; A529-I552 HydrophobicContact CB-CD1 3.71Å; A529-I552 HydrophobicContact CB-CG1 4.15Å; A529-I552 HydrophobicContact CB-CG2 3.96Å; A529-L554 PolarHBondContact N-O 2.89Å; A529-L555 HydrophobicContact CB-CD1 4.12Å; A529-I556 PolarHBondContact O-N 2.94Å
530	E	93.5	Very high	87.8	Confident	10 Å²	10	49.3 Å²	49.3	5%	0.047	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	146.1	167.8	-165.1	-171	149.9	0	0	111	A513 H514 Y517 S532 L535 I556	A513-E530 HydrophobicContact CB-CG 4.42Å; H514-E530 IonicContact CE1-OE2 3.83Å; H514-E530 IonicContact CG-OE2 3.56Å; H514-E530 IonicContact ND1-OE2 3.69Å; H514-E530 PolarHBondContact ND1-OE2 2.91Å; Y517-E530 HydrophobicContact CD1-CB 3.98Å; Y517-E530 HydrophobicContact CG-CB 3.94Å; E530-S532 WeakPolarHBondContact OE1-CB 3.47Å; E530-S532 PolarHBondContact OE1-OG 3.03Å; E530-L535 WeakPolarHBondContact O-CD1 3.27Å; E530-I556 CarbonylContact C-O 3.51Å; E530-I556 WeakPolarHBondContact CA-O 3.14Å
531	F	89.8	Confident	87.4	Confident	3 Å²	3	55.6 Å²	55.6	1%	0.013	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	84.8	164.5	-163.6	-88.4	0	0	0	110.2	R540 L544 L555 I556 S557 A561 I565	F531-R540 HydrophobicContact CD2-CB 4.34Å; F531-R540 HydrophobicContact CD2-CG 4.19Å; F531-R540 HydrophobicContact CE2-CB 3.49Å; F531-R540 VanDerWaalsContact CE2-CB 3.49Å; F531-R540 HydrophobicContact CE2-CG 3.73Å; F531-R540 HydrophobicContact CZ-CB 3.88Å; F531-R540 HydrophobicContact CZ-CG 4.07Å; F531-L544 HydrophobicContact CD2-CD2 4.37Å; F531-L544 HydrophobicContact CD2-CG 4.26Å; F531-L544 HydrophobicContact CE2-CD1 3.75Å; F531-L544 HydrophobicContact CE2-CD2 4.01Å; F531-L544 HydrophobicContact CE2-CG 3.62Å; F531-L544 HydrophobicContact CZ-CD1 3.93Å; F531-L544 HydrophobicContact CZ-CD2 4.45Å; F531-L544 HydrophobicContact CZ-CG 4.24Å; F531-L555 HydrophobicContact CB-CD1 3.93Å; F531-L555 HydrophobicContact CB-CG 4.17Å; F531-I556 PolarHBondContact N-O 3.03Å; F531-S557 WeakPolarHBondContact O-CA 3.29Å; F531-S557 PolarHBondContact O-OG 3.45Å; F531-A561 HydrophobicContact CD1-CB 3.67Å; F531-A561 HydrophobicContact CE1-CB 3.83Å; F531-A561 WeakPolarHBondContact CE1-O 3.45Å; F531-A561 WeakPolarHBondContact O-CB 3.25Å; F531-I565 HydrophobicContact CD1-CD1 4.3Å; F531-I565 HydrophobicContact CE1-CD1 3.3Å; F531-I565 HydrophobicContact CE2-CD1 4.46Å; F531-I565 HydrophobicContact CZ-CD1 3.4Å
532	S	86.3	Confident	87.2	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.32	C	S	.	.	S	Bend	trans	-133.8	171	173.5	96.4	0	0	0	0	111.1	E530 R534 L535 R540	E530-S532 WeakPolarHBondContact OE1-CB 3.47Å; E530-S532 PolarHBondContact OE1-OG 3.03Å; S532-R534 PolarHBondContact O-N 2.84Å; S532-R534 WeakPolarHBondContact OG-CB 3.46Å; S532-R534 PolarHBondContact OG-N 3.31Å; S532-L535 PolarHBondContact O-N 3.1Å; S532-R540 WeakPolarHBondContact O-CD 3.39Å
533	S	82.9	Confident	87.1	Confident	71 Å²	71	53.3 Å²	53.3	50%	0.497	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	8.7	172.9	49	0	0	0	0	114.5	R510	R510-S533 WeakPolarHBondContact CD-OG 3.11Å; R510-S533 PolarHBondContact NE-OG 3.04Å; R510-S533 VanDerWaalsContact NE-OG 3.14Å; R510-S533 PolarHBondContact NH2-O 3.13Å
534	R	83.5	Confident	87	Confident	109 Å²	109	54 Å²	54	41%	0.411	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-35.4	160.4	-70.1	-179.2	177.8	-103.2	-11.5	111.4	R510 E511 S532	R510-R534 VanDerWaalsContact NH2-N 3.16Å; E511-R534 IonicContact OE1-NH2 2.76Å; E511-R534 PolarHBondContact OE1-NH2 3.08Å; S532-R534 PolarHBondContact O-N 2.84Å; S532-R534 WeakPolarHBondContact OG-CB 3.46Å; S532-R534 PolarHBondContact OG-N 3.31Å
535	L	84.1	Confident	87	Confident	41 Å²	41	58.2 Å²	58.2	22%	0.215	32%	0.323	C	S	.	.	S	Bend	trans	-83.1	141.3	-178	-64.6	-178.2	0	0	0	112.8	E530 S532 E539 R540	E530-L535 WeakPolarHBondContact O-CD1 3.27Å; S532-L535 PolarHBondContact O-N 3.1Å; L535-E539 HydrophobicContact CB-CB 4.25Å; L535-R540 HydrophobicContact CB-CG 3.54Å; L535-R540 HydrophobicContact CD1-CG 4.33Å; L535-R540 PolarHBondContact O-NE 3.02Å
536	S	84.4	Confident	87.3	Confident	51 Å²	51	56.2 Å²	56.2	36%	0.357	30%	0.296	S	S	.	.			trans	-62.1	159.6	175.3	72.4	0	0	0	0	112.1	G538 E539 R540	S536-G538 PolarHBondContact O-N 3.02Å; S536-E539 WeakPolarHBondContact CA-OE2 3.4Å; S536-E539 WeakPolarHBondContact CB-OE2 3.39Å; S536-E539 PolarHBondContact N-OE2 2.77Å; S536-E539 PolarHBondContact O-N 2.86Å; S536-E539 WeakPolarHBondContact OG-CG 3.48Å; S536-E539 PolarHBondContact OG-N 3Å; S536-E539 PolarHBondContact OG-OE2 2.9Å; S536-R540 WeakPolarHBondContact O-CB 3.45Å; S536-R540 WeakPolarHBondContact O-CG 3.22Å; S536-R540 PolarHBondContact O-N 2.72Å
537	P	78	Confident	87.4	Confident	93 Å²	93	56 Å²	56	60%	0.604	29%	0.294	S	S	*	.	H	α-helix	trans	-58.7	-28.9	174.9	-23.6	34.5	0	0	0	113.7	K541	P537-K541 WeakPolarHBondContact O-CB 3.18Å; P537-K541 PolarHBondContact O-N 3.01Å
538	G	82.4	Confident	87.1	Confident	51 Å²	51	55.4 Å²	55.4	53%	0.526	29%	0.291	S	S	.	.	H	α-helix	trans	-70.7	-49	176.9	0	0	0	0	0	112.2	S536 K541 K542	S536-G538 PolarHBondContact O-N 3.02Å; G538-K541 WeakPolarHBondContact O-CB 3.27Å; G538-K541 PolarHBondContact O-N 3.03Å; G538-K542 PolarHBondContact O-N 2.9Å; G538-K542 VanDerWaalsContact O-N 3.07Å
539	E	87.4	Confident	86.8	Confident	93 Å²	93	62 Å²	62	44%	0.435	32%	0.316	S	S	.	.	H	α-helix	trans	-62.5	-46.3	175.9	-68.3	160.2	119	0	0	111.1	L535 S536 K541 K542 T543	L535-E539 HydrophobicContact CB-CB 4.25Å; S536-E539 WeakPolarHBondContact CA-OE2 3.4Å; S536-E539 WeakPolarHBondContact CB-OE2 3.39Å; S536-E539 PolarHBondContact N-OE2 2.77Å; S536-E539 PolarHBondContact O-N 2.86Å; S536-E539 WeakPolarHBondContact OG-CG 3.48Å; S536-E539 PolarHBondContact OG-N 3Å; S536-E539 PolarHBondContact OG-OE2 2.9Å; E539-K541 PolarHBondContact O-N 3.21Å; E539-K542 CarbonylContact O-C 3.47Å; E539-K542 WeakPolarHBondContact O-CA 3.31Å; E539-K542 WeakPolarHBondContact O-CB 3.37Å; E539-K542 PolarHBondContact O-N 3.35Å; E539-T543 PolarHBondContact O-N 3.4Å; E539-T543 PolarHBondContact O-OG1 2.98Å; E539-T543 VanDerWaalsContact O-OG1 3.1Å
540	R	84.9	Confident	86.5	Confident	31 Å²	31	63.8 Å²	63.8	12%	0.117	34%	0.336	C	S	.	.	H	α-helix	trans	-57.7	-37.6	177.2	-71.9	-169.1	-68	122.6	4.7	112.4	E287 F531 S532 L535 S536 L544	E287-R540 IonicContact OE1-CZ 2.76Å; E287-R540 IonicContact OE1-NH1 3.37Å; E287-R540 PolarHBondContact OE1-NH1 3.1Å; E287-R540 IonicContact OE1-NH2 3.45Å; E287-R540 PolarHBondContact OE1-NH2 2.83Å; F531-R540 HydrophobicContact CD2-CB 4.34Å; F531-R540 HydrophobicContact CD2-CG 4.19Å; F531-R540 HydrophobicContact CE2-CB 3.49Å; F531-R540 VanDerWaalsContact CE2-CB 3.49Å; F531-R540 HydrophobicContact CE2-CG 3.73Å; F531-R540 HydrophobicContact CZ-CB 3.88Å; F531-R540 HydrophobicContact CZ-CG 4.07Å; S532-R540 WeakPolarHBondContact O-CD 3.39Å; L535-R540 HydrophobicContact CB-CG 3.54Å; L535-R540 HydrophobicContact CD1-CG 4.33Å; L535-R540 PolarHBondContact O-NE 3.02Å; S536-R540 WeakPolarHBondContact O-CB 3.45Å; S536-R540 WeakPolarHBondContact O-CG 3.22Å; S536-R540 PolarHBondContact O-N 2.72Å; R540-L544 WeakPolarHBondContact O-CG 3.31Å; R540-L544 PolarHBondContact O-N 3.2Å; R540-L544 VanDerWaalsContact O-N 3.11Å
541	K	83.4	Confident	86.3	Confident	132 Å²	132	69.1 Å²	69.1	57%	0.574	36%	0.359	S	S	*	.	H	α-helix	trans	-68.5	-29.1	172.7	-176	-179.3	178.1	-176.9	0	113.3	P537 G538 E539 K545	P537-K541 WeakPolarHBondContact O-CB 3.18Å; P537-K541 PolarHBondContact O-N 3.01Å; G538-K541 WeakPolarHBondContact O-CB 3.27Å; G538-K541 PolarHBondContact O-N 3.03Å; E539-K541 PolarHBondContact O-N 3.21Å; K541-K545 WeakPolarHBondContact O-CG 3.36Å
542	K	88.7	Confident	86.4	Confident	141 Å²	141	70 Å²	70	61%	0.613	36%	0.364	S	S	*	.	H	α-helix	trans	-74.7	-51.5	172.8	-176.6	-174.8	175.4	-172.6	0	111	G538 E539 L544 K545 D546	G538-K542 PolarHBondContact O-N 2.9Å; G538-K542 VanDerWaalsContact O-N 3.07Å; E539-K542 CarbonylContact O-C 3.47Å; E539-K542 WeakPolarHBondContact O-CA 3.31Å; E539-K542 WeakPolarHBondContact O-CB 3.37Å; E539-K542 PolarHBondContact O-N 3.35Å; K542-L544 VanDerWaalsContact C-N 3.32Å; K542-L544 PolarHBondContact O-N 3.16Å; K542-K545 WeakPolarHBondContact O-CB 3.23Å; K542-K545 PolarHBondContact O-N 2.95Å; K542-D546 PolarHBondContact O-N 3.27Å
543	T	90.3	Very high	86.7	Confident	18 Å²	18	72.1 Å²	72.1	11%	0.11	37%	0.374	C	S	.	.	H	α-helix	trans	-55.9	-44.2	179.8	-52.4	0	0	0	0	112	A529 E539 D546 F547 I552 L555	A529-T543 HydrophobicContact CB-CG2 3.64Å; E539-T543 PolarHBondContact O-N 3.4Å; E539-T543 PolarHBondContact O-OG1 2.98Å; E539-T543 VanDerWaalsContact O-OG1 3.1Å; T543-D546 PolarHBondContact O-N 3.44Å; T543-F547 WeakPolarHBondContact O-CB 3.37Å; T543-F547 PolarHBondContact O-N 3.34Å; T543-I552 HydrophobicContact CG2-CD1 3.81Å; T543-I552 WeakPolarHBondContact O-CD1 3.36Å; T543-L555 HydrophobicContact CG2-CD1 3.58Å
544	L	86.8	Confident	87.2	Confident	29 Å²	29	68.8 Å²	68.8	15%	0.152	35%	0.35	C	S	.	.	H	α-helix	trans	-61.1	-46	175.1	-71.6	167.6	0	0	0	112	F531 R540 K542 D546 F547 E548 L555 I565 I567	F531-L544 HydrophobicContact CD2-CD2 4.37Å; F531-L544 HydrophobicContact CD2-CG 4.26Å; F531-L544 HydrophobicContact CE2-CD1 3.75Å; F531-L544 HydrophobicContact CE2-CD2 4.01Å; F531-L544 HydrophobicContact CE2-CG 3.62Å; F531-L544 HydrophobicContact CZ-CD1 3.93Å; F531-L544 HydrophobicContact CZ-CD2 4.45Å; F531-L544 HydrophobicContact CZ-CG 4.24Å; R540-L544 WeakPolarHBondContact O-CG 3.31Å; R540-L544 PolarHBondContact O-N 3.2Å; R540-L544 VanDerWaalsContact O-N 3.11Å; K542-L544 VanDerWaalsContact C-N 3.32Å; K542-L544 PolarHBondContact O-N 3.16Å; L544-D546 VanDerWaalsContact C-N 3.33Å; L544-D546 PolarHBondContact O-N 3.45Å; L544-F547 PolarHBondContact O-N 3.17Å; L544-E548 WeakPolarHBondContact O-CB 3.39Å; L544-E548 VanDerWaalsContact O-CG 3.29Å; L544-E548 WeakPolarHBondContact O-CG 3.36Å; L544-E548 PolarHBondContact O-N 3.15Å; L544-L555 HydrophobicContact CD2-CD2 4.38Å; L544-I565 HydrophobicContact CD1-CD1 4.24Å; L544-I565 HydrophobicContact CD1-CG2 4.23Å; L544-I565 HydrophobicContact CD2-CG2 4.01Å; L544-I567 HydrophobicContact CD2-CD1 3.96Å; L544-I567 HydrophobicContact CD2-CG1 4.14Å
545	K	87.6	Confident	87.7	Confident	117 Å²	117	63.6 Å²	63.6	51%	0.509	33%	0.331	S	S	.	.	H	α-helix	trans	-62.1	-37.1	176.6	-79.7	-175.8	168.4	-161.6	0	113.3	K541 K542 K549	K541-K545 WeakPolarHBondContact O-CG 3.36Å; K542-K545 WeakPolarHBondContact O-CB 3.23Å; K542-K545 PolarHBondContact O-N 2.95Å; K545-K549 WeakPolarHBondContact O-CB 3.42Å; K545-K549 WeakPolarHBondContact O-CG 3.26Å; K545-K549 PolarHBondContact O-N 2.74Å
546	D	90.9	Very high	88.2	Confident	28 Å²	28	61.7 Å²	61.7	15%	0.15	32%	0.321	C	S	.	.	H	α-helix	trans	-78	-22.1	179.4	-74.3	-37.9	0	0	0	112.2	K542 T543 L544 K551 I552	K542-D546 PolarHBondContact O-N 3.27Å; T543-D546 PolarHBondContact O-N 3.44Å; L544-D546 VanDerWaalsContact C-N 3.33Å; L544-D546 PolarHBondContact O-N 3.45Å; D546-K551 HydrophobicContact CB-CD 4.15Å; D546-K551 WeakPolarHBondContact O-CB 3.45Å; D546-K551 PolarHBondContact O-N 2.88Å; D546-K551 WeakPolarHBondContact OD1-CD 3.49Å; D546-K551 VanDerWaalsContact OD1-CE 3.29Å; D546-K551 WeakPolarHBondContact OD1-CE 3.34Å; D546-K551 IonicContact OD1-NZ 2.78Å; D546-K551 PolarHBondContact OD1-NZ 3.11Å; D546-I552 HydrophobicContact CB-CD1 3.87Å; D546-I552 HydrophobicContact CB-CG1 4.43Å; D546-I552 PolarHBondContact O-N 2.9Å
547	F	90.1	Very high	88.6	Confident	6 Å²	6	59.2 Å²	59.2	3%	0.026	30%	0.304	C	S	.	.	H	α-helix	trans	-78.8	-43.9	168.5	-171.5	-120.5	0	0	0	112.3	P502 I503 T543 L544 K549 G550 I552 L555 I567 V570	P502-F547 HydrophobicContact CB-CD2 4.36Å; P502-F547 HydrophobicContact CB-CE2 3.63Å; P502-F547 HydrophobicContact CB-CZ 3.78Å; I503-F547 WeakPolarHBondContact O-CZ 3.46Å; T543-F547 WeakPolarHBondContact O-CB 3.37Å; T543-F547 PolarHBondContact O-N 3.34Å; L544-F547 PolarHBondContact O-N 3.17Å; F547-K549 PolarHBondContact O-N 2.9Å; F547-G550 WeakPolarHBondContact O-CA 3.34Å; F547-G550 PolarHBondContact O-N 2.73Å; F547-I552 HydrophobicContact CB-CB 4.25Å; F547-I552 HydrophobicContact CB-CD1 4.38Å; F547-I552 HydrophobicContact CD2-CB 3.91Å; F547-I552 HydrophobicContact CD2-CG2 3.78Å; F547-I552 VanDerWaalsContact CD2-O 3.31Å; F547-I552 WeakPolarHBondContact CD2-O 3.44Å; F547-I552 HydrophobicContact CE2-CG2 4.44Å; F547-L555 HydrophobicContact CB-CD2 4.37Å; F547-L555 HydrophobicContact CD1-CB 4.2Å; F547-L555 HydrophobicContact CD1-CD2 3.57Å; F547-L555 HydrophobicContact CD1-CG 4.49Å; F547-L555 HydrophobicContact CD2-CB 3.8Å; F547-L555 HydrophobicContact CD2-CD2 4.48Å; F547-L555 HydrophobicContact CE1-CB 3.99Å; F547-L555 HydrophobicContact CE1-CD2 3.83Å; F547-L555 HydrophobicContact CE2-CB 3.58Å; F547-L555 HydrophobicContact CG-CB 4.11Å; F547-L555 HydrophobicContact CG-CD2 3.92Å; F547-L555 HydrophobicContact CZ-CB 3.67Å; F547-L555 HydrophobicContact CZ-CD2 4.4Å; F547-I567 HydrophobicContact CD1-CD1 4.35Å; F547-I567 HydrophobicContact CD1-CG2 3.7Å; F547-I567 HydrophobicContact CE1-CD1 4.25Å; F547-I567 HydrophobicContact CE1-CG2 3.81Å; F547-V570 HydrophobicContact CE1-CG2 4.1Å
548	E	86.3	Confident	89.2	Confident	109 Å²	109	55.2 Å²	55.2	51%	0.509	28%	0.277	S	S	.	.	H	α-helix	trans	-56.2	-36.1	170.4	-73.7	169.6	167.5	0	0	111.8	L544 G550	L544-E548 WeakPolarHBondContact O-CB 3.39Å; L544-E548 VanDerWaalsContact O-CG 3.29Å; L544-E548 WeakPolarHBondContact O-CG 3.36Å; L544-E548 PolarHBondContact O-N 3.15Å; E548-G550 VanDerWaalsContact C-N 3.26Å; E548-G550 PolarHBondContact O-N 3.01Å
549	K	88.3	Confident	89.1	Confident	156 Å²	156	54 Å²	54	68%	0.678	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	2.8	174	-72.9	179.3	176.1	-161.1	0	114.5	K545 F547 K551	K545-K549 WeakPolarHBondContact O-CB 3.42Å; K545-K549 WeakPolarHBondContact O-CG 3.26Å; K545-K549 PolarHBondContact O-N 2.74Å; F547-K549 PolarHBondContact O-N 2.9Å; K549-K551 HydrophobicContact CB-CG 4.43Å; K549-K551 PolarHBondContact O-N 2.72Å
550	G	86.6	Confident	88.5	Confident	50 Å²	50	53 Å²	53	52%	0.515	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	12	178.2	0	0	0	0	0	115.9	F547 E548	F547-G550 WeakPolarHBondContact O-CA 3.34Å; F547-G550 PolarHBondContact O-N 2.73Å; E548-G550 VanDerWaalsContact C-N 3.26Å; E548-G550 PolarHBondContact O-N 3.01Å
551	K	90.2	Very high	88	Confident	123 Å²	123	52 Å²	52	54%	0.535	26%	0.264	S	S	.	.			trans	-69.4	-43.8	174.6	-58.4	-177.6	-175	167.9	0	110.8	Q527 D546 K549	Q527-K551 VanDerWaalsContact CB-O 3.23Å; Q527-K551 WeakPolarHBondContact CB-O 3.42Å; D546-K551 HydrophobicContact CB-CD 4.15Å; D546-K551 WeakPolarHBondContact O-CB 3.45Å; D546-K551 PolarHBondContact O-N 2.88Å; D546-K551 WeakPolarHBondContact OD1-CD 3.49Å; D546-K551 VanDerWaalsContact OD1-CE 3.29Å; D546-K551 WeakPolarHBondContact OD1-CE 3.34Å; D546-K551 IonicContact OD1-NZ 2.78Å; D546-K551 PolarHBondContact OD1-NZ 3.11Å; K549-K551 HydrophobicContact CB-CG 4.43Å; K549-K551 PolarHBondContact O-N 2.72Å
552	I	91.4	Very high	87.3	Confident	20 Å²	20	45.8 Å²	45.8	10%	0.103	24%	0.238	C	C	.	.			trans	-84	124.7	174.5	-62.8	160.1	0	0	0	107.3	Q527 A529 T543 D546 F547 L554	Q527-I552 CarbonylContact O-C 3.6Å; A529-I552 HydrophobicContact CB-CD1 3.71Å; A529-I552 HydrophobicContact CB-CG1 4.15Å; A529-I552 HydrophobicContact CB-CG2 3.96Å; T543-I552 HydrophobicContact CG2-CD1 3.81Å; T543-I552 WeakPolarHBondContact O-CD1 3.36Å; D546-I552 HydrophobicContact CB-CD1 3.87Å; D546-I552 HydrophobicContact CB-CG1 4.43Å; D546-I552 PolarHBondContact O-N 2.9Å; F547-I552 HydrophobicContact CB-CB 4.25Å; F547-I552 HydrophobicContact CB-CD1 4.38Å; F547-I552 HydrophobicContact CD2-CB 3.91Å; F547-I552 HydrophobicContact CD2-CG2 3.78Å; F547-I552 VanDerWaalsContact CD2-O 3.31Å; F547-I552 WeakPolarHBondContact CD2-O 3.44Å; F547-I552 HydrophobicContact CE2-CG2 4.44Å; I552-L554 WeakPolarHBondContact CG2-O 3.46Å
553	Q	92	Very high	86.6	Confident	45 Å²	45	40.7 Å²	40.7	21%	0.21	22%	0.215	C	C	.	.	S	Bend	trans	-88.9	-35.2	178.9	-64.5	166.4	1	0	0	111.3	V495 I503 Q527	V495-Q553 HydrophobicContact CG1-CB 4.4Å; I503-Q553 PolarHBondContact N-O 2.98Å; Q527-Q553 HydrophobicContact CB-CG 4.16Å; Q527-Q553 PolarHBondContact O-N 2.89Å
554	L	93.8	Very high	85.4	Confident	1 Å²	1	40 Å²	40	1%	0.005	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	110.7	-176.6	179.7	67.1	0	0	0	110.7	I491 V495 I503 C505 V520 V526 Q527 A528 A529 I552 I556	I491-L554 HydrophobicContact CD1-CD1 3.89Å; I491-L554 HydrophobicContact CG1-CD1 4Å; I491-L554 HydrophobicContact CG1-CD2 4.01Å; V495-L554 HydrophobicContact CG2-CB 4.3Å; V495-L554 HydrophobicContact CG2-CD1 4.41Å; V495-L554 HydrophobicContact CG2-CD2 4.36Å; I503-L554 HydrophobicContact CB-CD1 3.87Å; I503-L554 HydrophobicContact CG2-CD1 3.87Å; C505-L554 HydrophobicContact CB-CD1 3.74Å; V520-L554 HydrophobicContact CG1-CD2 4.2Å; V520-L554 HydrophobicContact CG2-CD2 4.24Å; V526-L554 HydrophobicContact CG1-CB 4.07Å; V526-L554 HydrophobicContact CG1-CD2 4.43Å; Q527-L554 PolarHBondContact O-N 2.96Å; A528-L554 CarbonylContact C-O 3.48Å; A528-L554 VanDerWaalsContact CA-O 3.28Å; A528-L554 WeakPolarHBondContact CA-O 3.43Å; A528-L554 HydrophobicContact CB-CB 4.31Å; A528-L554 HydrophobicContact CB-CD2 4.42Å; A529-L554 PolarHBondContact N-O 2.89Å; I552-L554 WeakPolarHBondContact CG2-O 3.46Å; L554-I556 HydrophobicContact CD2-CD1 4.08Å; L554-I556 HydrophobicContact CD2-CG1 4.13Å; L554-I556 HydrophobicContact CG-CD1 4.43Å; L554-I556 HydrophobicContact CG-CG1 3.99Å
555	L	93.8	Very high	84.8	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	113.8	173.9	-171.2	63.9	0	0	0	109.9	I503 L504 C505 A529 F531 T543 L544 F547 I567	I503-L555 PolarHBondContact O-N 2.85Å; L504-L555 HydrophobicContact CD1-CB 4.15Å; L504-L555 HydrophobicContact CD1-CD2 4.03Å; L504-L555 HydrophobicContact CD1-CG 4.18Å; C505-L555 PolarHBondContact N-O 3Å; A529-L555 HydrophobicContact CB-CD1 4.12Å; F531-L555 HydrophobicContact CB-CD1 3.93Å; F531-L555 HydrophobicContact CB-CG 4.17Å; T543-L555 HydrophobicContact CG2-CD1 3.58Å; L544-L555 HydrophobicContact CD2-CD2 4.38Å; F547-L555 HydrophobicContact CB-CD2 4.37Å; F547-L555 HydrophobicContact CD1-CB 4.2Å; F547-L555 HydrophobicContact CD1-CD2 3.57Å; F547-L555 HydrophobicContact CD1-CG 4.49Å; F547-L555 HydrophobicContact CD2-CB 3.8Å; F547-L555 HydrophobicContact CD2-CD2 4.48Å; F547-L555 HydrophobicContact CE1-CB 3.99Å; F547-L555 HydrophobicContact CE1-CD2 3.83Å; F547-L555 HydrophobicContact CE2-CB 3.58Å; F547-L555 HydrophobicContact CG-CB 4.11Å; F547-L555 HydrophobicContact CG-CD2 3.92Å; F547-L555 HydrophobicContact CZ-CB 3.67Å; F547-L555 HydrophobicContact CZ-CD2 4.4Å; L555-I567 HydrophobicContact CD2-CD1 4.08Å
556	I	94.8	Very high	84.1	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	111.9	-176.9	-58.5	164.8	0	0	0	109.1	C505 T507 A513 L516 A529 E530 F531 L554	C505-I556 HydrophobicContact CB-CG1 4.26Å; T507-I556 HydrophobicContact CG2-CG2 4.16Å; A513-I556 HydrophobicContact CB-CG2 4.03Å; L516-I556 HydrophobicContact CB-CD1 4.35Å; L516-I556 HydrophobicContact CD2-CD1 4.23Å; L516-I556 HydrophobicContact CD2-CG1 4.48Å; L516-I556 HydrophobicContact CD2-CG2 4.16Å; L516-I556 HydrophobicContact CG-CD1 3.96Å; A529-I556 PolarHBondContact O-N 2.94Å; E530-I556 CarbonylContact C-O 3.51Å; E530-I556 WeakPolarHBondContact CA-O 3.14Å; F531-I556 PolarHBondContact N-O 3.03Å; L554-I556 HydrophobicContact CD2-CD1 4.08Å; L554-I556 HydrophobicContact CD2-CG1 4.13Å; L554-I556 HydrophobicContact CG-CD1 4.43Å; L554-I556 HydrophobicContact CG-CG1 3.99Å
557	S	92.7	Very high	83.3	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	158.3	-173.2	-172.2	0	0	0	0	113.1	C505 F506 T507 F531 A562	C505-S557 PolarHBondContact O-N 2.83Å; F506-S557 WeakPolarHBondContact CA-O 3.36Å; T507-S557 PolarHBondContact N-O 2.88Å; F531-S557 WeakPolarHBondContact O-CA 3.29Å; F531-S557 PolarHBondContact O-OG 3.45Å; S557-A562 WeakPolarHBondContact OG-CB 3.38Å; S557-A562 PolarHBondContact OG-N 2.8Å
558	T	90.5	Very high	82.4	Confident	8 Å²	8	41.6 Å²	41.6	5%	0.049	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	158.2	162.8	67	0	0	0	0	111.4	S509 R510 A513 A560 A561 A562	S509-T558 WeakPolarHBondContact O-CG2 3.11Å; R510-T558 HydrophobicContact CG-CG2 4.16Å; A513-T558 HydrophobicContact CB-CG2 4.05Å; T558-A560 VanDerWaalsContact C-N 3.25Å; T558-A560 PolarHBondContact O-N 2.84Å; T558-A561 PolarHBondContact O-N 2.77Å; T558-A561 VanDerWaalsContact O-N 3.13Å; T558-A562 PolarHBondContact O-N 3.43Å
559	D	81.6	Confident	81.7	Confident	27 Å²	27	40.9 Å²	40.9	14%	0.144	22%	0.218	C	C	.	.	H	α-helix	trans	-53.5	-38.8	174.3	-88	-41.6	0	0	0	113.9	A561 R563 T584 R588	D559-A561 VanDerWaalsContact C-N 3.28Å; D559-A561 PolarHBondContact O-N 2.77Å; D559-R563 WeakPolarHBondContact O-CB 3.15Å; D559-R563 VanDerWaalsContact O-CG 3.28Å; D559-R563 WeakPolarHBondContact O-CG 3.43Å; D559-R563 PolarHBondContact O-N 3.07Å; D559-T584 WeakPolarHBondContact OD1-CG2 3.5Å; D559-T584 WeakPolarHBondContact OD2-CG2 3.01Å; D559-R588 WeakPolarHBondContact OD1-CG 3.47Å; D559-R588 IonicContact OD1-CZ 3.37Å; D559-R588 IonicContact OD1-NE 2.74Å; D559-R588 PolarHBondContact OD1-NE 2.75Å; D559-R588 IonicContact OD1-NH2 3.15Å; D559-R588 IonicContact OD2-CZ 2.75Å; D559-R588 IonicContact OD2-NE 2.95Å; D559-R588 PolarHBondContact OD2-NE 3.4Å; D559-R588 IonicContact OD2-NH2 3.23Å; D559-R588 PolarHBondContact OD2-NH2 2.99Å
560	A	73.6	Confident	81.6	Confident	70 Å²	70	33.8 Å²	33.8	58%	0.579	19%	0.188	S	C	*	.	H	α-helix	trans	-70	-28	-178.4	0	0	0	0	0	112.3	T558	T558-A560 VanDerWaalsContact C-N 3.25Å; T558-A560 PolarHBondContact O-N 2.84Å
561	A	74.1	Confident	81.6	Confident	10 Å²	10	38 Å²	38	8%	0.083	19%	0.192	C	C	.	.	H	α-helix	trans	-89.7	-42	-177.3	0	0	0	0	0	112.7	F531 T558 D559 I565	F531-A561 HydrophobicContact CD1-CB 3.67Å; F531-A561 HydrophobicContact CE1-CB 3.83Å; F531-A561 WeakPolarHBondContact CE1-O 3.45Å; F531-A561 WeakPolarHBondContact O-CB 3.25Å; T558-A561 PolarHBondContact O-N 2.77Å; T558-A561 VanDerWaalsContact O-N 3.13Å; D559-A561 VanDerWaalsContact C-N 3.28Å; D559-A561 PolarHBondContact O-N 2.77Å; A561-I565 WeakPolarHBondContact O-CD1 3.26Å
562	A	70.5	Confident	81.7	Confident	2 Å²	2	32.3 Å²	32.3	2%	0.017	17%	0.167	C	C	.	.	H	α-helix	trans	-85.8	-12.5	-177	0	0	0	0	0	115.3	F506 S557 T558 I565 R591	F506-A562 HydrophobicContact CE1-CB 3.6Å; F506-A562 HydrophobicContact CZ-CB 3.91Å; S557-A562 WeakPolarHBondContact OG-CB 3.38Å; S557-A562 PolarHBondContact OG-N 2.8Å; T558-A562 PolarHBondContact O-N 3.43Å; A562-I565 PolarHBondContact O-N 2.94Å; A562-R591 PolarHBondContact O-NH1 2.93Å
563	R	73.4	Confident	81.8	Confident	35 Å²	35	31.3 Å²	31.3	13%	0.132	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	145.3	169.4	-85.8	-176.8	170.8	112.7	-6.8	111.2	D559 I565 T584 H587	D559-R563 WeakPolarHBondContact O-CB 3.15Å; D559-R563 VanDerWaalsContact O-CG 3.28Å; D559-R563 WeakPolarHBondContact O-CG 3.43Å; D559-R563 PolarHBondContact O-N 3.07Å; R563-I565 PolarHBondContact O-N 3.17Å; R563-I565 VanDerWaalsContact O-N 3.12Å; R563-T584 PolarHBondContact NH2-OG1 3.24Å; R563-H587 PolarHBondContact NE-ND1 2.93Å; R563-H587 VanDerWaalsContact NE-ND1 3.19Å
564	G	65.1	Low	82	Confident	2 Å²	2	29.2 Å²	29.2	2%	0.021	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.9	0.4	-175.7	0	0	0	0	0	116.8	L288 Q291 E367	L288-G564 WeakPolarHBondContact CA-O 3.49Å; L288-G564 WeakPolarHBondContact CB-O 3.21Å; L288-G564 VanDerWaalsContact CD1-O 3.25Å; L288-G564 WeakPolarHBondContact CD1-O 3.25Å; Q291-G564 PolarHBondContact OE1-O 3.29Å; E367-G564 WeakPolarHBondContact OE1-CA 3.39Å; E367-G564 PolarHBondContact OE1-N 3.27Å
565	I	74.3	Confident	82	Confident	11 Å²	11	29.1 Å²	29.1	6%	0.056	15%	0.152	C	C	.	.			trans	-92.8	121.3	174.5	-53.1	-170.9	0	0	0	110	E287 F531 L544 A561 A562 R563 I567 R591	E287-I565 HydrophobicContact CB-CD1 4.42Å; E287-I565 HydrophobicContact CB-CG1 4.16Å; F531-I565 HydrophobicContact CD1-CD1 4.3Å; F531-I565 HydrophobicContact CE1-CD1 3.3Å; F531-I565 HydrophobicContact CE2-CD1 4.46Å; F531-I565 HydrophobicContact CZ-CD1 3.4Å; L544-I565 HydrophobicContact CD1-CD1 4.24Å; L544-I565 HydrophobicContact CD1-CG2 4.23Å; L544-I565 HydrophobicContact CD2-CG2 4.01Å; A561-I565 WeakPolarHBondContact O-CD1 3.26Å; A562-I565 PolarHBondContact O-N 2.94Å; R563-I565 PolarHBondContact O-N 3.17Å; R563-I565 VanDerWaalsContact O-N 3.12Å; I565-I567 HydrophobicContact CB-CG1 4.44Å; I565-I567 HydrophobicContact CG2-CD1 4.28Å; I565-I567 HydrophobicContact CG2-CG1 3.58Å; I565-R591 PolarHBondContact O-NH1 3.36Å
566	D	71.5	Confident	82.1	Confident	55 Å²	55	29.4 Å²	29.4	29%	0.294	15%	0.153	S	C	.	.			trans	-79.4	111.9	159	-173.4	41.6	0	0	0	109.9	Q291 R594	Q291-D566 VanDerWaalsContact CD-CB 3.43Å; Q291-D566 VanDerWaalsContact NE2-CB 3.3Å; D566-R594 IonicContact OD1-CZ 3.33Å; D566-R594 IonicContact OD1-NH1 3.71Å; D566-R594 PolarHBondContact OD1-NH1 3.26Å
567	I	75.9	Confident	82	Confident	4 Å²	4	29.9 Å²	29.9	2%	0.021	16%	0.156	C	C	.	.			trans	-111.6	121	168.9	-50.2	-179.2	0	0	0	105.9	L504 L544 F547 L555 I565 V570	L504-I567 HydrophobicContact CD1-CD1 4.31Å; L504-I567 HydrophobicContact CD2-CD1 4.37Å; L544-I567 HydrophobicContact CD2-CD1 3.96Å; L544-I567 HydrophobicContact CD2-CG1 4.14Å; F547-I567 HydrophobicContact CD1-CD1 4.35Å; F547-I567 HydrophobicContact CD1-CG2 3.7Å; F547-I567 HydrophobicContact CE1-CD1 4.25Å; F547-I567 HydrophobicContact CE1-CG2 3.81Å; L555-I567 HydrophobicContact CD2-CD1 4.08Å; I565-I567 HydrophobicContact CB-CG1 4.44Å; I565-I567 HydrophobicContact CG2-CD1 4.28Å; I565-I567 HydrophobicContact CG2-CG1 3.58Å; I567-V570 HydrophobicContact CB-CG2 3.77Å; I567-V570 HydrophobicContact CG2-CG2 3.58Å
568	K	71.2	Confident	82	Confident	144 Å²	144	30.1 Å²	30.1	63%	0.626	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	146.1	178.8	-61.6	-173.1	178.7	-173.4	0	110.4	V570	K568-V570 VanDerWaalsContact C-N 3.29Å; K568-V570 PolarHBondContact O-N 2.96Å; K568-V570 VanDerWaalsContact O-N 3.15Å
569	D	70	Confident	82	Confident	94 Å²	94	30 Å²	30	50%	0.503	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.8	29.1	167.2	-60.8	-68.3	0	0	0	117.1	P502 K571 K597	P502-D569 WeakPolarHBondContact CG-O 3.19Å; D569-K571 PolarHBondContact O-N 3.32Å; D569-K597 IonicContact OD1-NZ 3.26Å; D569-K597 PolarHBondContact OD1-NZ 3.31Å; D569-K597 IonicContact OD2-NZ 2.63Å
570	V	85.8	Confident	82.3	Confident	7 Å²	7	35.3 Å²	35.3	4%	0.042	18%	0.181	C	C	.	.			trans	-64.6	104.8	165.3	-177.7	0	0	0	0	109.5	L504 F547 I567 K568 C572 V573 T592	L504-V570 HydrophobicContact CB-CG1 3.76Å; F547-V570 HydrophobicContact CE1-CG2 4.1Å; I567-V570 HydrophobicContact CB-CG2 3.77Å; I567-V570 HydrophobicContact CG2-CG2 3.58Å; K568-V570 VanDerWaalsContact C-N 3.29Å; K568-V570 PolarHBondContact O-N 2.96Å; K568-V570 VanDerWaalsContact O-N 3.15Å; V570-C572 WeakPolarHBondContact CG1-O 3.47Å; V570-V573 HydrophobicContact CG1-CG2 4.12Å; V570-T592 WeakPolarHBondContact O-CB 3.38Å; V570-T592 PolarHBondContact O-OG1 2.91Å
571	K	87.6	Confident	83.1	Confident	140 Å²	140	38.4 Å²	38.4	61%	0.609	18%	0.182	S	C	*	.			trans	-75.6	-33.5	178.7	-65.8	-173.4	-173.4	177.6	0	113.3	D569 T592 L600	D569-K571 PolarHBondContact O-N 3.32Å; K571-T592 PolarHBondContact O-OG1 3.26Å; K571-L600 PolarHBondContact O-N 3.27Å
572	C	92.3	Very high	83.8	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.014	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	129.1	-172.4	-178.5	0	0	0	0	111	P502 I503 L504 V570 L600	P502-C572 PolarHBondContact O-N 3.17Å; I503-C572 WeakPolarHBondContact CA-O 3.32Å; I503-C572 HydrophobicContact CG1-CB 4.14Å; I503-C572 HydrophobicContact CG2-CB 4.43Å; L504-C572 PolarHBondContact N-O 3.37Å; V570-C572 WeakPolarHBondContact CG1-O 3.47Å; C572-L600 CarbonylContact C-O 3.6Å; C572-L600 WeakPolarHBondContact CA-O 3.46Å
573	V	93.7	Very high	84.5	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	132	167.5	171.5	0	0	0	0	108.6	L504 F506 V570 R591 T592 L600 A601 F602	L504-V573 CarbonylContact O-C 3.59Å; L504-V573 WeakPolarHBondContact O-CA 3.42Å; F506-V573 HydrophobicContact CD2-CG1 3.86Å; F506-V573 HydrophobicContact CE2-CG1 3.91Å; V570-V573 HydrophobicContact CG1-CG2 4.12Å; V573-R591 HydrophobicContact CG2-CB 4.09Å; V573-T592 HydrophobicContact CB-CG2 4.35Å; V573-T592 HydrophobicContact CG2-CG2 3.86Å; V573-L600 PolarHBondContact N-O 3.12Å; V573-A601 CarbonylContact O-C 3.57Å; V573-A601 WeakPolarHBondContact O-CA 3.5Å; V573-F602 PolarHBondContact O-N 3.48Å
574	V	95.2	Very high	85.2	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	117.3	172.9	-177.2	0	0	0	0	109.9	I491 F494 I503 L504 C505 F506 Y576 F602 F604	I491-V574 HydrophobicContact CD1-CB 4.1Å; I491-V574 HydrophobicContact CD1-CG1 4.06Å; I491-V574 HydrophobicContact CD1-CG2 3.96Å; F494-V574 HydrophobicContact CD2-CG2 4.4Å; I503-V574 HydrophobicContact CG2-CB 4.27Å; I503-V574 HydrophobicContact CG2-CG2 3.62Å; L504-V574 PolarHBondContact O-N 3.31Å; C505-V574 CarbonylContact C-O 3.58Å; C505-V574 WeakPolarHBondContact CA-O 3.32Å; F506-V574 PolarHBondContact N-O 2.85Å; V574-Y576 PolarHBondContact O-N 2.94Å; V574-F602 CarbonylContact C-O 3.59Å; V574-F602 WeakPolarHBondContact CA-O 2.97Å; V574-F602 HydrophobicContact CG2-CB 4.3Å; V574-F602 HydrophobicContact CG2-CD2 4.32Å; V574-F604 HydrophobicContact CG1-CD1 4.26Å; V574-F604 HydrophobicContact CG1-CE1 3.85Å; V574-F604 HydrophobicContact CG1-CE2 4.17Å; V574-F604 HydrophobicContact CG1-CZ 3.81Å
575	N	95.4	Very high	86.5	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	88.8	167.2	-61.2	-53	0	0	0	108.5	D577 Y585 R588 F602 T603 F604	N575-D577 PolarHBondContact O-N 3.38Å; N575-Y585 WeakPolarHBondContact ND2-CE2 3.39Å; N575-R588 WeakPolarHBondContact OD1-CD 3.4Å; N575-R588 PolarHBondContact OD1-NH1 3.33Å; N575-F602 PolarHBondContact N-O 3.09Å; N575-T603 HydrophobicContact CB-CG2 3.85Å; N575-T603 PolarHBondContact ND2-OG1 2.96Å; N575-F604 PolarHBondContact O-N 3.42Å
576	Y	94.9	Very high	87.1	Confident	6 Å²	6	40 Å²	40	2%	0.024	19%	0.188	C	C	.	.	S	Bend	trans	-61.7	-38	176	177.6	-84	0	0	0	110.9	K487 P488 I491 F506 T507 L516 V574 F604	K487-Y576 HydrophobicContact CB-CD2 4.33Å; K487-Y576 HydrophobicContact CB-CE1 4.41Å; K487-Y576 HydrophobicContact CB-CE2 3.56Å; K487-Y576 HydrophobicContact CD-CD1 4.38Å; K487-Y576 HydrophobicContact CD-CE1 3.98Å; K487-Y576 HydrophobicContact CD-CE2 4.43Å; K487-Y576 WeakPolarHBondContact CE-O 3.39Å; K487-Y576 PolarHBondContact NZ-O 3.21Å; P488-Y576 WeakPolarHBondContact CG-OH 3.28Å; I491-Y576 HydrophobicContact CG2-CD2 4.45Å; I491-Y576 HydrophobicContact CG2-CE2 4.46Å; F506-Y576 WeakPolarHBondContact O-CB 3.47Å; F506-Y576 PolarHBondContact O-N 3.09Å; T507-Y576 HydrophobicContact CG2-CD1 3.97Å; T507-Y576 HydrophobicContact CG2-CG 4.27Å; L516-Y576 HydrophobicContact CD1-CD2 4.43Å; L516-Y576 HydrophobicContact CD1-CE2 3.76Å; L516-Y576 HydrophobicContact CD2-CD1 4.42Å; L516-Y576 HydrophobicContact CD2-CD2 3.65Å; L516-Y576 HydrophobicContact CD2-CE2 3.77Å; L516-Y576 HydrophobicContact CD2-CG 4Å; L516-Y576 HydrophobicContact CG-CE2 4.42Å; V574-Y576 PolarHBondContact O-N 2.94Å; Y576-F604 HydrophobicContact CD2-CD2 4.12Å; Y576-F604 HydrophobicContact CD2-CE2 4.24Å
577	D	93.1	Very high	87.8	Confident	11 Å²	11	37.8 Å²	37.8	6%	0.059	18%	0.175	C	C	.	.	S	Bend	trans	-108.3	134	164.5	-68.3	-46.4	0	0	0	111	K487 F506 N508 N575 R588	K487-D577 IonicContact NZ-OD1 3.01Å; K487-D577 PolarHBondContact NZ-OD1 3.05Å; F506-D577 PolarHBondContact O-N 3.16Å; N508-D577 HydrophobicContact CB-CB 4.11Å; N508-D577 VanDerWaalsContact CG-CB 3.42Å; N508-D577 PolarHBondContact N-OD2 3.28Å; N508-D577 WeakPolarHBondContact OD1-CB 3.18Å; N575-D577 PolarHBondContact O-N 3.38Å; D577-R588 PolarHBondContact O-NH1 3.03Å
578	A	91.8	Very high	88.4	Confident	5 Å²	5	37.6 Å²	37.6	4%	0.041	17%	0.174	C	C	.	.			trans	-59.9	128.9	172.8	0	0	0	0	0	110.6	N508 T603 L605 F613	N508-A578 PolarHBondContact ND2-O 3.18Å; A578-T603 HydrophobicContact CB-CG2 4.46Å; A578-L605 HydrophobicContact CB-CD2 3.68Å; A578-F613 HydrophobicContact CB-CD2 4.5Å
579	P	91.3	Very high	89.2	Confident	6 Å²	6	30.7 Å²	30.7	4%	0.039	14%	0.144	C	C	.	.			trans	-70.1	142.5	172.3	29.4	-33.3	0	0	0	110.5	F581 T584 Y585 F613	P579-F581 VanDerWaalsContact C-N 3.35Å; P579-T584 HydrophobicContact CB-CG2 3.78Å; P579-Y585 HydrophobicContact CG-CD2 3.92Å; P579-Y585 HydrophobicContact CG-CG 4.23Å; P579-F613 HydrophobicContact CG-CE2 4.06Å
580	Q	88.6	Confident	90	Very high	138 Å²	138	26.2 Å²	26.2	65%	0.645	12%	0.121	S	C	*	.	S	Bend	trans	-77.9	-17.3	-179.4	-68.5	174.6	-26.6	0	0	114.1
581	F	89.1	Confident	90	Very high	135 Å²	135	26.4 Å²	26.4	59%	0.592	12%	0.12	S	C	*	.	S	Bend	trans	-136.2	139.1	-173.5	-56.3	-69.8	0	0	0	110.9	P579 R583 T584 Y585	P579-F581 VanDerWaalsContact C-N 3.35Å; F581-R583 VanDerWaalsContact C-N 3.31Å; F581-R583 PolarHBondContact O-N 2.94Å; F581-T584 WeakPolarHBondContact O-CA 3.25Å; F581-T584 WeakPolarHBondContact O-CB 3.37Å; F581-T584 PolarHBondContact O-N 3.34Å; F581-Y585 PolarHBondContact O-N 2.91Å; F581-Y585 VanDerWaalsContact O-N 3.13Å
582	I	89.1	Confident	90.1	Very high	26 Å²	26	19.9 Å²	19.9	13%	0.133	9%	0.092	C	C	.	.	H	α-helix	trans	-56.2	-41.6	-178.7	-176.4	64.6	0	0	0	113.2	F469 F471 T584 Y585 I586 M616 V617 A620	F469-I582 HydrophobicContact CD2-CG1 3.9Å; F469-I582 HydrophobicContact CD2-CG2 4.24Å; F469-I582 HydrophobicContact CE2-CB 4.47Å; F469-I582 HydrophobicContact CE2-CG1 4.06Å; F469-I582 HydrophobicContact CE2-CG2 3.53Å; F469-I582 HydrophobicContact CZ-CG2 4.11Å; F471-I582 HydrophobicContact CZ-CD1 4.25Å; I582-T584 VanDerWaalsContact C-N 3.26Å; I582-T584 PolarHBondContact O-N 3.15Å; I582-Y585 HydrophobicContact CD1-CD1 4.09Å; I582-Y585 WeakPolarHBondContact O-CA 3.48Å; I582-Y585 WeakPolarHBondContact O-CB 3.42Å; I582-Y585 PolarHBondContact O-N 2.65Å; I582-I586 HydrophobicContact CD1-CD1 4.27Å; I582-I586 HydrophobicContact CD1-CG1 4.37Å; I582-I586 HydrophobicContact CG1-CD1 3.78Å; I582-I586 HydrophobicContact CG1-CG1 4.37Å; I582-I586 WeakPolarHBondContact O-CG1 3.19Å; I582-I586 PolarHBondContact O-N 3.48Å; I582-M616 HydrophobicContact CB-CG 3.91Å; I582-M616 HydrophobicContact CB-SD 4.22Å; I582-M616 PolarHBondContact N-SD 2.98Å; I582-V617 HydrophobicContact CD1-CG2 4.42Å; I582-A620 HydrophobicContact CD1-CB 3.45Å; I582-A620 VanDerWaalsContact CD1-CB 3.45Å; I582-A620 HydrophobicContact CG1-CB 3.52Å
583	R	85.8	Confident	89.7	Confident	48 Å²	48	20 Å²	20	18%	0.181	9%	0.094	C	C	.	.	H	α-helix	trans	-56.8	-40.1	176.3	-70.1	162.2	170.7	-79.7	-12.1	111.4	D369 T428 L429 E467 F469 F581 H587	D369-R583 IonicContact OD2-NH1 3.67Å; T428-R583 PolarHBondContact O-NH1 2.67Å; L429-R583 PolarHBondContact O-NH2 3.38Å; L429-R583 VanDerWaalsContact O-NH2 3.11Å; E467-R583 IonicContact OE1-NH2 3.29Å; E467-R583 PolarHBondContact OE1-NH2 3.28Å; E467-R583 IonicContact OE2-CZ 2.7Å; E467-R583 IonicContact OE2-NE 3.02Å; E467-R583 PolarHBondContact OE2-NE 2.7Å; E467-R583 IonicContact OE2-NH2 3.74Å; E467-R583 PolarHBondContact OE2-NH2 3Å; F469-R583 HydrophobicContact CE1-CG 3.97Å; F469-R583 HydrophobicContact CZ-CG 3.83Å; F581-R583 VanDerWaalsContact C-N 3.31Å; F581-R583 PolarHBondContact O-N 2.94Å; R583-H587 WeakPolarHBondContact O-CB 3.43Å; R583-H587 PolarHBondContact O-CD2 3.05Å; R583-H587 PolarHBondContact O-N 3.24Å; R583-H587 VanDerWaalsContact O-N 3.1Å
584	T	88.4	Confident	89.2	Confident	18 Å²	18	22.2 Å²	22.2	11%	0.11	10%	0.102	C	C	.	.	H	α-helix	trans	-66.8	-43.5	172.5	-59.5	0	0	0	0	111.8	D559 R563 P579 F581 I582 I586 H587 R588	D559-T584 WeakPolarHBondContact OD1-CG2 3.5Å; D559-T584 WeakPolarHBondContact OD2-CG2 3.01Å; R563-T584 PolarHBondContact NH2-OG1 3.24Å; P579-T584 HydrophobicContact CB-CG2 3.78Å; F581-T584 WeakPolarHBondContact O-CA 3.25Å; F581-T584 WeakPolarHBondContact O-CB 3.37Å; F581-T584 PolarHBondContact O-N 3.34Å; I582-T584 VanDerWaalsContact C-N 3.26Å; I582-T584 PolarHBondContact O-N 3.15Å; T584-I586 PolarHBondContact O-N 3.25Å; T584-H587 PolarHBondContact O-N 2.95Å; T584-R588 HydrophobicContact CG2-CG 4.43Å; T584-R588 WeakPolarHBondContact O-CG 3.37Å; T584-R588 PolarHBondContact O-N 3.2Å; T584-R588 VanDerWaalsContact O-N 3.09Å
585	Y	90.8	Very high	88.2	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-56.2	-50.6	176.9	-176.8	-127.1	0	0	0	111.9	F471 E477 N575 P579 F581 I582 H587 R588 I589 F613 V617	F471-Y585 HydrophobicContact CE1-CD1 4.41Å; F471-Y585 HydrophobicContact CE1-CE1 4.15Å; E477-Y585 VanDerWaalsContact OE2-CE1 3.25Å; E477-Y585 WeakPolarHBondContact OE2-CE1 3.39Å; E477-Y585 PolarHBondContact OE2-OH 2.92Å; E477-Y585 VanDerWaalsContact OE2-OH 3.07Å; N575-Y585 WeakPolarHBondContact ND2-CE2 3.39Å; P579-Y585 HydrophobicContact CG-CD2 3.92Å; P579-Y585 HydrophobicContact CG-CG 4.23Å; F581-Y585 PolarHBondContact O-N 2.91Å; F581-Y585 VanDerWaalsContact O-N 3.13Å; I582-Y585 HydrophobicContact CD1-CD1 4.09Å; I582-Y585 WeakPolarHBondContact O-CA 3.48Å; I582-Y585 WeakPolarHBondContact O-CB 3.42Å; I582-Y585 PolarHBondContact O-N 2.65Å; Y585-H587 VanDerWaalsContact C-N 3.33Å; Y585-H587 PolarHBondContact O-N 2.85Å; Y585-R588 WeakPolarHBondContact O-CB 3.39Å; Y585-R588 PolarHBondContact O-N 3.32Å; Y585-R588 VanDerWaalsContact O-N 3.08Å; Y585-I589 HydrophobicContact CD1-CD1 4.07Å; Y585-I589 HydrophobicContact CD2-CG2 3.84Å; Y585-I589 HydrophobicContact CE1-CD1 3.95Å; Y585-I589 HydrophobicContact CE1-CG2 4.44Å; Y585-I589 HydrophobicContact CE2-CG2 3.45Å; Y585-I589 VanDerWaalsContact CE2-CG2 3.45Å; Y585-I589 HydrophobicContact CG-CG2 4.47Å; Y585-I589 WeakPolarHBondContact O-CG1 3Å; Y585-I589 PolarHBondContact O-N 2.89Å; Y585-F613 HydrophobicContact CD1-CZ 4.43Å; Y585-F613 HydrophobicContact CD2-CE2 4.25Å; Y585-F613 AromaticContact CD2-CZ 3.92Å; Y585-F613 HydrophobicContact CD2-CZ 3.92Å; Y585-F613 HydrophobicContact CE1-CZ 4.21Å; Y585-F613 HydrophobicContact CE2-CE2 4.47Å; Y585-F613 AromaticContact CE2-CZ 3.7Å; Y585-F613 HydrophobicContact CE2-CZ 3.7Å; Y585-F613 HydrophobicContact CG-CE2 4.46Å; Y585-F613 HydrophobicContact CG-CZ 4.28Å; Y585-F613 AromaticContact CZ-CZ 3.84Å; Y585-V617 HydrophobicContact CD1-CG2 3.81Å; Y585-V617 HydrophobicContact CE1-CG1 4.07Å; Y585-V617 HydrophobicContact CE1-CG2 3.66Å
586	I	88.5	Confident	87.3	Confident	1 Å²	1	24.4 Å²	24.4	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-58.6	-43.3	177.4	-62.2	156.4	0	0	0	111.2	T428 F469 I582 T584 R588 G590	T428-I586 HydrophobicContact CG2-CB 4.34Å; T428-I586 HydrophobicContact CG2-CD1 4.01Å; T428-I586 HydrophobicContact CG2-CG2 3.9Å; F469-I586 HydrophobicContact CB-CD1 3.36Å; F469-I586 HydrophobicContact CD1-CD1 3.85Å; F469-I586 HydrophobicContact CD2-CD1 3.8Å; F469-I586 HydrophobicContact CG-CD1 3.39Å; I582-I586 HydrophobicContact CD1-CD1 4.27Å; I582-I586 HydrophobicContact CD1-CG1 4.37Å; I582-I586 HydrophobicContact CG1-CD1 3.78Å; I582-I586 HydrophobicContact CG1-CG1 4.37Å; I582-I586 WeakPolarHBondContact O-CG1 3.19Å; I582-I586 PolarHBondContact O-N 3.48Å; T584-I586 PolarHBondContact O-N 3.25Å; I586-R588 PolarHBondContact O-N 3.47Å; I586-G590 WeakPolarHBondContact O-CA 3.22Å; I586-G590 PolarHBondContact O-N 3.5Å
587	H	85.6	Confident	86.8	Confident	8 Å²	8	29.1 Å²	29.1	4%	0.037	14%	0.141	C	C	.	.	H	α-helix	trans	-65.3	-24.7	178.6	-68.2	-177.2	0	0	0	113.9	D369 T428 R563 R583 T584 Y585 R591	D369-H587 IonicContact OD2-CE1 3.4Å; D369-H587 PolarHBondContact OD2-CE1 3.27Å; D369-H587 IonicContact OD2-NE2 3.07Å; T428-H587 PolarHBondContact OG1-NE2 2.92Å; R563-H587 PolarHBondContact NE-ND1 2.93Å; R563-H587 VanDerWaalsContact NE-ND1 3.19Å; R583-H587 WeakPolarHBondContact O-CB 3.43Å; R583-H587 PolarHBondContact O-CD2 3.05Å; R583-H587 PolarHBondContact O-N 3.24Å; R583-H587 VanDerWaalsContact O-N 3.1Å; T584-H587 PolarHBondContact O-N 2.95Å; Y585-H587 VanDerWaalsContact C-N 3.33Å; Y585-H587 PolarHBondContact O-N 2.85Å; H587-R591 PolarHBondContact O-NE 2.77Å; H587-R591 PolarHBondContact O-NH2 3.18Å; H587-R591 VanDerWaalsContact O-NH2 3.15Å
588	R	89.2	Confident	86.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-85.6	-54.6	176.9	-67.4	-174.9	-174.6	-177.5	2.2	112.4	F506 N508 D559 N575 D577 T584 Y585 I586 G590 R591	F506-R588 HydrophobicContact CB-CG 4.48Å; F506-R588 HydrophobicContact CD1-CG 3.69Å; F506-R588 HydrophobicContact CD2-CB 3.91Å; F506-R588 HydrophobicContact CD2-CG 3.95Å; F506-R588 HydrophobicContact CE1-CB 4.35Å; F506-R588 HydrophobicContact CE1-CG 3.71Å; F506-R588 HydrophobicContact CE2-CB 3.73Å; F506-R588 HydrophobicContact CE2-CG 3.96Å; F506-R588 HydrophobicContact CG-CB 4.29Å; F506-R588 HydrophobicContact CG-CG 3.8Å; F506-R588 HydrophobicContact CZ-CB 3.96Å; F506-R588 HydrophobicContact CZ-CG 3.84Å; N508-R588 PolarHBondContact OD1-NH2 3.31Å; D559-R588 WeakPolarHBondContact OD1-CG 3.47Å; D559-R588 IonicContact OD1-CZ 3.37Å; D559-R588 IonicContact OD1-NE 2.74Å; D559-R588 PolarHBondContact OD1-NE 2.75Å; D559-R588 IonicContact OD1-NH2 3.15Å; D559-R588 IonicContact OD2-CZ 2.75Å; D559-R588 IonicContact OD2-NE 2.95Å; D559-R588 PolarHBondContact OD2-NE 3.4Å; D559-R588 IonicContact OD2-NH2 3.23Å; D559-R588 PolarHBondContact OD2-NH2 2.99Å; N575-R588 WeakPolarHBondContact OD1-CD 3.4Å; N575-R588 PolarHBondContact OD1-NH1 3.33Å; D577-R588 PolarHBondContact O-NH1 3.03Å; T584-R588 HydrophobicContact CG2-CG 4.43Å; T584-R588 WeakPolarHBondContact O-CG 3.37Å; T584-R588 PolarHBondContact O-N 3.2Å; T584-R588 VanDerWaalsContact O-N 3.09Å; Y585-R588 WeakPolarHBondContact O-CB 3.39Å; Y585-R588 PolarHBondContact O-N 3.32Å; Y585-R588 VanDerWaalsContact O-N 3.08Å; I586-R588 PolarHBondContact O-N 3.47Å; R588-G590 PolarHBondContact O-N 3.41Å; R588-R591 WeakPolarHBondContact O-CB 3.06Å; R588-R591 WeakPolarHBondContact O-CG 3.37Å; R588-R591 PolarHBondContact O-N 2.68Å
589	I	88.3	Confident	86.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-60.5	-34	177.5	68.8	-167.2	0	0	0	110.6	F471 L475 E477 Y585 R591 T592 A601	F471-I589 HydrophobicContact CD1-CD1 3.78Å; F471-I589 HydrophobicContact CE1-CD1 3.98Å; L475-I589 HydrophobicContact CD2-CB 3.84Å; L475-I589 HydrophobicContact CD2-CD1 3.72Å; L475-I589 HydrophobicContact CD2-CG1 3.84Å; E477-I589 WeakPolarHBondContact OE2-CD1 3.4Å; Y585-I589 HydrophobicContact CD1-CD1 4.07Å; Y585-I589 HydrophobicContact CD2-CG2 3.84Å; Y585-I589 HydrophobicContact CE1-CD1 3.95Å; Y585-I589 HydrophobicContact CE1-CG2 4.44Å; Y585-I589 HydrophobicContact CE2-CG2 3.45Å; Y585-I589 VanDerWaalsContact CE2-CG2 3.45Å; Y585-I589 HydrophobicContact CG-CG2 4.47Å; Y585-I589 WeakPolarHBondContact O-CG1 3Å; Y585-I589 PolarHBondContact O-N 2.89Å; I589-R591 PolarHBondContact O-N 2.85Å; I589-T592 VanDerWaalsContact O-CG2 3.32Å; I589-T592 WeakPolarHBondContact O-CG2 3.34Å; I589-T592 PolarHBondContact O-N 2.92Å; I589-A601 HydrophobicContact CB-CB 4.1Å; I589-A601 HydrophobicContact CG2-CB 3.66Å
590	G	85.4	Confident	86.6	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	9.2	170.7	0	0	0	0	0	116.9	T253 I586 R588 R594	T253-G590 WeakPolarHBondContact CB-O 3.32Å; T253-G590 WeakPolarHBondContact OG1-CA 3.47Å; T253-G590 PolarHBondContact OG1-O 2.73Å; I586-G590 WeakPolarHBondContact O-CA 3.22Å; I586-G590 PolarHBondContact O-N 3.5Å; R588-G590 PolarHBondContact O-N 3.41Å; G590-R594 VanDerWaalsContact O-CZ 3.26Å; G590-R594 PolarHBondContact O-NE 2.92Å; G590-R594 PolarHBondContact O-NH2 2.7Å
591	R	86.9	Confident	86.8	Confident	10 Å²	10	29.3 Å²	29.3	4%	0.038	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-24.8	164.1	-55.5	-61.5	135.8	174.8	-0.7	112.5	L504 F506 A562 I565 V573 H587 R588 I589	L504-R591 HydrophobicContact CD2-CB 3.61Å; L504-R591 HydrophobicContact CD2-CG 3.67Å; F506-R591 HydrophobicContact CE2-CG 4.19Å; F506-R591 HydrophobicContact CZ-CG 3.88Å; A562-R591 PolarHBondContact O-NH1 2.93Å; I565-R591 PolarHBondContact O-NH1 3.36Å; V573-R591 HydrophobicContact CG2-CB 4.09Å; H587-R591 PolarHBondContact O-NE 2.77Å; H587-R591 PolarHBondContact O-NH2 3.18Å; H587-R591 VanDerWaalsContact O-NH2 3.15Å; R588-R591 WeakPolarHBondContact O-CB 3.06Å; R588-R591 WeakPolarHBondContact O-CG 3.37Å; R588-R591 PolarHBondContact O-N 2.68Å; I589-R591 PolarHBondContact O-N 2.85Å
592	T	88.8	Confident	87.1	Confident	3 Å²	3	23.3 Å²	23.3	2%	0.018	13%	0.125	C	C	.	.	S	Bend	trans	-99	-175	165.7	-166.9	0	0	0	0	110.5	L475 V570 K571 V573 I589 R594 G599	L475-T592 HydrophobicContact CD1-CG2 3.6Å; V570-T592 WeakPolarHBondContact O-CB 3.38Å; V570-T592 PolarHBondContact O-OG1 2.91Å; K571-T592 PolarHBondContact O-OG1 3.26Å; V573-T592 HydrophobicContact CB-CG2 4.35Å; V573-T592 HydrophobicContact CG2-CG2 3.86Å; I589-T592 VanDerWaalsContact O-CG2 3.32Å; I589-T592 WeakPolarHBondContact O-CG2 3.34Å; I589-T592 PolarHBondContact O-N 2.92Å; T592-R594 PolarHBondContact O-N 3.03Å; T592-R594 VanDerWaalsContact O-N 3.13Å; T592-G599 WeakPolarHBondContact OG1-CA 3.46Å
593	A	84.6	Confident	87.4	Confident	5 Å²	5	22 Å²	22	4%	0.041	12%	0.119	C	C	.	.	S	Bend	trans	50.6	35.9	178.6	0	0	0	0	0	115.3	P472 L475 K597	P472-A593 HydrophobicContact CB-CB 3.74Å; L475-A593 HydrophobicContact CB-CB 3.91Å; L475-A593 HydrophobicContact CD1-CB 4.13Å; A593-K597 VanDerWaalsContact CA-O 3.26Å; A593-K597 WeakPolarHBondContact CA-O 3.44Å
594	R	82.2	Confident	87.8	Confident	46 Å²	46	19.8 Å²	19.8	17%	0.174	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-83.2	146.1	-179	-64.7	-171.2	165.2	-155.1	-5.2	111.6	D566 G590 T592 G596 K597	D566-R594 IonicContact OD1-CZ 3.33Å; D566-R594 IonicContact OD1-NH1 3.71Å; D566-R594 PolarHBondContact OD1-NH1 3.26Å; G590-R594 VanDerWaalsContact O-CZ 3.26Å; G590-R594 PolarHBondContact O-NE 2.92Å; G590-R594 PolarHBondContact O-NH2 2.7Å; T592-R594 PolarHBondContact O-N 3.03Å; T592-R594 VanDerWaalsContact O-N 3.13Å; R594-G596 PolarHBondContact O-N 2.76Å; R594-K597 WeakPolarHBondContact O-CB 3.4Å; R594-K597 PolarHBondContact O-N 3.16Å; R594-K597 VanDerWaalsContact O-N 3.08Å
595	A	75.4	Confident	88.1	Confident	43 Å²	43	18.9 Å²	18.9	36%	0.355	11%	0.105	S	C	.	.	G	3₁₀ helix	trans	49.5	38.2	-177.9	0	0	0	0	0	113.6	F217 G254 K597	F217-A595 HydrophobicContact CE1-CB 4.22Å; F217-A595 HydrophobicContact CZ-CB 3.74Å; G254-A595 PolarHBondContact O-N 2.88Å; A595-K597 PolarHBondContact O-N 2.75Å; A595-K597 VanDerWaalsContact O-N 3.16Å
596	G	76.1	Confident	88.2	Confident	4 Å²	4	20.6 Å²	20.6	4%	0.041	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	68.1	7.9	180	0	0	0	0	0	115.7	K188 R594	K188-G596 WeakPolarHBondContact CE-O 3.4Å; K188-G596 PolarHBondContact NZ-O 2.94Å; R594-G596 PolarHBondContact O-N 2.76Å
597	K	83.8	Confident	88.3	Confident	105 Å²	105	30.8 Å²	30.8	46%	0.457	15%	0.152	S	C	.	.			trans	-63.7	148	168.5	-70.4	178.5	171.3	177.3	0	109.7	D569 A593 R594 A595	D569-K597 IonicContact OD1-NZ 3.26Å; D569-K597 PolarHBondContact OD1-NZ 3.31Å; D569-K597 IonicContact OD2-NZ 2.63Å; A593-K597 VanDerWaalsContact CA-O 3.26Å; A593-K597 WeakPolarHBondContact CA-O 3.44Å; R594-K597 WeakPolarHBondContact O-CB 3.4Å; R594-K597 PolarHBondContact O-N 3.16Å; R594-K597 VanDerWaalsContact O-N 3.08Å; A595-K597 PolarHBondContact O-N 2.75Å; A595-K597 VanDerWaalsContact O-N 3.16Å
598	P	88.6	Confident	88.6	Confident	106 Å²	106	37.8 Å²	37.8	69%	0.688	19%	0.189	S	C	*	.			trans	-65.2	150.4	172.1	29.4	-35	0	0	0	110.9	G474	G474-P598 WeakPolarHBondContact O-CA 3.36Å
599	G	90.3	Very high	88.7	Confident	3 Å²	3	39.7 Å²	39.7	3%	0.031	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	150	179.4	0	0	0	0	0	113.1	G474 L475 T476 T592	G474-G599 PolarHBondContact O-N 3.31Å; L475-G599 CarbonylContact C-O 3.59Å; L475-G599 WeakPolarHBondContact CA-O 3.44Å; T476-G599 PolarHBondContact N-O 2.95Å; T592-G599 WeakPolarHBondContact OG1-CA 3.46Å
600	L	92.6	Very high	88.8	Confident	55 Å²	55	40.6 Å²	40.6	29%	0.288	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	133.4	179.1	-56.1	178.7	0	0	0	110.7	F478 L500 K571 C572 V573 F602	F478-L600 HydrophobicContact CE2-CD2 4.28Å; L500-L600 HydrophobicContact CD2-CD1 4.29Å; K571-L600 PolarHBondContact O-N 3.27Å; C572-L600 CarbonylContact C-O 3.6Å; C572-L600 WeakPolarHBondContact CA-O 3.46Å; V573-L600 PolarHBondContact N-O 3.12Å; L600-F602 HydrophobicContact CB-CE2 3.81Å; L600-F602 HydrophobicContact CB-CZ 4.32Å; L600-F602 HydrophobicContact CD1-CE2 4.23Å; L600-F602 HydrophobicContact CD1-CZ 4.31Å
601	A	93.8	Very high	89	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	118.8	172.3	0	0	0	0	0	111.3	L475 T476 F478 V573 I589	L475-A601 HydrophobicContact CD1-CB 3.81Å; T476-A601 PolarHBondContact O-N 3.07Å; F478-A601 PolarHBondContact N-O 3.39Å; V573-A601 CarbonylContact O-C 3.57Å; V573-A601 WeakPolarHBondContact O-CA 3.5Å; I589-A601 HydrophobicContact CB-CB 4.1Å; I589-A601 HydrophobicContact CG2-CB 3.66Å
602	F	94.9	Very high	89.2	Confident	8 Å²	8	51 Å²	51	4%	0.035	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	139.4	175.6	-60	-84.1	0	0	0	111	F478 V480 F494 L500 V573 V574 N575 L600	F478-F602 HydrophobicContact CB-CD1 3.48Å; F478-F602 VanDerWaalsContact CB-CD1 3.48Å; F478-F602 HydrophobicContact CB-CE1 3.73Å; F478-F602 HydrophobicContact CB-CG 4.4Å; F478-F602 HydrophobicContact CD2-CD1 4.06Å; F478-F602 AromaticContact CD2-CE1 3.51Å; F478-F602 HydrophobicContact CD2-CE1 3.51Å; F478-F602 AromaticContact CD2-CZ 3.96Å; F478-F602 HydrophobicContact CD2-CZ 3.96Å; F478-F602 HydrophobicContact CE2-CE1 4.25Å; F478-F602 HydrophobicContact CE2-CZ 4.41Å; F478-F602 HydrophobicContact CG-CD1 4Å; F478-F602 AromaticContact CG-CE1 3.7Å; F478-F602 HydrophobicContact CG-CE1 3.7Å; F478-F602 CarbonylContact O-C 3.53Å; F478-F602 WeakPolarHBondContact O-CA 3.4Å; V480-F602 HydrophobicContact CG2-CD1 4.45Å; F494-F602 HydrophobicContact CD2-CD2 4.39Å; F494-F602 HydrophobicContact CD2-CG 4.38Å; F494-F602 HydrophobicContact CE2-CB 3.98Å; F494-F602 AromaticContact CE2-CD1 3.74Å; F494-F602 HydrophobicContact CE2-CD1 3.74Å; F494-F602 HydrophobicContact CE2-CD2 4.06Å; F494-F602 HydrophobicContact CE2-CE1 4.28Å; F494-F602 AromaticContact CE2-CG 3.64Å; F494-F602 HydrophobicContact CE2-CG 3.64Å; F494-F602 HydrophobicContact CZ-CD1 4.2Å; L500-F602 HydrophobicContact CD1-CE2 3.98Å; L500-F602 HydrophobicContact CD1-CZ 4.42Å; V573-F602 PolarHBondContact O-N 3.48Å; V574-F602 CarbonylContact C-O 3.59Å; V574-F602 WeakPolarHBondContact CA-O 2.97Å; V574-F602 HydrophobicContact CG2-CB 4.3Å; V574-F602 HydrophobicContact CG2-CD2 4.32Å; N575-F602 PolarHBondContact N-O 3.09Å; L600-F602 HydrophobicContact CB-CE2 3.81Å; L600-F602 HydrophobicContact CB-CZ 4.32Å; L600-F602 HydrophobicContact CD1-CE2 4.23Å; L600-F602 HydrophobicContact CD1-CZ 4.31Å
603	T	95.5	Very high	89.4	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	122.3	174.8	-54.4	0	0	0	0	111.8	F478 Y479 V480 N575 A578 L605 F613	F478-T603 PolarHBondContact O-N 3.02Å; Y479-T603 CarbonylContact C-O 3.59Å; Y479-T603 WeakPolarHBondContact CA-O 3.4Å; V480-T603 PolarHBondContact N-O 2.9Å; N575-T603 HydrophobicContact CB-CG2 3.85Å; N575-T603 PolarHBondContact ND2-OG1 2.96Å; A578-T603 HydrophobicContact CB-CG2 4.46Å; T603-L605 HydrophobicContact CG2-CD2 3.62Å; T603-L605 HydrophobicContact CG2-CG 4.19Å; T603-L605 PolarHBondContact O-N 2.68Å; T603-F613 HydrophobicContact CG2-CE1 4.11Å; T603-F613 HydrophobicContact CG2-CE2 4.13Å; T603-F613 HydrophobicContact CG2-CZ 3.78Å
604	F	95.3	Very high	89.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	106.8	179.4	-68.4	0	0	0	0	109.8	V480 K487 L490 I491 F494 V574 N575 Y576	V480-F604 HydrophobicContact CB-CD1 3.9Å; V480-F604 HydrophobicContact CB-CE1 4.28Å; V480-F604 HydrophobicContact CG2-CD1 4.12Å; V480-F604 HydrophobicContact CG2-CE1 4.14Å; K487-F604 HydrophobicContact CB-CD2 4.38Å; K487-F604 HydrophobicContact CG-CD2 4.34Å; L490-F604 HydrophobicContact CB-CE1 4.36Å; L490-F604 HydrophobicContact CB-CE2 3.74Å; L490-F604 HydrophobicContact CB-CZ 3.64Å; I491-F604 HydrophobicContact CB-CE2 4.14Å; I491-F604 HydrophobicContact CB-CZ 4.4Å; F494-F604 HydrophobicContact CD2-CE1 4.35Å; F494-F604 HydrophobicContact CD2-CZ 4.37Å; F494-F604 AromaticContact CE2-CE1 3.85Å; F494-F604 HydrophobicContact CE2-CE1 3.85Å; F494-F604 HydrophobicContact CE2-CZ 4.29Å; F494-F604 HydrophobicContact CZ-CE1 4.25Å; V574-F604 HydrophobicContact CG1-CD1 4.26Å; V574-F604 HydrophobicContact CG1-CE1 3.85Å; V574-F604 HydrophobicContact CG1-CE2 4.17Å; V574-F604 HydrophobicContact CG1-CZ 3.81Å; N575-F604 PolarHBondContact O-N 3.42Å; Y576-F604 HydrophobicContact CD2-CD2 4.12Å; Y576-F604 HydrophobicContact CD2-CE2 4.24Å
605	L	94.5	Very high	90.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	137.5	-177.3	-59.7	-177.3	0	0	0	110.8	Y479 V480 P481 C482 A578 T603 E610 F613	Y479-L605 HydrophobicContact CD2-CD1 3.72Å; Y479-L605 HydrophobicContact CD2-CG 4.46Å; Y479-L605 HydrophobicContact CG-CD1 4Å; V480-L605 PolarHBondContact O-N 3.28Å; P481-L605 CarbonylContact C-O 3.52Å; P481-L605 WeakPolarHBondContact CA-O 3.38Å; C482-L605 PolarHBondContact N-O 3.34Å; C482-L605 PolarHBondContact SG-O 3.05Å; A578-L605 HydrophobicContact CB-CD2 3.68Å; T603-L605 HydrophobicContact CG2-CD2 3.62Å; T603-L605 HydrophobicContact CG2-CG 4.19Å; T603-L605 PolarHBondContact O-N 2.68Å; L605-E610 HydrophobicContact CB-CG 3.92Å; L605-E610 HydrophobicContact CD1-CG 4.25Å; L605-F613 HydrophobicContact CD1-CB 4.13Å; L605-F613 HydrophobicContact CD1-CD1 3.56Å; L605-F613 HydrophobicContact CD1-CE1 4.3Å; L605-F613 HydrophobicContact CD1-CG 4.05Å; L605-F613 HydrophobicContact CD2-CB 3.98Å; L605-F613 HydrophobicContact CD2-CD1 3.86Å; L605-F613 HydrophobicContact CD2-CD2 4.15Å; L605-F613 HydrophobicContact CD2-CE1 4.41Å; L605-F613 HydrophobicContact CD2-CG 3.7Å; L605-F613 HydrophobicContact CG-CD1 4.31Å
606	L	93.1	Very high	90.9	Very high	35 Å²	35	57.7 Å²	57.7	18%	0.183	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	151.3	162.2	-54.9	176.6	0	0	0	109	C482 M484 I608 Q609 E610	C482-L606 WeakPolarHBondContact O-CD2 3.32Å; M484-L606 HydrophobicContact CG-CD1 3.98Å; M484-L606 HydrophobicContact CG-CD2 3.85Å; M484-L606 HydrophobicContact SD-CD1 3.85Å; M484-L606 HydrophobicContact SD-CD2 3.95Å; M484-L606 HydrophobicContact SD-CG 4.36Å; L606-I608 PolarHBondContact O-N 3.26Å; L606-I608 VanDerWaalsContact O-N 3.09Å; L606-Q609 HydrophobicContact CB-CG 4.25Å; L606-Q609 WeakPolarHBondContact O-CA 3.28Å; L606-Q609 WeakPolarHBondContact O-CB 3.13Å; L606-Q609 PolarHBondContact O-N 3.29Å; L606-E610 PolarHBondContact O-N 2.91Å
607	R	89.9	Confident	91.5	Very high	215 Å²	215	57.6 Å²	57.6	81%	0.811	28%	0.276	S	S	*	.	H	α-helix	trans	-45	-45.3	177.6	-87.2	-179	168.8	169.7	-5	114.1	Q609 E610	R607-Q609 PolarHBondContact O-N 2.94Å; R607-E610 WeakPolarHBondContact CA-OE1 3.47Å; R607-E610 PolarHBondContact O-N 3.36Å
608	I	90.9	Very high	91.7	Very high	156 Å²	156	59.6 Å²	59.6	80%	0.8	29%	0.289	S	S	*	.	H	α-helix	trans	-64	-26	179.9	-55	171.1	0	0	0	112	L606	L606-I608 PolarHBondContact O-N 3.26Å; L606-I608 VanDerWaalsContact O-N 3.09Å
609	Q	91.1	Very high	91.5	Very high	40 Å²	40	57.3 Å²	57.3	19%	0.187	27%	0.271	C	S	.	.	H	α-helix	trans	-91.9	-19.3	-179.4	-57.7	-173.9	-79.1	0	0	113.6	L606 R607 N611 N612 F613	L606-Q609 HydrophobicContact CB-CG 4.25Å; L606-Q609 WeakPolarHBondContact O-CA 3.28Å; L606-Q609 WeakPolarHBondContact O-CB 3.13Å; L606-Q609 PolarHBondContact O-N 3.29Å; R607-Q609 PolarHBondContact O-N 2.94Å; Q609-N611 PolarHBondContact O-N 2.93Å; Q609-N612 PolarHBondContact O-N 2.96Å; Q609-F613 VanDerWaalsContact O-CB 3.25Å; Q609-F613 WeakPolarHBondContact O-CB 3.38Å; Q609-F613 PolarHBondContact O-N 2.95Å
610	E	90.8	Very high	91.2	Very high	18 Å²	18	57.3 Å²	57.3	8%	0.084	27%	0.27	C	S	.	.	H	α-helix	trans	-53.9	-58.1	-174.6	-72.8	179.4	-123.6	0	0	111.5	Y479 P481 L605 L606 R607 N612 F613 L614 R627	Y479-E610 HydrophobicContact CE2-CG 4.26Å; Y479-E610 WeakPolarHBondContact CE2-OE2 3.32Å; P481-E610 WeakPolarHBondContact CB-OE1 3.41Å; L605-E610 HydrophobicContact CB-CG 3.92Å; L605-E610 HydrophobicContact CD1-CG 4.25Å; L606-E610 PolarHBondContact O-N 2.91Å; R607-E610 WeakPolarHBondContact CA-OE1 3.47Å; R607-E610 PolarHBondContact O-N 3.36Å; E610-N612 PolarHBondContact O-N 2.86Å; E610-F613 PolarHBondContact O-N 3.31Å; E610-L614 WeakPolarHBondContact O-CB 3.42Å; E610-L614 VanDerWaalsContact O-CG 3.22Å; E610-L614 WeakPolarHBondContact O-CG 3.21Å; E610-L614 PolarHBondContact O-N 3.4Å; E610-R627 IonicContact OE2-NH2 2.7Å
611	N	90.3	Very high	90.7	Very high	119 Å²	119	56.6 Å²	56.6	64%	0.636	28%	0.277	S	S	*	.	H	α-helix	trans	-60	-44.4	-175.8	-66.1	-6.4	0	0	0	113.4	Q609 R615	Q609-N611 PolarHBondContact O-N 2.93Å; N611-R615 WeakPolarHBondContact O-CB 3.15Å; N611-R615 PolarHBondContact O-N 2.91Å; N611-R615 VanDerWaalsContact O-N 3.08Å
612	N	91.3	Very high	90.2	Very high	110 Å²	110	57.7 Å²	57.7	59%	0.588	28%	0.284	S	S	*	.	H	α-helix	trans	-71.2	-37.3	-177.6	-70.5	-10.4	0	0	0	111.9	Q609 E610 M616	Q609-N612 PolarHBondContact O-N 2.96Å; E610-N612 PolarHBondContact O-N 2.86Å; N612-M616 WeakPolarHBondContact O-CB 3.26Å; N612-M616 PolarHBondContact O-N 3.04Å; N612-M616 VanDerWaalsContact O-N 3.09Å
613	F	92.4	Very high	89.1	Confident	9 Å²	9	62.5 Å²	62.5	4%	0.039	32%	0.316	C	S	.	.	H	α-helix	trans	-71.4	-44.7	177.4	-178.2	-92.4	0	0	0	111.8	A578 P579 Y585 T603 L605 Q609 E610 R615 M616 V617 I625	A578-F613 HydrophobicContact CB-CD2 4.5Å; P579-F613 HydrophobicContact CG-CE2 4.06Å; Y585-F613 HydrophobicContact CD1-CZ 4.43Å; Y585-F613 HydrophobicContact CD2-CE2 4.25Å; Y585-F613 AromaticContact CD2-CZ 3.92Å; Y585-F613 HydrophobicContact CD2-CZ 3.92Å; Y585-F613 HydrophobicContact CE1-CZ 4.21Å; Y585-F613 HydrophobicContact CE2-CE2 4.47Å; Y585-F613 AromaticContact CE2-CZ 3.7Å; Y585-F613 HydrophobicContact CE2-CZ 3.7Å; Y585-F613 HydrophobicContact CG-CE2 4.46Å; Y585-F613 HydrophobicContact CG-CZ 4.28Å; Y585-F613 AromaticContact CZ-CZ 3.84Å; T603-F613 HydrophobicContact CG2-CE1 4.11Å; T603-F613 HydrophobicContact CG2-CE2 4.13Å; T603-F613 HydrophobicContact CG2-CZ 3.78Å; L605-F613 HydrophobicContact CD1-CB 4.13Å; L605-F613 HydrophobicContact CD1-CD1 3.56Å; L605-F613 HydrophobicContact CD1-CE1 4.3Å; L605-F613 HydrophobicContact CD1-CG 4.05Å; L605-F613 HydrophobicContact CD2-CB 3.98Å; L605-F613 HydrophobicContact CD2-CD1 3.86Å; L605-F613 HydrophobicContact CD2-CD2 4.15Å; L605-F613 HydrophobicContact CD2-CE1 4.41Å; L605-F613 HydrophobicContact CD2-CG 3.7Å; L605-F613 HydrophobicContact CG-CD1 4.31Å; Q609-F613 VanDerWaalsContact O-CB 3.25Å; Q609-F613 WeakPolarHBondContact O-CB 3.38Å; Q609-F613 PolarHBondContact O-N 2.95Å; E610-F613 PolarHBondContact O-N 3.31Å; F613-R615 VanDerWaalsContact C-N 3.34Å; F613-R615 PolarHBondContact O-N 3.16Å; F613-M616 HydrophobicContact CD2-CE 3.55Å; F613-M616 HydrophobicContact CE2-CE 3.59Å; F613-M616 HydrophobicContact CG-CE 4.46Å; F613-M616 PolarHBondContact O-N 3.39Å; F613-V617 HydrophobicContact CD1-CG2 4.17Å; F613-V617 HydrophobicContact CE1-CG2 3.71Å; F613-V617 HydrophobicContact CE2-CG2 4.14Å; F613-V617 HydrophobicContact CZ-CG2 3.68Å; F613-V617 WeakPolarHBondContact O-CG2 3.25Å; F613-V617 PolarHBondContact O-N 3.43Å; F613-I625 HydrophobicContact CE1-CD1 3.79Å
614	L	91.6	Very high	88.4	Confident	39 Å²	39	64.6 Å²	64.6	20%	0.204	34%	0.338	C	S	.	.	H	α-helix	trans	-61.5	-42.3	177.7	-69.1	172.7	0	0	0	111.4	Y479 E610 V617 M618 I625	Y479-L614 HydrophobicContact CD1-CD2 3.9Å; Y479-L614 HydrophobicContact CE1-CD1 4.29Å; Y479-L614 HydrophobicContact CE1-CD2 3.85Å; Y479-L614 HydrophobicContact CG-CD2 4.45Å; E610-L614 WeakPolarHBondContact O-CB 3.42Å; E610-L614 VanDerWaalsContact O-CG 3.22Å; E610-L614 WeakPolarHBondContact O-CG 3.21Å; E610-L614 PolarHBondContact O-N 3.4Å; L614-V617 PolarHBondContact O-N 3.46Å; L614-M618 VanDerWaalsContact O-CB 3.28Å; L614-M618 WeakPolarHBondContact O-CB 3.46Å; L614-M618 PolarHBondContact O-N 3.18Å; L614-I625 HydrophobicContact CD2-CG2 3.5Å; L614-I625 VanDerWaalsContact CD2-CG2 3.5Å
615	R	90.4	Very high	88	Confident	155 Å²	155	66 Å²	66	59%	0.585	35%	0.345	S	S	*	.	H	α-helix	trans	-59	-53	172.4	-171.5	-177.5	-62	161	1.1	111.4	N611 F613 V617 M618 D619	N611-R615 WeakPolarHBondContact O-CB 3.15Å; N611-R615 PolarHBondContact O-N 2.91Å; N611-R615 VanDerWaalsContact O-N 3.08Å; F613-R615 VanDerWaalsContact C-N 3.34Å; F613-R615 PolarHBondContact O-N 3.16Å; R615-V617 PolarHBondContact O-N 3.49Å; R615-V617 VanDerWaalsContact O-N 3.15Å; R615-M618 PolarHBondContact O-N 3.07Å; R615-M618 VanDerWaalsContact O-N 3.09Å; R615-D619 WeakPolarHBondContact O-CB 3.24Å; R615-D619 PolarHBondContact O-N 2.81Å
616	M	91.3	Very high	87.9	Confident	35 Å²	35	71.1 Å²	71.1	17%	0.172	37%	0.369	C	S	.	.	H	α-helix	trans	-54.2	-36.5	178.8	179.6	-169.4	72.5	0	0	113.5	I582 N612 F613 A620	I582-M616 HydrophobicContact CB-CG 3.91Å; I582-M616 HydrophobicContact CB-SD 4.22Å; I582-M616 PolarHBondContact N-SD 2.98Å; N612-M616 WeakPolarHBondContact O-CB 3.26Å; N612-M616 PolarHBondContact O-N 3.04Å; N612-M616 VanDerWaalsContact O-N 3.09Å; F613-M616 HydrophobicContact CD2-CE 3.55Å; F613-M616 HydrophobicContact CE2-CE 3.59Å; F613-M616 HydrophobicContact CG-CE 4.46Å; F613-M616 PolarHBondContact O-N 3.39Å; M616-A620 WeakPolarHBondContact O-CB 3.48Å
617	V	89.6	Confident	87.9	Confident	1 Å²	1	76.7 Å²	76.7	1%	0.006	39%	0.388	C	S	.	.	H	α-helix	trans	-81.5	-32.2	-179.9	172.3	0	0	0	0	112.1	I582 Y585 F613 L614 R615 S622 I625	I582-V617 HydrophobicContact CD1-CG2 4.42Å; Y585-V617 HydrophobicContact CD1-CG2 3.81Å; Y585-V617 HydrophobicContact CE1-CG1 4.07Å; Y585-V617 HydrophobicContact CE1-CG2 3.66Å; F613-V617 HydrophobicContact CD1-CG2 4.17Å; F613-V617 HydrophobicContact CE1-CG2 3.71Å; F613-V617 HydrophobicContact CE2-CG2 4.14Å; F613-V617 HydrophobicContact CZ-CG2 3.68Å; F613-V617 WeakPolarHBondContact O-CG2 3.25Å; F613-V617 PolarHBondContact O-N 3.43Å; L614-V617 PolarHBondContact O-N 3.46Å; R615-V617 PolarHBondContact O-N 3.49Å; R615-V617 VanDerWaalsContact O-N 3.15Å; V617-S622 VanDerWaalsContact CG1-CB 3.4Å; V617-S622 WeakPolarHBondContact O-CB 3.16Å; V617-S622 PolarHBondContact O-N 3.17Å; V617-I625 HydrophobicContact CG1-CG2 4.28Å
618	M	86.8	Confident	87.8	Confident	148 Å²	148	69 Å²	69	73%	0.729	36%	0.361	S	S	*	.	H	α-helix	trans	-70.9	-48.3	174	-172.3	-178.3	-63.4	0	0	111.9	L614 R615 A620 G621	L614-M618 VanDerWaalsContact O-CB 3.28Å; L614-M618 WeakPolarHBondContact O-CB 3.46Å; L614-M618 PolarHBondContact O-N 3.18Å; R615-M618 PolarHBondContact O-N 3.07Å; R615-M618 VanDerWaalsContact O-N 3.09Å; M618-A620 PolarHBondContact O-N 3.12Å; M618-A620 VanDerWaalsContact O-N 3.12Å; M618-G621 PolarHBondContact O-N 3.3Å
619	D	86.1	Confident	87.6	Confident	57 Å²	57	67.4 Å²	67.4	31%	0.305	35%	0.353	S	S	.	.	H	α-helix	trans	-53.7	-32.7	175.9	-67.2	-5.5	0	0	0	112.2	H466 R615 G621	H466-D619 HydrophobicContact CB-CB 4.2Å; H466-D619 WeakPolarHBondContact CB-O 3.25Å; H466-D619 IonicContact CE1-OD2 3.23Å; H466-D619 PolarHBondContact CE1-OD2 2.8Å; H466-D619 IonicContact ND1-OD2 3.93Å; H466-D619 PolarHBondContact ND1-OD2 2.91Å; R615-D619 WeakPolarHBondContact O-CB 3.24Å; R615-D619 PolarHBondContact O-N 2.81Å; D619-G621 VanDerWaalsContact C-N 3.35Å
620	A	83.9	Confident	87.2	Confident	3 Å²	3	66.6 Å²	66.6	3%	0.025	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-16.9	179.9	0	0	0	0	0	114.6	R468 F469 F471 I582 M616 M618	R468-A620 WeakPolarHBondContact CA-O 3.4Å; F469-A620 HydrophobicContact CD2-CB 4.11Å; F469-A620 PolarHBondContact N-O 3.1Å; F471-A620 HydrophobicContact CE2-CB 4.09Å; F471-A620 HydrophobicContact CZ-CB 4.04Å; I582-A620 HydrophobicContact CD1-CB 3.45Å; I582-A620 VanDerWaalsContact CD1-CB 3.45Å; I582-A620 HydrophobicContact CG1-CB 3.52Å; M616-A620 WeakPolarHBondContact O-CB 3.48Å; M618-A620 PolarHBondContact O-N 3.12Å; M618-A620 VanDerWaalsContact O-N 3.12Å
621	G	82.1	Confident	86.7	Confident	41 Å²	41	72.4 Å²	72.4	42%	0.423	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.7	35.4	-175	0	0	0	0	0	115.3	M618 D619	M618-G621 PolarHBondContact O-N 3.3Å; D619-G621 VanDerWaalsContact C-N 3.35Å
622	S	81.7	Confident	86.1	Confident	22 Å²	22	70 Å²	70	15%	0.154	37%	0.367	C	S	.	.			trans	-57.3	144.2	168.1	163.1	0	0	0	0	111.2	E477 V617 G624	E477-S622 PolarHBondContact OE1-OG 3.15Å; V617-S622 VanDerWaalsContact CG1-CB 3.4Å; V617-S622 WeakPolarHBondContact O-CB 3.16Å; V617-S622 PolarHBondContact O-N 3.17Å; S622-G624 PolarHBondContact O-N 2.92Å; S622-G624 PolarHBondContact OG-N 3.37Å; S622-G624 VanDerWaalsContact OG-N 3.17Å
623	P	72.3	Confident	85.4	Confident	109 Å²	109	70 Å²	70	71%	0.708	36%	0.363	S	S	*	.	S	Bend	trans	-67.3	-7.5	175.5	29.3	-36.6	0	0	0	114.5
624	G	80.2	Confident	84.8	Confident	44 Å²	44	72.1 Å²	72.1	45%	0.454	38%	0.379	S	S	.	.			trans	128.3	104.2	173.3	0	0	0	0	0	112.9	S622	S622-G624 PolarHBondContact O-N 2.92Å; S622-G624 PolarHBondContact OG-N 3.37Å; S622-G624 VanDerWaalsContact OG-N 3.17Å
625	I	88.3	Confident	84.2	Confident	29 Å²	29	70.6 Å²	70.6	15%	0.149	37%	0.371	C	S	.	.			trans	-80.3	124.8	177.9	-170.4	174	0	0	0	111.8	E477 Y479 F613 L614 V617	E477-I625 HydrophobicContact CB-CB 4.15Å; E477-I625 HydrophobicContact CB-CG1 3.93Å; Y479-I625 HydrophobicContact CD1-CG1 4.28Å; F613-I625 HydrophobicContact CE1-CD1 3.79Å; L614-I625 HydrophobicContact CD2-CG2 3.5Å; L614-I625 VanDerWaalsContact CD2-CG2 3.5Å; V617-I625 HydrophobicContact CG1-CG2 4.28Å
626	Q	91.3	Very high	83.6	Confident	108 Å²	108	68.7 Å²	68.7	51%	0.505	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	148.7	-174.4	-60.4	-174.9	9.1	0	0	112.3	E477 F478 Y479	E477-Q626 PolarHBondContact O-N 2.87Å; F478-Q626 CarbonylContact C-O 3.5Å; F478-Q626 VanDerWaalsContact CA-O 3.26Å; F478-Q626 WeakPolarHBondContact CA-O 3.41Å; F478-Q626 HydrophobicContact CD1-CB 3.73Å; F478-Q626 HydrophobicContact CE1-CB 3.88Å; Y479-Q626 WeakPolarHBondContact CD1-O 3.43Å; Y479-Q626 PolarHBondContact N-O 3.22Å
627	R	92.6	Very high	83.1	Confident	153 Å²	153	70.2 Å²	70.2	58%	0.577	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	115.3	176.1	-171.1	-179	-163.8	-177.2	8.7	110.7	Y479 E610	Y479-R627 HydrophobicContact CD1-CB 4.23Å; Y479-R627 HydrophobicContact CE1-CB 3.53Å; Y479-R627 HydrophobicContact CE1-CG 3.92Å; Y479-R627 HydrophobicContact CE2-CB 4.47Å; Y479-R627 HydrophobicContact CE2-CG 3.94Å; Y479-R627 WeakPolarHBondContact OH-CD 3.42Å; E610-R627 IonicContact OE2-NH2 2.7Å
628	Q	89.3	Confident	82.8	Confident	53 Å²	53	70.4 Å²	70.4	25%	0.248	39%	0.392	C	S	.	.			trans	-103.3	112.4	170.4	-178.6	162.5	-29.1	0	0	111.1	F478 Y479 V480	F478-Q628 HydrophobicContact CD1-CB 4.16Å; Y479-Q628 PolarHBondContact O-N 3.01Å; V480-Q628 HydrophobicContact CG2-CB 4.44Å
629	L	85.4	Confident	82.8	Confident	123 Å²	123	65.5 Å²	65.5	64%	0.644	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-88	123.8	171.6	-166.7	80.6	0	0	0	109.9	P481	P481-L629 HydrophobicContact CG-CD1 4.26Å
630	V	83.4	Confident	82.8	Confident	22 Å²	22	71 Å²	71	13%	0.133	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-90.1	122.7	167.5	-179.3	0	0	0	0	108.2	V480 L490 F494 L635	V480-V630 HydrophobicContact CG1-CG2 4.23Å; L490-V630 HydrophobicContact CD2-CB 3.74Å; L490-V630 HydrophobicContact CD2-CG1 3.93Å; L490-V630 HydrophobicContact CD2-CG2 3.72Å; F494-V630 HydrophobicContact CE1-CG2 3.83Å; F494-V630 HydrophobicContact CZ-CG2 4.38Å; V630-L635 HydrophobicContact CG1-CD2 4.28Å; V630-L635 HydrophobicContact CG1-CG 4.4Å
631	K	80.9	Confident	83	Confident	141 Å²	141	75.4 Å²	75.4	61%	0.613	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-63.9	131.2	178.5	-70.8	-172.6	177.5	-176.6	0	110.2	E633 C634	K631-E633 PolarHBondContact O-N 3.23Å; K631-E633 VanDerWaalsContact O-N 3.12Å; K631-C634 WeakPolarHBondContact O-CB 3.49Å; K631-C634 PolarHBondContact O-N 3.4Å; K631-C634 VanDerWaalsContact O-N 3.07Å
632	P	76.4	Confident	83.2	Confident	68 Å²	68	74 Å²	74	44%	0.442	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-31.8	179.2	-27.5	35.5	0	0	0	113.8	C634 L635 K636	P632-C634 PolarHBondContact O-N 3.1Å; P632-L635 PolarHBondContact O-N 3.32Å; P632-K636 PolarHBondContact O-N 2.82Å
633	E	78.1	Confident	83.6	Confident	109 Å²	109	78.6 Å²	78.6	51%	0.509	41%	0.41	S	S	.	.	H	α-helix	trans	-55.7	-36.7	178.9	-68.3	55	-113.9	0	0	111.9	K631 L635 K636	K631-E633 PolarHBondContact O-N 3.23Å; K631-E633 VanDerWaalsContact O-N 3.12Å; E633-L635 PolarHBondContact O-N 3.07Å; E633-K636 IonicContact OE1-NZ 2.73Å; E633-K636 PolarHBondContact OE1-NZ 3.42Å
634	C	78.1	Confident	84.5	Confident	54 Å²	54	77.1 Å²	77.1	37%	0.365	40%	0.399	S	S	.	.	H	α-helix	trans	-72.2	-10.3	179.2	-57.8	0	0	0	0	113.8	K631 P632	K631-C634 WeakPolarHBondContact O-CB 3.49Å; K631-C634 PolarHBondContact O-N 3.4Å; K631-C634 VanDerWaalsContact O-N 3.07Å; P632-C634 PolarHBondContact O-N 3.1Å
635	L	80.5	Confident	85	Confident	7 Å²	7	75.3 Å²	75.3	4%	0.037	38%	0.379	C	S	.	.	H	α-helix	trans	-104.8	-27.6	178.6	-55.2	-179	0	0	0	112.5	K486 L489 L490 H493 V630 P632 E633 G637 M638 E639	K486-L635 HydrophobicContact CD-CD1 4.38Å; L489-L635 HydrophobicContact CB-CD2 4.39Å; L490-L635 HydrophobicContact CD2-CD1 4.14Å; L490-L635 HydrophobicContact CD2-CD2 4.5Å; H493-L635 HydrophobicContact CB-CD2 3.84Å; V630-L635 HydrophobicContact CG1-CD2 4.28Å; V630-L635 HydrophobicContact CG1-CG 4.4Å; P632-L635 PolarHBondContact O-N 3.32Å; E633-L635 PolarHBondContact O-N 3.07Å; L635-G637 PolarHBondContact O-N 2.95Å; L635-G637 VanDerWaalsContact O-N 3.11Å; L635-M638 WeakPolarHBondContact O-CA 3.4Å; L635-M638 WeakPolarHBondContact O-CB 3.45Å; L635-M638 PolarHBondContact O-N 3.4Å; L635-E639 PolarHBondContact O-N 3.41Å
636	K	78.4	Confident	85	Confident	115 Å²	115	75.6 Å²	75.6	50%	0.5	38%	0.38	S	S	.	.	H	α-helix	trans	-52.2	-36.1	-176.7	-71.5	173.8	-175.5	163	0	114	P632 E633 M638 E639	P632-K636 PolarHBondContact O-N 2.82Å; E633-K636 IonicContact OE1-NZ 2.73Å; E633-K636 PolarHBondContact OE1-NZ 3.42Å; K636-M638 PolarHBondContact O-N 2.58Å; K636-E639 WeakPolarHBondContact CA-OE2 3.42Å
637	G	80.1	Confident	84.9	Confident	67 Å²	67	76.8 Å²	76.8	69%	0.691	39%	0.386	S	S	*	.	H	α-helix	trans	-67.3	-21.6	176.8	0	0	0	0	0	114.6	L635	L635-G637 PolarHBondContact O-N 2.95Å; L635-G637 VanDerWaalsContact O-N 3.11Å
638	M	83.2	Confident	84.9	Confident	5 Å²	5	73.7 Å²	73.7	3%	0.025	38%	0.378	C	S	.	.	H	α-helix	trans	-99.6	-23.8	-178.6	-52.8	-179.1	77.4	0	0	112.8	L489 L492 H493 L496 Y497 F523 L635 K636 K640 Q641 Y642	L489-M638 HydrophobicContact CD2-CB 3.81Å; L492-M638 HydrophobicContact CB-CE 3.6Å; L492-M638 HydrophobicContact CD1-CE 4.47Å; H493-M638 HydrophobicContact CB-SD 4.38Å; L496-M638 HydrophobicContact CD1-CE 3.9Å; Y497-M638 HydrophobicContact CD2-SD 4.25Å; Y497-M638 HydrophobicContact CE2-CE 4.26Å; Y497-M638 HydrophobicContact CE2-CG 4.15Å; Y497-M638 HydrophobicContact CE2-SD 3.58Å; Y497-M638 VanDerWaalsContact CE2-SD 3.58Å; F523-M638 HydrophobicContact CE1-CE 3.71Å; F523-M638 HydrophobicContact CZ-CB 4.23Å; F523-M638 HydrophobicContact CZ-CE 3.62Å; L635-M638 WeakPolarHBondContact O-CA 3.4Å; L635-M638 WeakPolarHBondContact O-CB 3.45Å; L635-M638 PolarHBondContact O-N 3.4Å; K636-M638 PolarHBondContact O-N 2.58Å; M638-K640 VanDerWaalsContact C-N 3.33Å; M638-K640 PolarHBondContact O-N 3.48Å; M638-Q641 PolarHBondContact O-N 2.95Å; M638-Y642 VanDerWaalsContact O-CB 3.28Å; M638-Y642 WeakPolarHBondContact O-CB 3.32Å; M638-Y642 PolarHBondContact O-N 3.41Å
639	E	86.2	Confident	84.9	Confident	46 Å²	46	71.2 Å²	71.2	22%	0.215	37%	0.367	C	S	.	.	H	α-helix	trans	-56.8	-42.3	-173	-78.7	172.4	159.7	0	0	112.4	K486 L489 L635 K636 Y642 E643	K486-E639 WeakPolarHBondContact CE-OE1 3.32Å; K486-E639 IonicContact NZ-OE1 3.55Å; K486-E639 PolarHBondContact NZ-OE1 2.92Å; L489-E639 HydrophobicContact CD1-CG 3.67Å; L635-E639 PolarHBondContact O-N 3.41Å; K636-E639 WeakPolarHBondContact CA-OE2 3.42Å; E639-Y642 PolarHBondContact O-N 3.21Å; E639-E643 WeakPolarHBondContact O-CG 3.23Å; E639-E643 PolarHBondContact O-N 2.99Å
640	K	86.7	Confident	85.1	Confident	171 Å²	171	66.3 Å²	66.3	74%	0.743	34%	0.343	S	S	*	.	H	α-helix	trans	-61.6	-48.5	176.9	-65.3	-172.8	177.4	-173.6	0	113.6	M638 Y642 E643 V644	M638-K640 VanDerWaalsContact C-N 3.33Å; M638-K640 PolarHBondContact O-N 3.48Å; K640-Y642 VanDerWaalsContact C-N 3.31Å; K640-Y642 PolarHBondContact O-N 2.95Å; K640-E643 PolarHBondContact O-N 3Å; K640-V644 PolarHBondContact O-N 3.4Å
641	Q	86.9	Confident	85.4	Confident	96 Å²	96	69 Å²	69	45%	0.449	36%	0.357	S	S	.	.	H	α-helix	trans	-66.5	-37.7	179.5	-175.7	-174.5	-6.7	0	0	110.8	F523 M638 V644 V645	F523-Q641 HydrophobicContact CD2-CG 4.14Å; F523-Q641 HydrophobicContact CE2-CB 3.88Å; F523-Q641 HydrophobicContact CE2-CG 3.73Å; F523-Q641 HydrophobicContact CZ-CB 4.29Å; F523-Q641 HydrophobicContact CZ-CG 4.16Å; F523-Q641 VanDerWaalsContact CZ-OE1 3.3Å; F523-Q641 PolarHBondContact O-NE2 2.92Å; M638-Q641 PolarHBondContact O-N 2.95Å; Q641-V644 PolarHBondContact O-N 3.3Å; Q641-V645 WeakPolarHBondContact O-CG2 3.42Å; Q641-V645 PolarHBondContact O-N 2.65Å
642	Y	88.3	Confident	85.8	Confident	13 Å²	13	64.9 Å²	64.9	5%	0.051	34%	0.344	C	S	.	.	H	α-helix	trans	-64.3	-37.9	177.3	172.6	-113.3	0	0	0	112.8	N485 P488 L489 L519 M638 E639 K640 V644 V645 L646	N485-Y642 WeakPolarHBondContact O-CE1 3.44Å; N485-Y642 PolarHBondContact O-OH 2.99Å; P488-Y642 HydrophobicContact CB-CE2 3.66Å; P488-Y642 WeakPolarHBondContact CD-OH 3.45Å; P488-Y642 HydrophobicContact CG-CE2 4.13Å; P488-Y642 VanDerWaalsContact CG-OH 3.3Å; P488-Y642 WeakPolarHBondContact CG-OH 3.47Å; L489-Y642 HydrophobicContact CD1-CD1 3.74Å; L489-Y642 HydrophobicContact CD1-CE1 3.86Å; L489-Y642 HydrophobicContact CD1-CG 4.38Å; L489-Y642 HydrophobicContact CD2-CD1 3.82Å; L489-Y642 HydrophobicContact CD2-CD2 4.08Å; L489-Y642 HydrophobicContact CD2-CE1 4.44Å; L489-Y642 HydrophobicContact CD2-CG 3.59Å; L489-Y642 HydrophobicContact CG-CD1 3.73Å; L489-Y642 HydrophobicContact CG-CD2 4.27Å; L489-Y642 HydrophobicContact CG-CE1 3.87Å; L489-Y642 HydrophobicContact CG-CE2 4.42Å; L489-Y642 HydrophobicContact CG-CG 3.91Å; L519-Y642 HydrophobicContact CD1-CD2 4.36Å; L519-Y642 HydrophobicContact CD1-CE2 3.68Å; L519-Y642 HydrophobicContact CD2-CD2 4.23Å; L519-Y642 HydrophobicContact CD2-CE2 4.1Å; L519-Y642 HydrophobicContact CG-CE2 4.48Å; M638-Y642 VanDerWaalsContact O-CB 3.28Å; M638-Y642 WeakPolarHBondContact O-CB 3.32Å; M638-Y642 PolarHBondContact O-N 3.41Å; E639-Y642 PolarHBondContact O-N 3.21Å; K640-Y642 VanDerWaalsContact C-N 3.31Å; K640-Y642 PolarHBondContact O-N 2.95Å; Y642-V644 PolarHBondContact O-N 3.48Å; Y642-V645 PolarHBondContact O-N 2.76Å; Y642-L646 HydrophobicContact CD1-CD1 4.01Å; Y642-L646 HydrophobicContact CD2-CG 4.3Å; Y642-L646 HydrophobicContact CE1-CD1 3.61Å; Y642-L646 HydrophobicContact CE1-CG 4.34Å; Y642-L646 HydrophobicContact CE2-CD1 4.16Å; Y642-L646 HydrophobicContact CE2-CD2 4.09Å; Y642-L646 HydrophobicContact CE2-CG 4.01Å; Y642-L646 HydrophobicContact CG-CD1 4.48Å; Y642-L646 WeakPolarHBondContact O-CB 3.34Å; Y642-L646 VanDerWaalsContact O-CG 3.27Å; Y642-L646 WeakPolarHBondContact O-CG 3.5Å; Y642-L646 PolarHBondContact O-N 2.87Å
643	E	88.9	Confident	86.4	Confident	117 Å²	117	62.9 Å²	62.9	55%	0.547	33%	0.329	S	S	.	.	H	α-helix	trans	-64.8	-36.2	175.8	-76.4	176.5	171.4	0	0	113.1	E639 K640	E639-E643 WeakPolarHBondContact O-CG 3.23Å; E639-E643 PolarHBondContact O-N 2.99Å; K640-E643 PolarHBondContact O-N 3Å
644	V	90.9	Very high	86.8	Confident	79 Å²	79	63.5 Å²	63.5	48%	0.479	33%	0.33	S	S	.	.	H	α-helix	trans	-67	-51.3	172.4	179.3	0	0	0	0	110.6	K640 Q641 Y642 L646 Q647 E648	K640-V644 PolarHBondContact O-N 3.4Å; Q641-V644 PolarHBondContact O-N 3.3Å; Y642-V644 PolarHBondContact O-N 3.48Å; V644-L646 PolarHBondContact O-N 3.11Å; V644-Q647 WeakPolarHBondContact O-CA 3.26Å; V644-Q647 WeakPolarHBondContact O-CB 3.46Å; V644-Q647 PolarHBondContact O-N 2.7Å; V644-E648 PolarHBondContact O-N 2.86Å
645	V	90.2	Very high	87.3	Confident	6 Å²	6	64.8 Å²	64.8	4%	0.036	33%	0.333	C	S	.	.	H	α-helix	trans	-60.6	-29	179.4	169.2	0	0	0	0	112.5	L519 L522 F523 Q641 Y642 Q647 L649	L519-V645 HydrophobicContact CG-CG1 4.22Å; L522-V645 HydrophobicContact CB-CG1 3.74Å; F523-V645 HydrophobicContact CB-CG1 4.35Å; F523-V645 HydrophobicContact CB-CG2 4.49Å; F523-V645 HydrophobicContact CD2-CG2 4.26Å; Q641-V645 WeakPolarHBondContact O-CG2 3.42Å; Q641-V645 PolarHBondContact O-N 2.65Å; Y642-V645 PolarHBondContact O-N 2.76Å; V645-Q647 VanDerWaalsContact C-N 3.33Å; V645-L649 WeakPolarHBondContact O-CB 3.47Å; V645-L649 PolarHBondContact O-N 3.38Å
646	L	89.2	Confident	87.5	Confident	34 Å²	34	68 Å²	68	18%	0.178	35%	0.348	C	S	.	.	H	α-helix	trans	-68	-28.8	172.6	-79.8	176.5	0	0	0	113.5	L3 F4 L519 Y642 V644 A650	L3-L646 HydrophobicContact CD1-CB 4.37Å; L3-L646 HydrophobicContact CD1-CD2 4.29Å; L3-L646 WeakPolarHBondContact CD1-O 3.37Å; F4-L646 HydrophobicContact CE2-CD2 3.89Å; L519-L646 HydrophobicContact CD1-CD2 3.74Å; Y642-L646 HydrophobicContact CD1-CD1 4.01Å; Y642-L646 HydrophobicContact CD2-CG 4.3Å; Y642-L646 HydrophobicContact CE1-CD1 3.61Å; Y642-L646 HydrophobicContact CE1-CG 4.34Å; Y642-L646 HydrophobicContact CE2-CD1 4.16Å; Y642-L646 HydrophobicContact CE2-CD2 4.09Å; Y642-L646 HydrophobicContact CE2-CG 4.01Å; Y642-L646 HydrophobicContact CG-CD1 4.48Å; Y642-L646 WeakPolarHBondContact O-CB 3.34Å; Y642-L646 VanDerWaalsContact O-CG 3.27Å; Y642-L646 WeakPolarHBondContact O-CG 3.5Å; Y642-L646 PolarHBondContact O-N 2.87Å; V644-L646 PolarHBondContact O-N 3.11Å; L646-A650 PolarHBondContact O-N 2.75Å
647	Q	89.9	Confident	87.6	Confident	134 Å²	134	69.4 Å²	69.4	63%	0.626	35%	0.354	S	S	*	.	H	α-helix	trans	-74.6	-52.2	174.9	-62.3	176	25	0	0	109.7	V644 V645 L649 A650 D651	V644-Q647 WeakPolarHBondContact O-CA 3.26Å; V644-Q647 WeakPolarHBondContact O-CB 3.46Å; V644-Q647 PolarHBondContact O-N 2.7Å; V645-Q647 VanDerWaalsContact C-N 3.33Å; Q647-L649 VanDerWaalsContact C-N 3.29Å; Q647-L649 PolarHBondContact O-N 3.4Å; Q647-A650 WeakPolarHBondContact O-CA 3.18Å; Q647-A650 VanDerWaalsContact O-CB 3.27Å; Q647-A650 WeakPolarHBondContact O-CB 3.19Å; Q647-A650 PolarHBondContact O-N 3.11Å; Q647-D651 PolarHBondContact O-N 3.02Å
648	E	90.9	Very high	87.4	Confident	88 Å²	88	70.6 Å²	70.6	41%	0.411	35%	0.352	S	S	.	.	H	α-helix	trans	-52.2	-46	174.6	-63.5	173.5	-179.3	0	0	112.1	L522 V644 A650 D651 V652	L522-E648 HydrophobicContact CD1-CB 4.31Å; V644-E648 PolarHBondContact O-N 2.86Å; E648-A650 VanDerWaalsContact C-N 3.3Å; E648-A650 PolarHBondContact O-N 2.78Å; E648-D651 PolarHBondContact O-N 3.31Å; E648-D651 VanDerWaalsContact O-N 3.16Å; E648-V652 WeakPolarHBondContact O-CG2 3.33Å; E648-V652 PolarHBondContact O-N 3.06Å
649	L	90.4	Very high	86.7	Confident	1 Å²	1	79.1 Å²	79.1	1%	0.005	38%	0.384	C	S	.	.	H	α-helix	trans	-62.6	-34.9	177.1	179.9	66.6	0	0	0	112.7	C518 L519 L522 V645 Q647 D651 I653	C518-L649 HydrophobicContact CB-CD1 3.61Å; L519-L649 HydrophobicContact CB-CD2 3.71Å; L519-L649 HydrophobicContact CD1-CD2 3.71Å; L519-L649 HydrophobicContact CG-CD2 4Å; L522-L649 HydrophobicContact CD1-CB 3.96Å; L522-L649 HydrophobicContact CD1-CD1 4.16Å; V645-L649 WeakPolarHBondContact O-CB 3.47Å; V645-L649 PolarHBondContact O-N 3.38Å; Q647-L649 VanDerWaalsContact C-N 3.29Å; Q647-L649 PolarHBondContact O-N 3.4Å; L649-D651 VanDerWaalsContact C-N 3.26Å; L649-D651 PolarHBondContact O-N 3.24Å; L649-I653 HydrophobicContact CD1-CD1 3.84Å; L649-I653 HydrophobicContact CD1-CG1 4.2Å; L649-I653 HydrophobicContact CD2-CD1 4.46Å; L649-I653 HydrophobicContact CG-CD1 3.73Å; L649-I653 HydrophobicContact CG-CG1 4.47Å; L649-I653 WeakPolarHBondContact O-CB 3.33Å; L649-I653 WeakPolarHBondContact O-CD1 3.43Å; L649-I653 WeakPolarHBondContact O-CG1 3.3Å; L649-I653 PolarHBondContact O-N 3.19Å
650	A	88.7	Confident	85.1	Confident	19 Å²	19	87.4 Å²	87.4	16%	0.157	42%	0.422	C	S	.	.	H	α-helix	trans	-63.9	-36.3	176.6	0	0	0	0	0	111.2	L3 L646 Q647 E648 K654	L3-A650 HydrophobicContact CD1-CB 3.96Å; L3-A650 HydrophobicContact CD2-CB 3.73Å; L646-A650 PolarHBondContact O-N 2.75Å; Q647-A650 WeakPolarHBondContact O-CA 3.18Å; Q647-A650 VanDerWaalsContact O-CB 3.27Å; Q647-A650 WeakPolarHBondContact O-CB 3.19Å; Q647-A650 PolarHBondContact O-N 3.11Å; E648-A650 VanDerWaalsContact C-N 3.3Å; E648-A650 PolarHBondContact O-N 2.78Å; A650-K654 WeakPolarHBondContact O-CG 3.29Å; A650-K654 PolarHBondContact O-N 2.91Å
651	D	89.5	Confident	85.1	Confident	79 Å²	79	83.2 Å²	83.2	42%	0.422	41%	0.406	S	S	.	.	H	α-helix	trans	-79.6	-42.2	-179.7	-63.6	-34.8	0	0	0	112	Q647 E648 L649 I653 K654 D655	Q647-D651 PolarHBondContact O-N 3.02Å; E648-D651 PolarHBondContact O-N 3.31Å; E648-D651 VanDerWaalsContact O-N 3.16Å; L649-D651 VanDerWaalsContact C-N 3.26Å; L649-D651 PolarHBondContact O-N 3.24Å; D651-I653 PolarHBondContact O-N 3.38Å; D651-K654 WeakPolarHBondContact O-CA 3.46Å; D651-K654 WeakPolarHBondContact O-CB 3.42Å; D651-K654 PolarHBondContact O-N 3.05Å; D651-K654 WeakPolarHBondContact OD1-CE 3.41Å; D651-K654 IonicContact OD1-NZ 2.91Å; D651-K654 PolarHBondContact OD1-NZ 3.45Å; D651-D655 PolarHBondContact O-N 3.4Å
652	V	90.1	Very high	85	Confident	55 Å²	55	82.5 Å²	82.5	33%	0.333	40%	0.404	S	S	.	.	H	α-helix	trans	-55.4	-40.6	170.3	175	0	0	0	0	111.5	L522 E648 K654 D655 E656	L522-V652 HydrophobicContact CD1-CG2 4.44Å; E648-V652 WeakPolarHBondContact O-CG2 3.33Å; E648-V652 PolarHBondContact O-N 3.06Å; V652-K654 VanDerWaalsContact C-N 3.34Å; V652-K654 PolarHBondContact O-N 3.04Å; V652-D655 PolarHBondContact O-N 3.26Å; V652-E656 WeakPolarHBondContact O-CG 3.44Å; V652-E656 PolarHBondContact O-N 3.05Å
653	I	88.6	Confident	84.8	Confident	25 Å²	25	86.4 Å²	86.4	13%	0.128	42%	0.423	C	S	.	.	H	α-helix	trans	-70.9	-25.8	177.2	-68.5	166.2	0	0	0	112.6	R515 L649 D651 K657	R515-I653 HydrophobicContact CG-CD1 3.73Å; L649-I653 HydrophobicContact CD1-CD1 3.84Å; L649-I653 HydrophobicContact CD1-CG1 4.2Å; L649-I653 HydrophobicContact CD2-CD1 4.46Å; L649-I653 HydrophobicContact CG-CD1 3.73Å; L649-I653 HydrophobicContact CG-CG1 4.47Å; L649-I653 WeakPolarHBondContact O-CB 3.33Å; L649-I653 WeakPolarHBondContact O-CD1 3.43Å; L649-I653 WeakPolarHBondContact O-CG1 3.3Å; L649-I653 PolarHBondContact O-N 3.19Å; D651-I653 PolarHBondContact O-N 3.38Å; I653-K657 HydrophobicContact CG2-CD 4.47Å; I653-K657 WeakPolarHBondContact O-CB 3.06Å; I653-K657 WeakPolarHBondContact O-CD 3.22Å; I653-K657 VanDerWaalsContact O-CG 3.22Å; I653-K657 WeakPolarHBondContact O-CG 3.39Å; I653-K657 PolarHBondContact O-N 2.82Å
654	K	87.9	Confident	84.5	Confident	123 Å²	123	84.6 Å²	84.6	54%	0.535	42%	0.416	S	S	.	.	H	α-helix	trans	-72.1	-44.7	170.4	-68.8	165.1	-162.2	168.2	0	110.3	A650 D651 V652 K657 S658	A650-K654 WeakPolarHBondContact O-CG 3.29Å; A650-K654 PolarHBondContact O-N 2.91Å; D651-K654 WeakPolarHBondContact O-CA 3.46Å; D651-K654 WeakPolarHBondContact O-CB 3.42Å; D651-K654 PolarHBondContact O-N 3.05Å; D651-K654 WeakPolarHBondContact OD1-CE 3.41Å; D651-K654 IonicContact OD1-NZ 2.91Å; D651-K654 PolarHBondContact OD1-NZ 3.45Å; V652-K654 VanDerWaalsContact C-N 3.34Å; V652-K654 PolarHBondContact O-N 3.04Å; K654-K657 CarbonylContact O-C 3.52Å; K654-K657 WeakPolarHBondContact O-CA 3.27Å; K654-K657 WeakPolarHBondContact O-CB 3.42Å; K654-K657 PolarHBondContact O-N 3.42Å; K654-K657 VanDerWaalsContact O-N 3.07Å; K654-S658 PolarHBondContact O-N 3.2Å; K654-S658 PolarHBondContact O-OG 3.39Å
655	D	87.2	Confident	84.1	Confident	81 Å²	81	84.9 Å²	84.9	43%	0.433	41%	0.412	S	S	.	.	H	α-helix	trans	-65.8	-37.1	-179.2	-88.6	22.9	0	0	0	113.3	D651 V652 K657 S658 R659	D651-D655 PolarHBondContact O-N 3.4Å; V652-D655 PolarHBondContact O-N 3.26Å; D655-K657 VanDerWaalsContact C-N 3.29Å; D655-S658 PolarHBondContact O-OG 3.38Å; D655-S658 VanDerWaalsContact O-OG 3.13Å; D655-R659 VanDerWaalsContact O-CD 3.26Å; D655-R659 WeakPolarHBondContact O-CD 3.34Å; D655-R659 WeakPolarHBondContact O-CG 3.44Å; D655-R659 PolarHBondContact O-NE 3.07Å; D655-R659 IonicContact OD2-NH2 3.76Å; D655-R659 PolarHBondContact OD2-NH2 3.09Å
656	E	85.3	Confident	83.7	Confident	73 Å²	73	90.2 Å²	90.2	34%	0.341	44%	0.437	S	S	.	.	H	α-helix	trans	-69.3	-28.5	171.6	-72.8	-178.9	151.3	0	0	112.2	H514 V652	H514-E656 IonicContact CD2-OE2 3.66Å; H514-E656 IonicContact NE2-OE1 3.17Å; H514-E656 IonicContact NE2-OE2 3.62Å; H514-E656 PolarHBondContact NE2-OE2 3.17Å; V652-E656 WeakPolarHBondContact O-CG 3.44Å; V652-E656 PolarHBondContact O-N 3.05Å
657	K	80.3	Confident	83.3	Confident	145 Å²	145	94.2 Å²	94.2	63%	0.63	46%	0.456	S	S	*	.	H	α-helix	trans	-81.2	-20.9	176.7	-81.5	178.7	171.7	-168.4	0	114.5	I653 K654 D655 R659	I653-K657 HydrophobicContact CG2-CD 4.47Å; I653-K657 WeakPolarHBondContact O-CB 3.06Å; I653-K657 WeakPolarHBondContact O-CD 3.22Å; I653-K657 VanDerWaalsContact O-CG 3.22Å; I653-K657 WeakPolarHBondContact O-CG 3.39Å; I653-K657 PolarHBondContact O-N 2.82Å; K654-K657 CarbonylContact O-C 3.52Å; K654-K657 WeakPolarHBondContact O-CA 3.27Å; K654-K657 WeakPolarHBondContact O-CB 3.42Å; K654-K657 PolarHBondContact O-N 3.42Å; K654-K657 VanDerWaalsContact O-N 3.07Å; D655-K657 VanDerWaalsContact C-N 3.29Å; K657-R659 VanDerWaalsContact C-N 3.35Å
658	S	75.7	Confident	82.8	Confident	93 Å²	93	91.2 Å²	91.2	65%	0.65	44%	0.443	S	S	*	.	S	Bend	trans	-87.9	-7.5	175.1	59.9	0	0	0	0	112.9	K654 D655	K654-S658 PolarHBondContact O-N 3.2Å; K654-S658 PolarHBondContact O-OG 3.39Å; D655-S658 PolarHBondContact O-OG 3.38Å; D655-S658 VanDerWaalsContact O-OG 3.13Å
659	R	69.2	Low	82.2	Confident	184 Å²	184	91.4 Å²	91.4	69%	0.694	45%	0.445	S	S	*	.			trans	-104.1	11.6	178.1	-63	170.5	-164	-162.8	6.9	113.3	D655 K657	D655-R659 VanDerWaalsContact O-CD 3.26Å; D655-R659 WeakPolarHBondContact O-CD 3.34Å; D655-R659 WeakPolarHBondContact O-CG 3.44Å; D655-R659 PolarHBondContact O-NE 3.07Å; D655-R659 IonicContact OD2-NH2 3.76Å; D655-R659 PolarHBondContact OD2-NH2 3.09Å; K657-R659 VanDerWaalsContact C-N 3.35Å
660	H	53.2	Low	81.4	Confident	219 Å²	219	99.6 Å²	99.6	100%	1.014	49%	0.485	S	S	*	.			trans	-140.3	0	-174.6	-82.3	-6.5	0	0	0	111.7

Retrieved 660 of 660 residues in 539 ms (Link to these results)

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