A0A3Q0KKG6_SCHMA Loading...

Putative spfh domain / Band 7 family protein

AlphaFold DB , UniProt , Accession A0A3Q0KKG6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 349 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	38.4	Very low	46	Very low	212 Å²	212	124.5 Å²	124.5	100%	1.044	64%	0.635	S	S	*	*				0	127.1	0	-80.5	146.5	140.6	0	0	109.6	K3	M1-K3 PolarHBondContact O-N 3.3Å
2	K	33.7	Very low	46.6	Very low	204 Å²	204	123.6 Å²	123.6	89%	0.887	64%	0.639	S	S	*	*			trans	-67.9	109.8	178.6	-168.1	166.9	-177.4	176.5	0	107.3	R4	K2-R4 PolarHBondContact O-N 3.35Å
3	K	42.6	Very low	46.8	Very low	198 Å²	198	119.7 Å²	119.7	86%	0.861	62%	0.619	S	S	*	*			trans	-51.1	103.7	173.6	-78.3	-178.1	176.4	179.8	0	107.3	M1 S5	M1-K3 PolarHBondContact O-N 3.3Å; K3-S5 PolarHBondContact O-N 3.23Å
4	R	44.5	Very low	46.7	Very low	204 Å²	204	116.1 Å²	116.1	77%	0.77	61%	0.61	S	S	*	*			trans	-61.4	105.5	170.7	-88.3	-177.3	165.4	162.5	-3	105.7	K2 E8	K2-R4 PolarHBondContact O-N 3.35Å; R4-E8 WeakPolarHBondContact CG-OE2 3.06Å; R4-E8 IonicContact NE-OE2 3.63Å
5	S	46	Very low	46.8	Very low	66 Å²	66	118.4 Å²	118.4	46%	0.462	62%	0.623	S	S	.	*			trans	-60.8	142.9	-171.5	178.9	0	0	0	0	109.1	K3 A7 E8	K3-S5 PolarHBondContact O-N 3.23Å; S5-A7 PolarHBondContact O-N 3.42Å; S5-A7 PolarHBondContact OG-N 2.91Å; S5-E8 PolarHBondContact O-N 3.43Å
6	S	52.9	Low	47.1	Very low	81 Å²	81	114.6 Å²	114.6	57%	0.566	61%	0.613	S	S	*	*	H	α-helix	trans	-44.8	-23.5	168.4	45.1	0	0	0	0	113.4	Y9 S10	S6-Y9 PolarHBondContact O-N 3.24Å; S6-S10 PolarHBondContact O-N 3.3Å; S6-S10 VanDerWaalsContact O-N 3.07Å
7	A	49.3	Very low	47.3	Very low	54 Å²	54	112.1 Å²	112.1	45%	0.446	60%	0.604	S	S	.	*	H	α-helix	trans	-58.2	-43.1	172.9	0	0	0	0	0	114.2	S5 Y9 S10 A11	S5-A7 PolarHBondContact O-N 3.42Å; S5-A7 PolarHBondContact OG-N 2.91Å; A7-Y9 PolarHBondContact O-N 3.2Å; A7-S10 WeakPolarHBondContact CA-OG 3.34Å; A7-S10 PolarHBondContact O-N 3.31Å; A7-S10 PolarHBondContact O-OG 3.28Å; A7-A11 PolarHBondContact O-N 3.4Å
8	E	51.1	Low	47.8	Very low	111 Å²	111	109.4 Å²	109.4	52%	0.519	61%	0.606	S	S	.	*	H	α-helix	trans	-66.5	-39	178.7	-85.6	-178.5	150.3	0	0	111.2	R4 S5 S10 A11 V12	R4-E8 WeakPolarHBondContact CG-OE2 3.06Å; R4-E8 IonicContact NE-OE2 3.63Å; S5-E8 PolarHBondContact O-N 3.43Å; E8-S10 VanDerWaalsContact C-N 3.32Å; E8-S10 PolarHBondContact O-N 2.72Å; E8-A11 PolarHBondContact O-N 2.85Å; E8-V12 WeakPolarHBondContact O-CG2 3.48Å; E8-V12 PolarHBondContact O-N 3.21Å; E8-V12 VanDerWaalsContact O-N 3.12Å
9	Y	54.6	Low	48.3	Very low	105 Å²	105	110.4 Å²	110.4	41%	0.412	61%	0.611	S	S	.	*	H	α-helix	trans	-63.5	-37.7	174.1	-87	-83.9	0	0	0	112.1	S6 A7 A11 L13 V124	S6-Y9 PolarHBondContact O-N 3.24Å; A7-Y9 PolarHBondContact O-N 3.2Å; Y9-A11 VanDerWaalsContact C-N 3.31Å; Y9-A11 PolarHBondContact O-N 2.76Å; Y9-L13 VanDerWaalsContact O-CG 3.3Å; Y9-L13 WeakPolarHBondContact O-CG 3.34Å; Y9-L13 PolarHBondContact O-N 3.33Å; Y9-L13 VanDerWaalsContact O-N 3.16Å; Y9-V124 HydrophobicContact CD1-CG2 4.36Å
10	S	46.1	Very low	49.1	Very low	74 Å²	74	107.2 Å²	107.2	52%	0.517	59%	0.592	S	S	.	*	H	α-helix	trans	-66.7	-31.9	175.1	69.4	0	0	0	0	113.1	S6 A7 E8 L13 S14	S6-S10 PolarHBondContact O-N 3.3Å; S6-S10 VanDerWaalsContact O-N 3.07Å; A7-S10 WeakPolarHBondContact CA-OG 3.34Å; A7-S10 PolarHBondContact O-N 3.31Å; A7-S10 PolarHBondContact O-OG 3.28Å; E8-S10 VanDerWaalsContact C-N 3.32Å; E8-S10 PolarHBondContact O-N 2.72Å; S10-L13 PolarHBondContact O-N 3.5Å; S10-S14 WeakPolarHBondContact O-CB 3.46Å; S10-S14 PolarHBondContact O-N 3.43Å
11	A	46.9	Very low	50.3	Low	60 Å²	60	104.3 Å²	104.3	50%	0.496	59%	0.587	S	S	.	*	H	α-helix	trans	-70.3	-44.2	177.6	0	0	0	0	0	111.8	A7 E8 Y9 L13 S14 D15	A7-A11 PolarHBondContact O-N 3.4Å; E8-A11 PolarHBondContact O-N 2.85Å; Y9-A11 VanDerWaalsContact C-N 3.31Å; Y9-A11 PolarHBondContact O-N 2.76Å; A11-L13 VanDerWaalsContact C-N 3.25Å; A11-L13 PolarHBondContact O-N 3.03Å; A11-S14 PolarHBondContact O-N 3.3Å; A11-S14 VanDerWaalsContact O-N 3.12Å; A11-D15 PolarHBondContact O-N 2.73Å
12	V	52.9	Low	52.4	Low	114 Å²	114	99.3 Å²	99.3	69%	0.691	57%	0.572	S	S	*	*	H	α-helix	trans	-62.5	-34.6	175.4	-179.9	0	0	0	0	111.4	E8	E8-V12 WeakPolarHBondContact O-CG2 3.48Å; E8-V12 PolarHBondContact O-N 3.21Å; E8-V12 VanDerWaalsContact O-N 3.12Å
13	L	48.9	Very low	54.8	Low	73 Å²	73	96.5 Å²	96.5	38%	0.382	56%	0.56	S	S	.	*	H	α-helix	trans	-73.3	-31.3	175.1	-70.8	170.8	0	0	0	113.1	Y9 S10 A11 I64 V123	Y9-L13 VanDerWaalsContact O-CG 3.3Å; Y9-L13 WeakPolarHBondContact O-CG 3.34Å; Y9-L13 PolarHBondContact O-N 3.33Å; Y9-L13 VanDerWaalsContact O-N 3.16Å; S10-L13 PolarHBondContact O-N 3.5Å; A11-L13 VanDerWaalsContact C-N 3.25Å; A11-L13 PolarHBondContact O-N 3.03Å; L13-I64 HydrophobicContact CD2-CD1 3.68Å; L13-V123 HydrophobicContact CD1-CG1 4.01Å
14	S	46	Very low	56.7	Low	69 Å²	69	87.4 Å²	87.4	48%	0.483	52%	0.523	S	S	.	.	H	α-helix	trans	-70.1	-34.5	-179.9	-167.5	0	0	0	0	112.4	S10 A11 A16 T17	S10-S14 WeakPolarHBondContact O-CB 3.46Å; S10-S14 PolarHBondContact O-N 3.43Å; A11-S14 PolarHBondContact O-N 3.3Å; A11-S14 VanDerWaalsContact O-N 3.12Å; S14-A16 PolarHBondContact O-N 3.15Å; S14-T17 WeakPolarHBondContact O-CB 3.03Å; S14-T17 WeakPolarHBondContact O-CG2 3.37Å; S14-T17 PolarHBondContact O-N 3.39Å; S14-T17 PolarHBondContact O-OG1 3.18Å
15	D	48.6	Very low	58.7	Low	151 Å²	151	83.4 Å²	83.4	81%	0.807	51%	0.511	S	S	*	.	H	α-helix	trans	-69.2	-20.2	-176.2	-135.8	16.3	0	0	0	112.9	A11 T17	A11-D15 PolarHBondContact O-N 2.73Å; D15-T17 PolarHBondContact O-N 3.1Å
16	A	51.1	Low	60.7	Low	57 Å²	57	85.5 Å²	85.5	47%	0.471	52%	0.516	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	0.4	176.4	0	0	0	0	0	114.4	S14 R63	S14-A16 PolarHBondContact O-N 3.15Å; A16-R63 PolarHBondContact O-NH1 3.3Å
17	T	51.4	Low	62.4	Low	73 Å²	73	84.3 Å²	84.3	45%	0.448	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-14.8	-173.9	54	0	0	0	0	114.9	S14 D15 D19 P66	S14-T17 WeakPolarHBondContact O-CB 3.03Å; S14-T17 WeakPolarHBondContact O-CG2 3.37Å; S14-T17 PolarHBondContact O-N 3.39Å; S14-T17 PolarHBondContact O-OG1 3.18Å; D15-T17 PolarHBondContact O-N 3.1Å; T17-D19 PolarHBondContact O-N 3.25Å; T17-P66 HydrophobicContact CG2-CB 4.41Å
18	G	55.1	Low	64.1	Low	63 Å²	63	83 Å²	83	65%	0.649	49%	0.488	S	S	*	.	S	Bend	trans	-70.2	-29	-172.9	0	0	0	0	0	116.4
19	D	58.6	Low	65.9	Low	129 Å²	129	79.6 Å²	79.6	69%	0.69	48%	0.482	S	S	*	.			trans	-117.6	55.6	-165.3	-98.3	-8.3	0	0	0	113.5	T17 G21 R63	T17-D19 PolarHBondContact O-N 3.25Å; D19-G21 VanDerWaalsContact C-N 3.34Å; D19-G21 PolarHBondContact O-N 3.01Å; D19-G21 VanDerWaalsContact O-N 3.13Å; D19-R63 VanDerWaalsContact C-NH1 3.34Å; D19-R63 PolarHBondContact O-NH1 3.44Å; D19-R63 VanDerWaalsContact O-NH1 3.1Å; D19-R63 PolarHBondContact O-NH2 3.24Å
20	L	64.1	Low	67.6	Low	45 Å²	45	79.4 Å²	79.4	24%	0.236	49%	0.488	C	S	.	.			trans	-68.5	104.4	152.5	-88	79.6	0	0	0	105.5	F25	L20-F25 HydrophobicContact CB-CD2 4Å; L20-F25 HydrophobicContact CB-CE1 4.28Å; L20-F25 HydrophobicContact CB-CE2 3.61Å; L20-F25 HydrophobicContact CB-CZ 3.76Å; L20-F25 WeakPolarHBondContact O-CD2 3.38Å; L20-F25 WeakPolarHBondContact O-CE2 3.48Å
21	G	74.4	Confident	69.5	Low	47 Å²	47	76.4 Å²	76.4	49%	0.485	47%	0.467	S	S	.	.			trans	-52.6	156.2	175.7	0	0	0	0	0	111	D19 F23 G24 F25	D19-G21 VanDerWaalsContact C-N 3.34Å; D19-G21 PolarHBondContact O-N 3.01Å; D19-G21 VanDerWaalsContact O-N 3.13Å; G21-F23 PolarHBondContact O-N 3.08Å; G21-G24 WeakPolarHBondContact O-CA 3.25Å; G21-G24 PolarHBondContact O-N 3.44Å; G21-F25 PolarHBondContact O-N 3.29Å
22	C	82.2	Confident	71.5	Confident	108 Å²	108	78.7 Å²	78.7	73%	0.73	46%	0.463	S	S	*	.	H	α-helix	trans	-47.4	-36.7	-176.6	-61.5	0	0	0	0	113.2	G24 F25 I26	C22-G24 PolarHBondContact O-N 2.93Å; C22-F25 PolarHBondContact O-N 2.93Å; C22-I26 VanDerWaalsContact O-CG1 3.31Å; C22-I26 WeakPolarHBondContact O-CG1 3.32Å; C22-I26 PolarHBondContact O-N 3.46Å
23	F	84.1	Confident	73.3	Confident	144 Å²	144	78.2 Å²	78.2	63%	0.632	46%	0.457	S	S	*	.	H	α-helix	trans	-61.6	-39.5	175.5	-174.5	-108.8	0	0	0	113.8	G21 F25 I26 L27	G21-F23 PolarHBondContact O-N 3.08Å; F23-F25 PolarHBondContact O-N 3.07Å; F23-I26 PolarHBondContact O-N 3.35Å; F23-L27 HydrophobicContact CD1-CD1 3.86Å; F23-L27 HydrophobicContact CD1-CG 4.26Å; F23-L27 HydrophobicContact CE1-CD1 3.31Å; F23-L27 HydrophobicContact CE1-CD2 4.44Å; F23-L27 HydrophobicContact CE1-CG 3.88Å; F23-L27 HydrophobicContact CE2-CD2 4.42Å; F23-L27 HydrophobicContact CE2-CG 4.33Å; F23-L27 HydrophobicContact CZ-CD1 3.74Å; F23-L27 HydrophobicContact CZ-CD2 4.02Å; F23-L27 HydrophobicContact CZ-CG 3.9Å; F23-L27 WeakPolarHBondContact O-CG 3.34Å; F23-L27 PolarHBondContact O-N 3.49Å
24	G	82.6	Confident	75.2	Confident	8 Å²	8	79.3 Å²	79.3	8%	0.082	46%	0.462	C	S	.	.	H	α-helix	trans	-62.8	-41	176.3	0	0	0	0	0	112.3	G21 C22 L28	G21-G24 WeakPolarHBondContact O-CA 3.25Å; G21-G24 PolarHBondContact O-N 3.44Å; C22-G24 PolarHBondContact O-N 2.93Å; G24-L28 VanDerWaalsContact O-CB 3.31Å; G24-L28 WeakPolarHBondContact O-CB 3.47Å; G24-L28 PolarHBondContact O-N 3.45Å
25	F	85.1	Confident	77.1	Confident	120 Å²	120	77.5 Å²	77.5	53%	0.526	45%	0.448	S	S	.	.	H	α-helix	trans	-67.8	-38.2	174.1	-73	-67.8	0	0	0	112.7	L20 G21 C22 F23 L28 G29	L20-F25 HydrophobicContact CB-CD2 4Å; L20-F25 HydrophobicContact CB-CE1 4.28Å; L20-F25 HydrophobicContact CB-CE2 3.61Å; L20-F25 HydrophobicContact CB-CZ 3.76Å; L20-F25 WeakPolarHBondContact O-CD2 3.38Å; L20-F25 WeakPolarHBondContact O-CE2 3.48Å; G21-F25 PolarHBondContact O-N 3.29Å; C22-F25 PolarHBondContact O-N 2.93Å; F23-F25 PolarHBondContact O-N 3.07Å; F25-L28 PolarHBondContact O-N 3Å; F25-G29 PolarHBondContact O-N 3.31Å
26	I	89.1	Confident	79	Confident	109 Å²	109	76.2 Å²	76.2	56%	0.559	44%	0.44	S	S	*	.	H	α-helix	trans	-62.7	-47.6	175.2	-68.1	164	0	0	0	110.6	C22 F23 L28 G29 L30	C22-I26 VanDerWaalsContact O-CG1 3.31Å; C22-I26 WeakPolarHBondContact O-CG1 3.32Å; C22-I26 PolarHBondContact O-N 3.46Å; F23-I26 PolarHBondContact O-N 3.35Å; I26-L28 VanDerWaalsContact C-N 3.31Å; I26-L28 PolarHBondContact O-N 3.49Å; I26-G29 PolarHBondContact O-N 2.88Å; I26-L30 WeakPolarHBondContact O-CB 3.4Å; I26-L30 PolarHBondContact O-N 3.47Å
27	L	87.1	Confident	80.8	Confident	57 Å²	57	79.5 Å²	79.5	30%	0.298	45%	0.448	S	S	.	.	H	α-helix	trans	-61.5	-41.2	176.4	-73.4	-177	0	0	0	111.9	F23 L30 S31 M81	F23-L27 HydrophobicContact CD1-CD1 3.86Å; F23-L27 HydrophobicContact CD1-CG 4.26Å; F23-L27 HydrophobicContact CE1-CD1 3.31Å; F23-L27 HydrophobicContact CE1-CD2 4.44Å; F23-L27 HydrophobicContact CE1-CG 3.88Å; F23-L27 HydrophobicContact CE2-CD2 4.42Å; F23-L27 HydrophobicContact CE2-CG 4.33Å; F23-L27 HydrophobicContact CZ-CD1 3.74Å; F23-L27 HydrophobicContact CZ-CD2 4.02Å; F23-L27 HydrophobicContact CZ-CG 3.9Å; F23-L27 WeakPolarHBondContact O-CG 3.34Å; F23-L27 PolarHBondContact O-N 3.49Å; L27-L30 PolarHBondContact O-N 3.31Å; L27-S31 WeakPolarHBondContact O-CB 3.37Å; L27-S31 PolarHBondContact O-N 3.32Å; L27-M81 HydrophobicContact CB-CE 4.01Å; L27-M81 HydrophobicContact CB-SD 4.42Å
28	L	85.8	Confident	82.5	Confident	27 Å²	27	78.8 Å²	78.8	14%	0.141	44%	0.444	C	S	.	.	H	α-helix	trans	-60.3	-50.6	176.2	-167	78.7	0	0	0	110.7	G24 F25 I26 L30 S31 Y32 M81	G24-L28 VanDerWaalsContact O-CB 3.31Å; G24-L28 WeakPolarHBondContact O-CB 3.47Å; G24-L28 PolarHBondContact O-N 3.45Å; F25-L28 PolarHBondContact O-N 3Å; I26-L28 VanDerWaalsContact C-N 3.31Å; I26-L28 PolarHBondContact O-N 3.49Å; L28-L30 PolarHBondContact O-N 3.1Å; L28-S31 PolarHBondContact O-N 2.92Å; L28-S31 PolarHBondContact O-OG 2.91Å; L28-Y32 HydrophobicContact CD1-CE2 3.98Å; L28-Y32 HydrophobicContact CD2-CE2 4.01Å; L28-Y32 HydrophobicContact CG-CD2 3.93Å; L28-Y32 HydrophobicContact CG-CE2 3.65Å; L28-Y32 WeakPolarHBondContact O-CD2 3.48Å; L28-Y32 PolarHBondContact O-N 3.27Å; L28-M81 VanDerWaalsContact CA-SD 3.56Å; L28-M81 HydrophobicContact CB-CE 3.93Å; L28-M81 HydrophobicContact CB-SD 4.39Å; L28-M81 HydrophobicContact CD1-CE 3.79Å; L28-M81 HydrophobicContact CD1-SD 4.08Å; L28-M81 HydrophobicContact CG-CE 4.5Å
29	G	88.8	Confident	84	Confident	38 Å²	38	82.1 Å²	82.1	39%	0.392	44%	0.441	S	S	.	.	H	α-helix	trans	-59.4	-43.9	177.1	0	0	0	0	0	112.8	F25 I26 S31 Y32 L33	F25-G29 PolarHBondContact O-N 3.31Å; I26-G29 PolarHBondContact O-N 2.88Å; G29-S31 VanDerWaalsContact C-N 3.35Å; G29-S31 PolarHBondContact O-N 3.34Å; G29-Y32 PolarHBondContact O-N 3.32Å; G29-L33 WeakPolarHBondContact O-CB 3.45Å; G29-L33 PolarHBondContact O-N 2.88Å
30	L	89.9	Confident	85.4	Confident	102 Å²	102	80.1 Å²	80.1	53%	0.534	44%	0.435	S	S	.	.	H	α-helix	trans	-63	-40.2	176.1	-175	147.6	0	0	0	111.7	I26 L27 L28 L33 L34	I26-L30 WeakPolarHBondContact O-CB 3.4Å; I26-L30 PolarHBondContact O-N 3.47Å; L27-L30 PolarHBondContact O-N 3.31Å; L28-L30 PolarHBondContact O-N 3.1Å; L30-L33 WeakPolarHBondContact O-CB 3.39Å; L30-L33 PolarHBondContact O-N 3.3Å; L30-L34 WeakPolarHBondContact O-CB 3.44Å; L30-L34 PolarHBondContact O-N 2.89Å
31	S	86.7	Confident	86.4	Confident	11 Å²	11	83.9 Å²	83.9	8%	0.077	46%	0.455	C	S	.	.	H	α-helix	trans	-64.3	-42	175.9	82.8	0	0	0	0	111.8	L27 L28 G29 L34 V35 V78 M81	L27-S31 WeakPolarHBondContact O-CB 3.37Å; L27-S31 PolarHBondContact O-N 3.32Å; L28-S31 PolarHBondContact O-N 2.92Å; L28-S31 PolarHBondContact O-OG 2.91Å; G29-S31 VanDerWaalsContact C-N 3.35Å; G29-S31 PolarHBondContact O-N 3.34Å; S31-L34 PolarHBondContact O-N 3.47Å; S31-V35 VanDerWaalsContact O-CG2 3.29Å; S31-V35 WeakPolarHBondContact O-CG2 3.23Å; S31-V35 PolarHBondContact O-N 3.32Å; S31-V78 VanDerWaalsContact OG-CG1 3.24Å; S31-V78 WeakPolarHBondContact OG-CG1 3.32Å; S31-M81 VanDerWaalsContact CB-SD 3.58Å; S31-M81 PolarHBondContact OG-SD 3.33Å; S31-M81 VanDerWaalsContact OG-SD 3.37Å
32	Y	88.8	Confident	86.9	Confident	107 Å²	107	82.2 Å²	82.2	42%	0.42	44%	0.435	S	S	.	.	H	α-helix	trans	-64.7	-41.9	175.9	-82	-65.3	0	0	0	111.4	L28 G29 L34 V35 I36 V78	L28-Y32 HydrophobicContact CD1-CE2 3.98Å; L28-Y32 HydrophobicContact CD2-CE2 4.01Å; L28-Y32 HydrophobicContact CG-CD2 3.93Å; L28-Y32 HydrophobicContact CG-CE2 3.65Å; L28-Y32 WeakPolarHBondContact O-CD2 3.48Å; L28-Y32 PolarHBondContact O-N 3.27Å; G29-Y32 PolarHBondContact O-N 3.32Å; Y32-L34 VanDerWaalsContact C-N 3.35Å; Y32-L34 PolarHBondContact O-N 3.43Å; Y32-V35 PolarHBondContact O-N 2.91Å; Y32-I36 VanDerWaalsContact O-CG1 3.29Å; Y32-I36 WeakPolarHBondContact O-CG1 3.41Å; Y32-I36 PolarHBondContact O-N 3.3Å; Y32-V78 HydrophobicContact CE1-CG2 4.28Å
33	L	91	Very high	87.1	Confident	105 Å²	105	80.9 Å²	80.9	55%	0.55	42%	0.421	S	S	.	.	H	α-helix	trans	-58	-46.8	174.1	-173.6	92.5	0	0	0	111.2	G29 L30 V35 I36 I37	G29-L33 WeakPolarHBondContact O-CB 3.45Å; G29-L33 PolarHBondContact O-N 2.88Å; L30-L33 WeakPolarHBondContact O-CB 3.39Å; L30-L33 PolarHBondContact O-N 3.3Å; L33-V35 VanDerWaalsContact C-N 3.34Å; L33-V35 PolarHBondContact O-N 3.15Å; L33-I36 PolarHBondContact O-N 2.89Å; L33-I37 HydrophobicContact CD2-CD1 3.94Å; L33-I37 HydrophobicContact CG-CD1 3.85Å; L33-I37 WeakPolarHBondContact O-CG1 3.31Å; L33-I37 PolarHBondContact O-N 3.17Å
34	L	87.8	Confident	87	Confident	95 Å²	95	79 Å²	79	50%	0.497	42%	0.424	S	S	.	.	H	α-helix	trans	-60.1	-45.7	177.8	-157.9	-178.1	0	0	0	110.5	L30 S31 Y32 I36 I37 T38	L30-L34 WeakPolarHBondContact O-CB 3.44Å; L30-L34 PolarHBondContact O-N 2.89Å; S31-L34 PolarHBondContact O-N 3.47Å; Y32-L34 VanDerWaalsContact C-N 3.35Å; Y32-L34 PolarHBondContact O-N 3.43Å; L34-I36 VanDerWaalsContact C-N 3.29Å; L34-I36 PolarHBondContact O-N 3.45Å; L34-I37 PolarHBondContact O-N 2.91Å; L34-T38 HydrophobicContact CD2-CG2 3.59Å; L34-T38 WeakPolarHBondContact O-CB 3.16Å; L34-T38 PolarHBondContact O-N 3.17Å; L34-T38 PolarHBondContact O-OG1 2.73Å
35	V	86.3	Confident	87	Confident	31 Å²	31	85.7 Å²	85.7	19%	0.188	45%	0.451	C	S	.	.	H	α-helix	trans	-59.5	-38.9	177.3	169.4	0	0	0	0	111.7	S31 Y32 L33 F39 S42 P79	S31-V35 VanDerWaalsContact O-CG2 3.29Å; S31-V35 WeakPolarHBondContact O-CG2 3.23Å; S31-V35 PolarHBondContact O-N 3.32Å; Y32-V35 PolarHBondContact O-N 2.91Å; L33-V35 VanDerWaalsContact C-N 3.34Å; L33-V35 PolarHBondContact O-N 3.15Å; V35-F39 PolarHBondContact O-N 3.12Å; V35-S42 PolarHBondContact O-OG 3.44Å; V35-P79 HydrophobicContact CG2-CG 4.16Å
36	I	88	Confident	87.1	Confident	124 Å²	124	80.5 Å²	80.5	64%	0.636	43%	0.43	S	S	*	.	H	α-helix	trans	-68.6	-47.1	176.6	-67.8	163.5	0	0	0	111.3	Y32 L33 L34 T38 F39	Y32-I36 VanDerWaalsContact O-CG1 3.29Å; Y32-I36 WeakPolarHBondContact O-CG1 3.41Å; Y32-I36 PolarHBondContact O-N 3.3Å; L33-I36 PolarHBondContact O-N 2.89Å; L34-I36 VanDerWaalsContact C-N 3.29Å; L34-I36 PolarHBondContact O-N 3.45Å; I36-T38 VanDerWaalsContact C-N 3.27Å; I36-T38 PolarHBondContact O-N 2.89Å; I36-F39 WeakPolarHBondContact O-CB 3.47Å; I36-F39 PolarHBondContact O-N 3.4Å
37	I	90.7	Very high	86.9	Confident	126 Å²	126	77.3 Å²	77.3	65%	0.646	42%	0.415	S	S	*	.	H	α-helix	trans	-62.5	-36.7	-179.8	-69	167.2	0	0	0	111.3	L33 L34 F39	L33-I37 HydrophobicContact CD2-CD1 3.94Å; L33-I37 HydrophobicContact CG-CD1 3.85Å; L33-I37 WeakPolarHBondContact O-CG1 3.31Å; L33-I37 PolarHBondContact O-N 3.17Å; L34-I37 PolarHBondContact O-N 2.91Å; I37-F39 VanDerWaalsContact C-N 3.3Å; I37-F39 PolarHBondContact O-N 2.86Å
38	T	87	Confident	86.9	Confident	58 Å²	58	81.1 Å²	81.1	36%	0.356	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	11	-178.8	53.1	0	0	0	0	113.8	L34 I36 L41 S42	L34-T38 HydrophobicContact CD2-CG2 3.59Å; L34-T38 WeakPolarHBondContact O-CB 3.16Å; L34-T38 PolarHBondContact O-N 3.17Å; L34-T38 PolarHBondContact O-OG1 2.73Å; I36-T38 VanDerWaalsContact C-N 3.27Å; I36-T38 PolarHBondContact O-N 2.89Å; T38-L41 PolarHBondContact O-N 3.46Å; T38-S42 PolarHBondContact O-N 2.75Å; T38-S42 WeakPolarHBondContact OG1-CB 3.49Å
39	F	86.4	Confident	87.1	Confident	133 Å²	133	84.6 Å²	84.6	58%	0.583	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	131.7	172.5	-172.5	-98.8	0	0	0	109.8	V35 I36 I37 L43	V35-F39 PolarHBondContact O-N 3.12Å; I36-F39 WeakPolarHBondContact O-CB 3.47Å; I36-F39 PolarHBondContact O-N 3.4Å; I37-F39 VanDerWaalsContact C-N 3.3Å; I37-F39 PolarHBondContact O-N 2.86Å; F39-L43 HydrophobicContact CE2-CB 4.32Å; F39-L43 HydrophobicContact CE2-CD1 4.19Å; F39-L43 HydrophobicContact CE2-CD2 4.48Å
40	P	86.6	Confident	87.2	Confident	88 Å²	88	83 Å²	83	57%	0.571	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	cis	-96.9	-8.2	14.7	36	-36	0	0	0	116.4	S42 L43	P40-S42 VanDerWaalsContact C-N 3.29Å; P40-S42 PolarHBondContact O-N 3.37Å; P40-L43 WeakPolarHBondContact O-CB 3.37Å; P40-L43 PolarHBondContact O-N 3.28Å; P40-L43 VanDerWaalsContact O-N 3.17Å
41	L	86.3	Confident	87.3	Confident	124 Å²	124	79.8 Å²	79.8	65%	0.649	42%	0.418	S	S	*	.	H	α-helix	trans	-58.6	-40.7	-176.2	-88.4	119.4	0	0	0	112.2	T38 L43 C44 F45	T38-L41 PolarHBondContact O-N 3.46Å; L41-L43 PolarHBondContact O-N 2.91Å; L41-C44 PolarHBondContact O-N 2.91Å; L41-F45 WeakPolarHBondContact O-CD2 3.32Å
42	S	85.6	Confident	87.5	Confident	11 Å²	11	86.9 Å²	86.9	8%	0.077	45%	0.45	C	S	.	.	H	α-helix	trans	-57.9	-33.7	179.4	60.9	0	0	0	0	113.4	V35 T38 P40 C44 F45 T46	V35-S42 PolarHBondContact O-OG 3.44Å; T38-S42 PolarHBondContact O-N 2.75Å; T38-S42 WeakPolarHBondContact OG1-CB 3.49Å; P40-S42 VanDerWaalsContact C-N 3.29Å; P40-S42 PolarHBondContact O-N 3.37Å; S42-C44 VanDerWaalsContact C-N 3.33Å; S42-C44 PolarHBondContact O-N 2.86Å; S42-F45 PolarHBondContact O-N 3.11Å; S42-T46 VanDerWaalsContact O-CB 3.23Å; S42-T46 WeakPolarHBondContact O-CB 3.5Å; S42-T46 PolarHBondContact O-N 3.22Å; S42-T46 PolarHBondContact O-OG1 3.32Å
43	L	84.6	Confident	87.7	Confident	81 Å²	81	87 Å²	87	42%	0.424	45%	0.45	S	S	.	.	H	α-helix	trans	-64	-39.9	-177.9	-160.3	86	0	0	0	111.4	F39 P40 L41 F45 T46 T47 F76	F39-L43 HydrophobicContact CE2-CB 4.32Å; F39-L43 HydrophobicContact CE2-CD1 4.19Å; F39-L43 HydrophobicContact CE2-CD2 4.48Å; P40-L43 WeakPolarHBondContact O-CB 3.37Å; P40-L43 PolarHBondContact O-N 3.28Å; P40-L43 VanDerWaalsContact O-N 3.17Å; L41-L43 PolarHBondContact O-N 2.91Å; L43-F45 VanDerWaalsContact C-N 3.31Å; L43-F45 PolarHBondContact O-N 3.18Å; L43-T46 PolarHBondContact O-N 3.43Å; L43-T47 HydrophobicContact CG-CG2 4.36Å; L43-T47 WeakPolarHBondContact O-CB 3.48Å; L43-T47 VanDerWaalsContact O-CG2 3.32Å; L43-T47 WeakPolarHBondContact O-CG2 3.3Å; L43-T47 PolarHBondContact O-N 3.5Å; L43-T47 PolarHBondContact O-OG1 3.16Å; L43-F76 HydrophobicContact CD1-CE1 4.09Å
44	C	82.9	Confident	87.9	Confident	103 Å²	103	83.9 Å²	83.9	70%	0.696	43%	0.433	S	S	*	.	H	α-helix	trans	-66.6	-33.6	178.9	-167.9	0	0	0	0	111.9	L41 S42	L41-C44 PolarHBondContact O-N 2.91Å; S42-C44 VanDerWaalsContact C-N 3.33Å; S42-C44 PolarHBondContact O-N 2.86Å
45	F	83.5	Confident	88.2	Confident	150 Å²	150	83.2 Å²	83.2	66%	0.658	42%	0.424	S	S	*	.	H	α-helix	trans	-82.6	-32.8	177.2	-72.3	-76.6	0	0	0	113.9	L41 S42 L43	L41-F45 WeakPolarHBondContact O-CD2 3.32Å; S42-F45 PolarHBondContact O-N 3.11Å; L43-F45 VanDerWaalsContact C-N 3.31Å; L43-F45 PolarHBondContact O-N 3.18Å
46	T	85.3	Confident	88.5	Confident	11 Å²	11	81.7 Å²	81.7	7%	0.067	42%	0.415	C	S	.	.	H	α-helix	trans	-79.3	-32.3	-175.7	-56.3	0	0	0	0	112	S42 L43 R48 F76 V77	S42-T46 VanDerWaalsContact O-CB 3.23Å; S42-T46 WeakPolarHBondContact O-CB 3.5Å; S42-T46 PolarHBondContact O-N 3.22Å; S42-T46 PolarHBondContact O-OG1 3.32Å; L43-T46 PolarHBondContact O-N 3.43Å; T46-R48 PolarHBondContact O-N 3.43Å; T46-F76 HydrophobicContact CG2-CB 4.08Å; T46-F76 HydrophobicContact CG2-CD1 3.94Å; T46-V77 WeakPolarHBondContact CG2-O 3.34Å; T46-V77 PolarHBondContact O-N 3.43Å; T46-V77 VanDerWaalsContact O-N 3.1Å
47	T	86.6	Confident	88.6	Confident	41 Å²	41	75.8 Å²	75.8	25%	0.252	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	121	177.7	47.5	0	0	0	0	110.2	L43 L74 F76	L43-T47 HydrophobicContact CG-CG2 4.36Å; L43-T47 WeakPolarHBondContact O-CB 3.48Å; L43-T47 VanDerWaalsContact O-CG2 3.32Å; L43-T47 WeakPolarHBondContact O-CG2 3.3Å; L43-T47 PolarHBondContact O-N 3.5Å; L43-T47 PolarHBondContact O-OG1 3.16Å; T47-L74 HydrophobicContact CG2-CD1 4.09Å; T47-F76 HydrophobicContact CG2-CD1 3.9Å; T47-F76 HydrophobicContact CG2-CE1 3.4Å; T47-F76 HydrophobicContact CG2-CZ 4.14Å
48	R	87.1	Confident	88.6	Confident	137 Å²	137	70 Å²	70	52%	0.517	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	143.8	172.6	-68.6	-64.9	-176.2	94.2	-3.7	109.3	T46 F75	T46-R48 PolarHBondContact O-N 3.43Å; R48-F75 HydrophobicContact CB-CE1 4.15Å; R48-F75 HydrophobicContact CB-CE2 3.96Å; R48-F75 HydrophobicContact CB-CZ 3.51Å; R48-F75 PolarHBondContact N-O 2.88Å; R48-F75 VanDerWaalsContact N-O 3.13Å; R48-F75 WeakPolarHBondContact O-CD1 3.34Å; R48-F75 WeakPolarHBondContact O-CE1 3.39Å; R48-F75 PolarHBondContact O-N 3.2Å; R48-F75 VanDerWaalsContact O-N 3.07Å
49	V	90	Very high	88.8	Confident	101 Å²	101	69 Å²	69	61%	0.612	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-112.9	134.1	178.1	-176.2	0	0	0	0	108.4	G73 L74	V49-G73 WeakPolarHBondContact CA-O 3.46Å; V49-L74 HydrophobicContact CG2-CD1 3.8Å
50	I	91.2	Very high	88.9	Confident	5 Å²	5	65 Å²	65	3%	0.026	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	140.9	173	-68.6	153.5	0	0	0	108.6	E54 A56 G73 F75 M84	I50-E54 HydrophobicContact CG2-CB 3.51Å; I50-E54 VanDerWaalsContact CG2-O 3.32Å; I50-E54 WeakPolarHBondContact CG2-O 3.43Å; I50-A56 HydrophobicContact CD1-CB 3.17Å; I50-A56 HydrophobicContact CG1-CB 4.12Å; I50-G73 PolarHBondContact N-O 2.65Å; I50-G73 VanDerWaalsContact N-O 3.11Å; I50-G73 PolarHBondContact O-N 3.44Å; I50-G73 VanDerWaalsContact O-N 3.08Å; I50-F75 HydrophobicContact CB-CE1 3.93Å; I50-F75 HydrophobicContact CD1-CD1 3.6Å; I50-F75 HydrophobicContact CD1-CE1 2.98Å; I50-F75 HydrophobicContact CD1-CE2 3.98Å; I50-F75 HydrophobicContact CD1-CG 4.43Å; I50-F75 HydrophobicContact CD1-CZ 3.21Å; I50-F75 HydrophobicContact CG1-CD1 4.2Å; I50-F75 HydrophobicContact CG1-CE1 3.19Å; I50-F75 HydrophobicContact CG1-CZ 3.42Å; I50-F75 VanDerWaalsContact CG1-CZ 3.42Å; I50-M84 HydrophobicContact CD1-CE 3.72Å; I50-M84 HydrophobicContact CG1-CE 3.53Å
51	A	91.8	Very high	88.9	Confident	33 Å²	33	64.6 Å²	64.6	27%	0.273	32%	0.319	S	S	.	.			trans	-75	158.7	174.8	0	0	0	0	0	112.1	Y53 E54	A51-Y53 VanDerWaalsContact C-N 3.28Å; A51-Y53 HydrophobicContact CB-CD1 4.11Å; A51-Y53 HydrophobicContact CB-CE1 3.64Å; A51-Y53 HydrophobicContact CB-CE2 4.08Å; A51-Y53 PolarHBondContact O-N 3.47Å; A51-E54 PolarHBondContact O-N 2.94Å
52	E	91.1	Very high	88.7	Confident	161 Å²	161	61.1 Å²	61.1	75%	0.752	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-35.6	-176.3	-169.6	168.4	-171.8	0	0	114.9	E54 P72	E52-E54 VanDerWaalsContact C-N 3.27Å; E52-E54 PolarHBondContact O-N 3.37Å; E52-P72 HydrophobicContact CB-CB 4.39Å; E52-P72 HydrophobicContact CG-CG 4.35Å
53	Y	93.1	Very high	88.7	Confident	108 Å²	108	65.7 Å²	65.7	42%	0.424	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-2.3	179.6	54.9	-97	0	0	0	113.9	A51 L89 R90	A51-Y53 VanDerWaalsContact C-N 3.28Å; A51-Y53 HydrophobicContact CB-CD1 4.11Å; A51-Y53 HydrophobicContact CB-CE1 3.64Å; A51-Y53 HydrophobicContact CB-CE2 4.08Å; A51-Y53 PolarHBondContact O-N 3.47Å; Y53-L89 PolarHBondContact O-N 3.44Å; Y53-R90 HydrophobicContact CG-CG 4.49Å
54	E	94.1	Very high	88.8	Confident	40 Å²	40	63.4 Å²	63.4	19%	0.187	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	152.3	177.6	-71.7	-177	168.1	0	0	110.8	I50 A51 E52 K86 V87	I50-E54 HydrophobicContact CG2-CB 3.51Å; I50-E54 VanDerWaalsContact CG2-O 3.32Å; I50-E54 WeakPolarHBondContact CG2-O 3.43Å; A51-E54 PolarHBondContact O-N 2.94Å; E52-E54 VanDerWaalsContact C-N 3.27Å; E52-E54 PolarHBondContact O-N 3.37Å; E54-K86 IonicContact OE2-NZ 2.82Å; E54-V87 CarbonylContact C-O 3.59Å; E54-V87 WeakPolarHBondContact CA-O 3.46Å
55	R	93.5	Very high	88.9	Confident	81 Å²	81	59.8 Å²	59.8	31%	0.306	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	145	167.6	-66	-67.5	169.1	150.4	-6.2	110.4	A69 K70 K86 V87 L89 P122	R55-A69 HydrophobicContact CB-CB 4.3Å; R55-K70 WeakPolarHBondContact CD-O 3.49Å; R55-K86 CarbonylContact O-C 3.45Å; R55-K86 WeakPolarHBondContact O-CA 3.48Å; R55-V87 PolarHBondContact N-O 3.44Å; R55-V87 PolarHBondContact O-N 2.92Å; R55-L89 HydrophobicContact CG-CD1 3.47Å; R55-L89 VanDerWaalsContact CG-CD1 3.47Å; R55-L89 HydrophobicContact CG-CD2 4.21Å; R55-L89 HydrophobicContact CG-CG 3.94Å; R55-P122 HydrophobicContact CB-CB 4.31Å; R55-P122 HydrophobicContact CB-CG 3.97Å; R55-P122 HydrophobicContact CG-CG 4.34Å
56	A	92.5	Very high	88.6	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.4	173.6	0	0	0	0	0	112.3	I50 K70 M84 R85	I50-A56 HydrophobicContact CD1-CB 3.17Å; I50-A56 HydrophobicContact CG1-CB 4.12Å; A56-K70 PolarHBondContact N-O 3.04Å; A56-K70 PolarHBondContact O-N 2.86Å; A56-M84 HydrophobicContact CB-CE 3.35Å; A56-M84 HydrophobicContact CB-CG 3.97Å; A56-R85 WeakPolarHBondContact CA-O 3.4Å
57	V	91.7	Very high	88.3	Confident	0 Å²	0	60 Å²	60	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	118.3	167.1	-173.3	0	0	0	0	107.1	F59 I64 A69 R85 P122 V123 I126	V57-F59 HydrophobicContact CB-CE2 4.27Å; V57-F59 HydrophobicContact CG1-CD2 4.48Å; V57-F59 HydrophobicContact CG1-CE1 4.29Å; V57-F59 HydrophobicContact CG1-CE2 3.78Å; V57-F59 HydrophobicContact CG1-CZ 3.67Å; V57-I64 HydrophobicContact CG1-CG2 4.48Å; V57-A69 HydrophobicContact CG2-CB 4.3Å; V57-R85 PolarHBondContact N-O 2.91Å; V57-R85 PolarHBondContact O-N 3.34Å; V57-P122 HydrophobicContact CG2-CB 4.23Å; V57-V123 HydrophobicContact CG2-CG2 4.3Å; V57-I126 HydrophobicContact CB-CD1 3.92Å; V57-I126 HydrophobicContact CG2-CD1 3.84Å
58	I	90.9	Very high	88.2	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.021	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	122.6	-178	-54.9	171.7	0	0	0	107.9	L65 K70 F75 V77 D82	I58-L65 PolarHBondContact O-N 3.34Å; I58-L65 VanDerWaalsContact O-N 3.15Å; I58-K70 HydrophobicContact CD1-CG 3.98Å; I58-F75 HydrophobicContact CD1-CD2 3.93Å; I58-F75 HydrophobicContact CD1-CE2 4.32Å; I58-V77 HydrophobicContact CD1-CG2 4.29Å; I58-D82 HydrophobicContact CG2-CB 3.86Å
59	F	90.5	Very high	88.2	Confident	37 Å²	37	53.8 Å²	53.8	16%	0.162	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	112.6	174.1	-61	-85	0	0	0	109.2	V57 R63 I64 D82 R83 R85 I126	V57-F59 HydrophobicContact CB-CE2 4.27Å; V57-F59 HydrophobicContact CG1-CD2 4.48Å; V57-F59 HydrophobicContact CG1-CE1 4.29Å; V57-F59 HydrophobicContact CG1-CE2 3.78Å; V57-F59 HydrophobicContact CG1-CZ 3.67Å; F59-R63 CarbonylContact C-O 3.58Å; F59-R63 VanDerWaalsContact CA-O 3.27Å; F59-R63 WeakPolarHBondContact CA-O 3.41Å; F59-I64 HydrophobicContact CD1-CG1 3.87Å; F59-I64 HydrophobicContact CE1-CD1 4.33Å; F59-I64 HydrophobicContact CE1-CG1 3.57Å; F59-D82 WeakPolarHBondContact O-CA 3.4Å; F59-R83 HydrophobicContact CB-CB 4.39Å; F59-R83 PolarHBondContact N-O 3.32Å; F59-R83 PolarHBondContact O-N 3.04Å; F59-R85 HydrophobicContact CE2-CB 4.44Å; F59-R85 HydrophobicContact CE2-CG 4.15Å; F59-I126 HydrophobicContact CE2-CG2 3.97Å; F59-I126 HydrophobicContact CZ-CB 4.46Å; F59-I126 HydrophobicContact CZ-CG2 3.67Å
60	R	89.1	Confident	88.2	Confident	50 Å²	50	52.4 Å²	52.4	19%	0.189	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	114.4	174.4	179.9	165.8	-67.6	173.5	1.3	108.9	G62 R63 L65 D82	R60-G62 PolarHBondContact O-N 2.91Å; R60-G62 VanDerWaalsContact O-N 3.13Å; R60-R63 PolarHBondContact N-O 3.03Å; R60-R63 PolarHBondContact O-N 3.5Å; R60-L65 HydrophobicContact CB-CD1 4.24Å; R60-D82 WeakPolarHBondContact CB-OD1 3.34Å; R60-D82 WeakPolarHBondContact CG-OD1 3.17Å; R60-D82 IonicContact CZ-OD1 2.86Å; R60-D82 IonicContact CZ-OD2 2.82Å; R60-D82 IonicContact NE-OD1 3.55Å; R60-D82 PolarHBondContact NE-OD1 3.49Å; R60-D82 IonicContact NE-OD2 3.06Å; R60-D82 IonicContact NH2-OD1 3.65Å; R60-D82 IonicContact NH2-OD2 3.7Å; R60-D82 PolarHBondContact NH2-OD2 2.91Å
61	L	85.3	Confident	88	Confident	79 Å²	79	53.5 Å²	53.5	41%	0.414	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	51	36.9	-176.7	-60.8	174.6	0	0	0	113	R63 M81	L61-R63 VanDerWaalsContact C-N 3.31Å; L61-R63 PolarHBondContact O-N 3.39Å; L61-M81 HydrophobicContact CD1-CE 3.62Å; L61-M81 HydrophobicContact CD2-CE 3.81Å; L61-M81 HydrophobicContact CG-CE 3.73Å; L61-M81 PolarHBondContact N-O 3.5Å
62	G	83.2	Confident	87.8	Confident	51 Å²	51	54.7 Å²	54.7	53%	0.526	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	-4.7	-179.8	0	0	0	0	0	115.7	R60	R60-G62 PolarHBondContact O-N 2.91Å; R60-G62 VanDerWaalsContact O-N 3.13Å
63	R	85.9	Confident	87.8	Confident	106 Å²	106	48.6 Å²	48.6	40%	0.4	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	148.9	174.1	-60.9	-170.9	-175.3	175.3	11.8	111.2	A16 D19 F59 R60 L61	A16-R63 PolarHBondContact O-NH1 3.3Å; D19-R63 VanDerWaalsContact C-NH1 3.34Å; D19-R63 PolarHBondContact O-NH1 3.44Å; D19-R63 VanDerWaalsContact O-NH1 3.1Å; D19-R63 PolarHBondContact O-NH2 3.24Å; F59-R63 CarbonylContact C-O 3.58Å; F59-R63 VanDerWaalsContact CA-O 3.27Å; F59-R63 WeakPolarHBondContact CA-O 3.41Å; R60-R63 PolarHBondContact N-O 3.03Å; R60-R63 PolarHBondContact O-N 3.5Å; L61-R63 VanDerWaalsContact C-N 3.31Å; L61-R63 PolarHBondContact O-N 3.39Å
64	I	86.7	Confident	87.5	Confident	34 Å²	34	48.6 Å²	48.6	17%	0.174	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	136.3	176.5	-61	151	0	0	0	108.6	L13 V57 F59 V123 T127	L13-I64 HydrophobicContact CD2-CD1 3.68Å; V57-I64 HydrophobicContact CG1-CG2 4.48Å; F59-I64 HydrophobicContact CD1-CG1 3.87Å; F59-I64 HydrophobicContact CE1-CD1 4.33Å; F59-I64 HydrophobicContact CE1-CG1 3.57Å; I64-V123 HydrophobicContact CD1-CG1 3.85Å; I64-V123 HydrophobicContact CG2-CG1 4.46Å; I64-T127 HydrophobicContact CD1-CG2 3.59Å
65	L	84	Confident	87.1	Confident	26 Å²	26	47.8 Å²	47.8	14%	0.136	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-64.2	140.4	178.7	-156.8	71.1	0	0	0	110.9	I58 R60 G67 G68	I58-L65 PolarHBondContact O-N 3.34Å; I58-L65 VanDerWaalsContact O-N 3.15Å; R60-L65 HydrophobicContact CB-CD1 4.24Å; L65-G67 PolarHBondContact O-N 2.94Å; L65-G68 PolarHBondContact O-N 3.46Å
66	P	76.8	Confident	86.8	Confident	88 Å²	88	50 Å²	50	57%	0.571	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	136.7	175.7	21.9	-33.7	0	0	0	111	T17	T17-P66 HydrophobicContact CG2-CB 4.41Å
67	G	78.7	Confident	86.5	Confident	77 Å²	77	50.8 Å²	50.8	79%	0.794	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.5	-4.9	-172.8	0	0	0	0	0	114.8	L65	L65-G67 PolarHBondContact O-N 2.94Å
68	G	84.8	Confident	86.2	Confident	19 Å²	19	51.1 Å²	51.1	20%	0.196	31%	0.31	C	S	.	.	S	Bend	trans	72.1	-140.7	174.3	0	0	0	0	0	113	L65 K70	L65-G68 PolarHBondContact O-N 3.46Å; G68-K70 PolarHBondContact O-N 2.89Å
69	A	88.4	Confident	85.7	Confident	29 Å²	29	54 Å²	54	24%	0.24	33%	0.329	C	S	.	.	S	Bend	trans	-70.3	121.8	-177.6	0	0	0	0	0	111.5	R55 V57 P122 V123	R55-A69 HydrophobicContact CB-CB 4.3Å; V57-A69 HydrophobicContact CG2-CB 4.3Å; A69-P122 HydrophobicContact CB-CG 3.53Å; A69-V123 HydrophobicContact CB-CG2 3.92Å
70	K	89	Confident	85.3	Confident	72 Å²	72	58.8 Å²	58.8	31%	0.313	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-72.4	137.8	179.5	-65.7	-54.5	-175.5	86.2	0	110.4	R55 A56 I58 G68	R55-K70 WeakPolarHBondContact CD-O 3.49Å; A56-K70 PolarHBondContact N-O 3.04Å; A56-K70 PolarHBondContact O-N 2.86Å; I58-K70 HydrophobicContact CD1-CG 3.98Å; G68-K70 PolarHBondContact O-N 2.89Å
71	G	86.3	Confident	85.1	Confident	29 Å²	29	57.3 Å²	57.3	30%	0.299	36%	0.361	S	S	.	.			trans	-73	178.1	-179.7	0	0	0	0	0	114.2
72	P	88.8	Confident	85.3	Confident	58 Å²	58	54.3 Å²	54.3	38%	0.377	35%	0.345	S	S	.	.	S	Bend	trans	-70.9	161	-177.2	32.4	-37	0	0	0	111.8	E52	E52-P72 HydrophobicContact CB-CB 4.39Å; E52-P72 HydrophobicContact CG-CG 4.35Å
73	G	90.5	Very high	85.6	Confident	32 Å²	32	60.4 Å²	60.4	33%	0.33	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	106.5	-159.7	-176.7	0	0	0	0	0	113.1	V49 I50 F75	V49-G73 WeakPolarHBondContact CA-O 3.46Å; I50-G73 PolarHBondContact N-O 2.65Å; I50-G73 VanDerWaalsContact N-O 3.11Å; I50-G73 PolarHBondContact O-N 3.44Å; I50-G73 VanDerWaalsContact O-N 3.08Å; G73-F75 WeakPolarHBondContact O-CD1 3.42Å
74	L	86.8	Confident	85.7	Confident	109 Å²	109	57.5 Å²	57.5	57%	0.571	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	128.8	-175.3	-176	71	0	0	0	110.8	T47 V49	T47-L74 HydrophobicContact CG2-CD1 4.09Å; V49-L74 HydrophobicContact CG2-CD1 3.8Å
75	F	86.9	Confident	86	Confident	22 Å²	22	63.6 Å²	63.6	10%	0.096	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	153	173.4	56.7	-73	0	0	0	109.8	R48 I50 I58 G73 V77 M84	R48-F75 HydrophobicContact CB-CE1 4.15Å; R48-F75 HydrophobicContact CB-CE2 3.96Å; R48-F75 HydrophobicContact CB-CZ 3.51Å; R48-F75 PolarHBondContact N-O 2.88Å; R48-F75 VanDerWaalsContact N-O 3.13Å; R48-F75 WeakPolarHBondContact O-CD1 3.34Å; R48-F75 WeakPolarHBondContact O-CE1 3.39Å; R48-F75 PolarHBondContact O-N 3.2Å; R48-F75 VanDerWaalsContact O-N 3.07Å; I50-F75 HydrophobicContact CB-CE1 3.93Å; I50-F75 HydrophobicContact CD1-CD1 3.6Å; I50-F75 HydrophobicContact CD1-CE1 2.98Å; I50-F75 HydrophobicContact CD1-CE2 3.98Å; I50-F75 HydrophobicContact CD1-CG 4.43Å; I50-F75 HydrophobicContact CD1-CZ 3.21Å; I50-F75 HydrophobicContact CG1-CD1 4.2Å; I50-F75 HydrophobicContact CG1-CE1 3.19Å; I50-F75 HydrophobicContact CG1-CZ 3.42Å; I50-F75 VanDerWaalsContact CG1-CZ 3.42Å; I58-F75 HydrophobicContact CD1-CD2 3.93Å; I58-F75 HydrophobicContact CD1-CE2 4.32Å; G73-F75 WeakPolarHBondContact O-CD1 3.42Å; F75-V77 HydrophobicContact CD2-CG2 3.51Å; F75-V77 HydrophobicContact CE2-CG2 3.32Å; F75-V77 HydrophobicContact CZ-CG2 4.48Å; F75-M84 HydrophobicContact CE1-CE 4.39Å; F75-M84 HydrophobicContact CE2-CE 3.76Å; F75-M84 HydrophobicContact CE2-SD 3.92Å; F75-M84 HydrophobicContact CZ-CE 3.33Å; F75-M84 HydrophobicContact CZ-SD 3.93Å
76	F	85.3	Confident	86.4	Confident	127 Å²	127	67.7 Å²	67.7	56%	0.557	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	125.6	-179.9	-64.9	-82.9	0	0	0	110	L43 T46 T47	L43-F76 HydrophobicContact CD1-CE1 4.09Å; T46-F76 HydrophobicContact CG2-CB 4.08Å; T46-F76 HydrophobicContact CG2-CD1 3.94Å; T47-F76 HydrophobicContact CG2-CD1 3.9Å; T47-F76 HydrophobicContact CG2-CE1 3.4Å; T47-F76 HydrophobicContact CG2-CZ 4.14Å
77	V	87.7	Confident	87.1	Confident	17 Å²	17	64.1 Å²	64.1	10%	0.103	36%	0.358	C	S	.	.			trans	-116.5	123.7	176.3	-178.4	0	0	0	0	108.2	T46 I58 F75 P79 D82	T46-V77 WeakPolarHBondContact CG2-O 3.34Å; T46-V77 PolarHBondContact O-N 3.43Å; T46-V77 VanDerWaalsContact O-N 3.1Å; I58-V77 HydrophobicContact CD1-CG2 4.29Å; F75-V77 HydrophobicContact CD2-CG2 3.51Å; F75-V77 HydrophobicContact CE2-CG2 3.32Å; F75-V77 HydrophobicContact CZ-CG2 4.48Å; V77-P79 WeakPolarHBondContact O-CD 3.36Å; V77-D82 HydrophobicContact CG1-CB 3.47Å; V77-D82 VanDerWaalsContact CG1-CB 3.47Å
78	V	84.6	Confident	87.9	Confident	8 Å²	8	62.8 Å²	62.8	5%	0.048	33%	0.333	C	S	.	.			trans	-71.5	120.2	-178.4	178.9	0	0	0	0	109.3	S31 Y32 M81 D82	S31-V78 VanDerWaalsContact OG-CG1 3.24Å; S31-V78 WeakPolarHBondContact OG-CG1 3.32Å; Y32-V78 HydrophobicContact CE1-CG2 4.28Å; V78-M81 HydrophobicContact CG1-CB 4.37Å; V78-D82 PolarHBondContact N-OD2 3.48Å; V78-D82 WeakPolarHBondContact O-CB 3.38Å; V78-D82 PolarHBondContact O-N 2.83Å
79	P	80.5	Confident	88.3	Confident	64 Å²	64	64.1 Å²	64.1	42%	0.416	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	146.4	176.6	26.5	-33.2	0	0	0	110	V35 V77 M81	V35-P79 HydrophobicContact CG2-CG 4.16Å; V77-P79 WeakPolarHBondContact O-CD 3.36Å; P79-M81 VanDerWaalsContact C-N 3.3Å; P79-M81 PolarHBondContact O-N 2.91Å; P79-M81 VanDerWaalsContact O-N 3.17Å
80	C	81.2	Confident	88.7	Confident	137 Å²	137	69 Å²	69	93%	0.926	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	-44.1	-176	-164.5	0	0	0	0	116.2
81	M	85	Confident	89	Confident	19 Å²	19	68.6 Å²	68.6	9%	0.094	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-34.1	-172.4	-65.8	-176.9	71.3	0	0	114.9	L27 L28 S31 L61 V78 P79	L27-M81 HydrophobicContact CB-CE 4.01Å; L27-M81 HydrophobicContact CB-SD 4.42Å; L28-M81 VanDerWaalsContact CA-SD 3.56Å; L28-M81 HydrophobicContact CB-CE 3.93Å; L28-M81 HydrophobicContact CB-SD 4.39Å; L28-M81 HydrophobicContact CD1-CE 3.79Å; L28-M81 HydrophobicContact CD1-SD 4.08Å; L28-M81 HydrophobicContact CG-CE 4.5Å; S31-M81 VanDerWaalsContact CB-SD 3.58Å; S31-M81 PolarHBondContact OG-SD 3.33Å; S31-M81 VanDerWaalsContact OG-SD 3.37Å; L61-M81 HydrophobicContact CD1-CE 3.62Å; L61-M81 HydrophobicContact CD2-CE 3.81Å; L61-M81 HydrophobicContact CG-CE 3.73Å; L61-M81 PolarHBondContact N-O 3.5Å; V78-M81 HydrophobicContact CG1-CB 4.37Å; P79-M81 VanDerWaalsContact C-N 3.3Å; P79-M81 PolarHBondContact O-N 2.91Å; P79-M81 VanDerWaalsContact O-N 3.17Å
82	D	89.9	Confident	89.5	Confident	16 Å²	16	69.9 Å²	69.9	9%	0.086	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	123.9	-174.3	-69	-16.4	0	0	0	109.9	I58 F59 R60 V77 V78	I58-D82 HydrophobicContact CG2-CB 3.86Å; F59-D82 WeakPolarHBondContact O-CA 3.4Å; R60-D82 WeakPolarHBondContact CB-OD1 3.34Å; R60-D82 WeakPolarHBondContact CG-OD1 3.17Å; R60-D82 IonicContact CZ-OD1 2.86Å; R60-D82 IonicContact CZ-OD2 2.82Å; R60-D82 IonicContact NE-OD1 3.55Å; R60-D82 PolarHBondContact NE-OD1 3.49Å; R60-D82 IonicContact NE-OD2 3.06Å; R60-D82 IonicContact NH2-OD1 3.65Å; R60-D82 IonicContact NH2-OD2 3.7Å; R60-D82 PolarHBondContact NH2-OD2 2.91Å; V77-D82 HydrophobicContact CG1-CB 3.47Å; V77-D82 VanDerWaalsContact CG1-CB 3.47Å; V78-D82 PolarHBondContact N-OD2 3.48Å; V78-D82 WeakPolarHBondContact O-CB 3.38Å; V78-D82 PolarHBondContact O-N 2.83Å
83	R	89.3	Confident	89.8	Confident	180 Å²	180	71.2 Å²	71.2	68%	0.679	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	119.2	169.1	-73.8	-164.8	-78.3	-114.7	3.8	109.6	F59	F59-R83 HydrophobicContact CB-CB 4.39Å; F59-R83 PolarHBondContact N-O 3.32Å; F59-R83 PolarHBondContact O-N 3.04Å
84	M	89.1	Confident	90.1	Very high	44 Å²	44	70.6 Å²	70.6	22%	0.217	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	130.2	179.2	-177.5	-164.3	178.5	0	0	110.3	I50 A56 F75 K86	I50-M84 HydrophobicContact CD1-CE 3.72Å; I50-M84 HydrophobicContact CG1-CE 3.53Å; A56-M84 HydrophobicContact CB-CE 3.35Å; A56-M84 HydrophobicContact CB-CG 3.97Å; F75-M84 HydrophobicContact CE1-CE 4.39Å; F75-M84 HydrophobicContact CE2-CE 3.76Å; F75-M84 HydrophobicContact CE2-SD 3.92Å; F75-M84 HydrophobicContact CZ-CE 3.33Å; F75-M84 HydrophobicContact CZ-SD 3.93Å; M84-K86 HydrophobicContact CE-CD 4.2Å; M84-K86 HydrophobicContact CE-CG 3.57Å
85	R	91.9	Very high	90.5	Very high	163 Å²	163	69.9 Å²	69.9	62%	0.615	35%	0.345	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	125	167.2	-70.5	-66.6	-172.5	134.3	0.3	109.3	A56 V57 F59 I126	A56-R85 WeakPolarHBondContact CA-O 3.4Å; V57-R85 PolarHBondContact N-O 2.91Å; V57-R85 PolarHBondContact O-N 3.34Å; F59-R85 HydrophobicContact CE2-CB 4.44Å; F59-R85 HydrophobicContact CE2-CG 4.15Å; R85-I126 HydrophobicContact CB-CD1 3.6Å; R85-I126 HydrophobicContact CG-CD1 4.4Å
86	K	92.2	Very high	91	Very high	112 Å²	112	69 Å²	69	49%	0.487	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	138.5	174.2	-67.4	179.8	170.5	-155.6	0	109.3	E54 R55 M84	E54-K86 IonicContact OE2-NZ 2.82Å; R55-K86 CarbonylContact O-C 3.45Å; R55-K86 WeakPolarHBondContact O-CA 3.48Å; M84-K86 HydrophobicContact CE-CD 4.2Å; M84-K86 HydrophobicContact CE-CG 3.57Å
87	V	92.8	Very high	91.4	Very high	13 Å²	13	66.5 Å²	66.5	8%	0.079	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	130	176.2	-175.8	0	0	0	0	108.1	E54 R55 I119 P122 I126	E54-V87 CarbonylContact C-O 3.59Å; E54-V87 WeakPolarHBondContact CA-O 3.46Å; R55-V87 PolarHBondContact N-O 3.44Å; R55-V87 PolarHBondContact O-N 2.92Å; V87-I119 HydrophobicContact CG1-CB 4.15Å; V87-I119 HydrophobicContact CG1-CD1 3.41Å; V87-I119 VanDerWaalsContact CG1-CD1 3.41Å; V87-I119 HydrophobicContact CG1-CG1 4.37Å; V87-I119 HydrophobicContact CG1-CG2 3.97Å; V87-P122 HydrophobicContact CB-CB 3.84Å; V87-P122 HydrophobicContact CG1-CB 3.96Å; V87-P122 HydrophobicContact CG2-CB 3.95Å; V87-I126 HydrophobicContact CG2-CD1 3.4Å; V87-I126 VanDerWaalsContact CG2-CD1 3.4Å; V87-I126 HydrophobicContact CG2-CG1 3.97Å
88	D	94.4	Very high	91.9	Very high	49 Å²	49	69.4 Å²	69.4	26%	0.262	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	132.6	172.4	-162.4	-22.5	0	0	0	109.5	R90	D88-R90 VanDerWaalsContact OD1-CB 3.28Å; D88-R90 WeakPolarHBondContact OD1-CB 3.49Å; D88-R90 VanDerWaalsContact OD1-CG 3.24Å; D88-R90 WeakPolarHBondContact OD1-CG 3.39Å; D88-R90 PolarHBondContact OD1-N 2.94Å; D88-R90 IonicContact OD1-NE 2.86Å; D88-R90 PolarHBondContact OD1-NE 3.32Å; D88-R90 VanDerWaalsContact OD1-NE 3.07Å; D88-R90 IonicContact OD2-CZ 3.07Å; D88-R90 VanDerWaalsContact OD2-CZ 3.26Å; D88-R90 IonicContact OD2-NE 3.97Å; D88-R90 PolarHBondContact OD2-NE 3.38Å; D88-R90 IonicContact OD2-NH2 3.5Å; D88-R90 PolarHBondContact OD2-NH2 3.42Å
89	L	94.2	Very high	92.4	Very high	47 Å²	47	69.7 Å²	69.7	25%	0.246	36%	0.358	C	S	.	.			trans	-96.2	-3.2	177.9	-61.3	-176.7	0	0	0	113.1	Y53 R55 I119 P122	Y53-L89 PolarHBondContact O-N 3.44Å; R55-L89 HydrophobicContact CG-CD1 3.47Å; R55-L89 VanDerWaalsContact CG-CD1 3.47Å; R55-L89 HydrophobicContact CG-CD2 4.21Å; R55-L89 HydrophobicContact CG-CG 3.94Å; L89-I119 WeakPolarHBondContact CD2-O 3.2Å; L89-P122 HydrophobicContact CD2-CB 4.47Å; L89-P122 HydrophobicContact CD2-CG 4.39Å
90	R	96.2	Very high	93.2	Very high	132 Å²	132	74.6 Å²	74.6	50%	0.498	38%	0.375	S	S	.	.	S	Bend	trans	-71.1	157	179.5	-65	177.9	-65.9	174	1.3	111.4	Y53 D88 V92	Y53-R90 HydrophobicContact CG-CG 4.49Å; D88-R90 VanDerWaalsContact OD1-CB 3.28Å; D88-R90 WeakPolarHBondContact OD1-CB 3.49Å; D88-R90 VanDerWaalsContact OD1-CG 3.24Å; D88-R90 WeakPolarHBondContact OD1-CG 3.39Å; D88-R90 PolarHBondContact OD1-N 2.94Å; D88-R90 IonicContact OD1-NE 2.86Å; D88-R90 PolarHBondContact OD1-NE 3.32Å; D88-R90 VanDerWaalsContact OD1-NE 3.07Å; D88-R90 IonicContact OD2-CZ 3.07Å; D88-R90 VanDerWaalsContact OD2-CZ 3.26Å; D88-R90 IonicContact OD2-NE 3.97Å; D88-R90 PolarHBondContact OD2-NE 3.38Å; D88-R90 IonicContact OD2-NH2 3.5Å; D88-R90 PolarHBondContact OD2-NH2 3.42Å; R90-V92 PolarHBondContact O-N 2.97Å
91	T	96.2	Very high	93.8	Very high	63 Å²	63	68.9 Å²	68.9	39%	0.387	34%	0.336	S	S	.	.			trans	-67.4	122.5	171.3	-51.5	0	0	0	0	109.6	Y117 E183	T91-Y117 CarbonylContact C-O 3.5Å; T91-Y117 WeakPolarHBondContact CA-O 3.24Å; T91-E183 WeakPolarHBondContact CB-OE2 3.38Å; T91-E183 WeakPolarHBondContact CG2-OE2 3.41Å; T91-E183 PolarHBondContact OG1-OE2 2.69Å
92	V	95.7	Very high	94.4	Very high	56 Å²	56	72.8 Å²	72.8	34%	0.339	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	152.5	174.1	-65.7	0	0	0	0	109.3	R90 Y117	R90-V92 PolarHBondContact O-N 2.97Å; V92-Y117 HydrophobicContact CG2-CD1 3.95Å; V92-Y117 HydrophobicContact CG2-CD2 4.15Å; V92-Y117 HydrophobicContact CG2-CE1 3.47Å; V92-Y117 VanDerWaalsContact CG2-CE1 3.47Å; V92-Y117 HydrophobicContact CG2-CE2 3.72Å; V92-Y117 HydrophobicContact CG2-CG 4.29Å; V92-Y117 PolarHBondContact N-O 3.03Å; V92-Y117 PolarHBondContact O-N 3.41Å
93	T	95.8	Very high	94.7	Very high	86 Å²	86	72.2 Å²	72.2	53%	0.528	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	148.6	179.1	56.7	0	0	0	0	110.4	V115 Y116	T93-V115 WeakPolarHBondContact CA-O 3.32Å; T93-Y116 HydrophobicContact CG2-CD1 3.14Å; T93-Y116 HydrophobicContact CG2-CE1 3.34Å; T93-Y116 HydrophobicContact CG2-CG 3.83Å
94	F	96	Very high	95	Very high	18 Å²	18	72 Å²	72	8%	0.079	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	148	167	66.9	-86.9	0	0	0	110.2	V96 V115 Y117 T136 R137 A140	F94-V96 HydrophobicContact CD2-CG2 4.34Å; F94-V96 HydrophobicContact CE2-CG2 3.8Å; F94-V115 HydrophobicContact CD1-CB 4.26Å; F94-V115 HydrophobicContact CE1-CB 3.67Å; F94-V115 HydrophobicContact CE1-CG1 3.86Å; F94-V115 HydrophobicContact CE2-CB 4.13Å; F94-V115 HydrophobicContact CE2-CG2 4.22Å; F94-V115 HydrophobicContact CZ-CB 3.62Å; F94-V115 HydrophobicContact CZ-CG1 3.99Å; F94-V115 HydrophobicContact CZ-CG2 3.97Å; F94-V115 PolarHBondContact N-O 2.88Å; F94-V115 PolarHBondContact O-N 2.88Å; F94-V115 VanDerWaalsContact O-N 3.14Å; F94-Y117 AromaticContact CD1-CD1 3.71Å; F94-Y117 HydrophobicContact CD1-CD1 3.71Å; F94-Y117 AromaticContact CD1-CE1 3.38Å; F94-Y117 HydrophobicContact CD1-CE1 3.38Å; F94-Y117 AromaticContact CE1-CD1 3.48Å; F94-Y117 HydrophobicContact CE1-CD1 3.48Å; F94-Y117 VanDerWaalsContact CE1-CD1 3.48Å; F94-Y117 AromaticContact CE1-CE1 3.42Å; F94-Y117 HydrophobicContact CE1-CE1 3.42Å; F94-Y117 VanDerWaalsContact CE1-CE1 3.42Å; F94-T136 HydrophobicContact CE1-CG2 4.08Å; F94-T136 HydrophobicContact CZ-CG2 4.07Å; F94-R137 HydrophobicContact CB-CG 4.44Å; F94-R137 HydrophobicContact CD1-CG 4.34Å; F94-R137 HydrophobicContact CD2-CB 4.39Å; F94-R137 HydrophobicContact CD2-CG 3.34Å; F94-R137 HydrophobicContact CE1-CG 4.39Å; F94-R137 HydrophobicContact CE2-CB 4.08Å; F94-R137 HydrophobicContact CE2-CG 3.44Å; F94-R137 VanDerWaalsContact CE2-CG 3.44Å; F94-R137 HydrophobicContact CG-CG 3.79Å; F94-R137 HydrophobicContact CZ-CG 3.95Å; F94-A140 HydrophobicContact CE2-CB 4.03Å; F94-A140 HydrophobicContact CZ-CB 3.97Å
95	D	96.8	Very high	95.3	Very high	95 Å²	95	73 Å²	73	51%	0.508	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	128.6	170.4	-64.6	-75.7	0	0	0	109.8	K188	D95-K188 IonicContact OD1-NZ 3.65Å; D95-K188 PolarHBondContact OD1-NZ 2.9Å
96	V	95.6	Very high	95.4	Very high	2 Å²	2	69.7 Å²	69.7	1%	0.012	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	125.5	166.1	-177.8	0	0	0	0	107.1	F94 A113 V115 A140 A141 L144	F94-V96 HydrophobicContact CD2-CG2 4.34Å; F94-V96 HydrophobicContact CE2-CG2 3.8Å; V96-A113 HydrophobicContact CB-CB 4.3Å; V96-A113 WeakPolarHBondContact CB-O 3.28Å; V96-A113 HydrophobicContact CG2-CB 4.37Å; V96-A113 PolarHBondContact N-O 2.9Å; V96-V115 HydrophobicContact CG2-CG2 3.77Å; V96-A140 HydrophobicContact CG2-CB 3.76Å; V96-A141 HydrophobicContact CG1-CB 4.04Å; V96-L144 HydrophobicContact CG1-CD2 3.99Å
97	P	95.4	Very high	95.5	Very high	76 Å²	76	65.5 Å²	65.5	49%	0.494	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	149.8	179.5	25.7	-34.2	0	0	0	110.8	Q99	P97-Q99 PolarHBondContact O-N 3.18Å; P97-Q99 PolarHBondContact O-NE2 2.93Å
98	P	96.4	Very high	95.6	Very high	77 Å²	77	68.9 Å²	68.9	50%	0.5	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-52	130.4	179.6	-25.2	31.8	0	0	0	112.5	V111 D112	P98-V111 WeakPolarHBondContact CA-O 3.41Å; P98-D112 HydrophobicContact CB-CB 4.36Å; P98-D112 HydrophobicContact CG-CB 4.07Å
99	Q	96.1	Very high	95.7	Very high	14 Å²	14	66.8 Å²	66.8	7%	0.065	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	116.1	177.2	-61.4	-54.6	-56.9	0	0	109.8	P97 V101 A110 V111 L144	P97-Q99 PolarHBondContact O-N 3.18Å; P97-Q99 PolarHBondContact O-NE2 2.93Å; Q99-V101 HydrophobicContact CB-CG2 4Å; Q99-A110 WeakPolarHBondContact O-CA 3.44Å; Q99-V111 PolarHBondContact N-O 3.44Å; Q99-V111 PolarHBondContact O-N 3.43Å; Q99-L144 HydrophobicContact CB-CD2 4.46Å; Q99-L144 HydrophobicContact CG-CD2 3.91Å; Q99-L144 HydrophobicContact CG-CG 4.31Å
100	E	96.1	Very high	95.7	Very high	168 Å²	168	65.4 Å²	65.4	79%	0.785	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	115.7	170.2	-66.9	-177.6	179.8	0	0	109.3	V109 A110	E100-V109 WeakPolarHBondContact CA-O 3.15Å; E100-A110 HydrophobicContact CG-CB 4.03Å
101	V	95.4	Very high	95.7	Very high	17 Å²	17	59.1 Å²	59.1	10%	0.103	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	144.1	-173.6	-170.3	0	0	0	0	110	Q99 V109 R145 L148	Q99-V101 HydrophobicContact CB-CG2 4Å; V101-V109 PolarHBondContact N-O 3.18Å; V101-V109 PolarHBondContact O-N 3.01Å; V101-R145 HydrophobicContact CG1-CG 4.35Å; V101-R145 HydrophobicContact CG2-CB 4.15Å; V101-R145 HydrophobicContact CG2-CG 3.81Å; V101-L148 HydrophobicContact CB-CB 4.46Å; V101-L148 HydrophobicContact CG1-CB 4.35Å; V101-L148 HydrophobicContact CG2-CD1 4.44Å
102	L	96.4	Very high	95.7	Very high	100 Å²	100	57.4 Å²	57.4	52%	0.524	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	117.9	166.8	-169.6	70.3	0	0	0	108.8	S106 T108	L102-S106 WeakPolarHBondContact CD1-O 3.38Å; L102-T108 HydrophobicContact CD1-CG2 4.01Å
103	T	95.8	Very high	95.8	Very high	5 Å²	5	54.8 Å²	54.8	3%	0.031	30%	0.299	C	S	.	.			trans	-71.3	170.9	175.8	58	0	0	0	0	111.5	D105 S106 V107 V109 K151 I156	T103-D105 WeakPolarHBondContact CB-OD1 3.22Å; T103-D105 PolarHBondContact O-N 2.97Å; T103-D105 PolarHBondContact OG1-OD1 3.44Å; T103-S106 PolarHBondContact O-N 3.1Å; T103-V107 PolarHBondContact N-O 3.31Å; T103-V107 WeakPolarHBondContact OG1-CB 3.39Å; T103-V107 PolarHBondContact OG1-N 2.98Å; T103-V107 VanDerWaalsContact OG1-N 3.1Å; T103-V107 PolarHBondContact OG1-O 2.98Å; T103-V109 HydrophobicContact CG2-CB 4.46Å; T103-V109 HydrophobicContact CG2-CG1 4.08Å; T103-V109 HydrophobicContact CG2-CG2 3.53Å; T103-K151 WeakPolarHBondContact CB-O 3.47Å; T103-I156 HydrophobicContact CG2-CD1 3.49Å; T103-I156 VanDerWaalsContact CG2-CD1 3.49Å
104	R	95.8	Very high	95.9	Very high	174 Å²	174	51.7 Å²	51.7	66%	0.657	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-30.6	179.4	179.6	177.9	175	-177.5	-1.9	113.4	S106 K151 N152	R104-S106 PolarHBondContact O-N 3.39Å; R104-K151 WeakPolarHBondContact CB-O 3.45Å; R104-K151 PolarHBondContact N-O 3.36Å; R104-N152 WeakPolarHBondContact CB-OD1 3.29Å
105	D	95.4	Very high	95.9	Very high	67 Å²	67	50.8 Å²	50.8	36%	0.358	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	16.8	175.5	55.6	-21.6	0	0	0	113.4	T103 V107 L153	T103-D105 WeakPolarHBondContact CB-OD1 3.22Å; T103-D105 PolarHBondContact O-N 2.97Å; T103-D105 PolarHBondContact OG1-OD1 3.44Å; D105-V107 VanDerWaalsContact C-N 3.27Å; D105-V107 PolarHBondContact O-N 3.47Å; D105-L153 PolarHBondContact OD1-N 3.4Å; D105-L153 VanDerWaalsContact OD1-N 3.11Å; D105-L153 WeakPolarHBondContact OD2-CB 3.42Å; D105-L153 PolarHBondContact OD2-N 3.01Å; D105-L153 VanDerWaalsContact OD2-N 3.11Å
106	S	94	Very high	96	Very high	93 Å²	93	49 Å²	49	65%	0.65	26%	0.262	S	S	*	.	S	Bend	trans	61.9	31.8	176.4	-53	0	0	0	0	114	L102 T103 R104	L102-S106 WeakPolarHBondContact CD1-O 3.38Å; T103-S106 PolarHBondContact O-N 3.1Å; R104-S106 PolarHBondContact O-N 3.39Å
107	V	94.5	Very high	96.1	Very high	24 Å²	24	49.1 Å²	49.1	15%	0.145	26%	0.263	C	S	.	.			trans	-102.1	132.9	173.5	178.6	0	0	0	0	109.6	T103 D105 V109 L153 L196	T103-V107 PolarHBondContact N-O 3.31Å; T103-V107 WeakPolarHBondContact OG1-CB 3.39Å; T103-V107 PolarHBondContact OG1-N 2.98Å; T103-V107 VanDerWaalsContact OG1-N 3.1Å; T103-V107 PolarHBondContact OG1-O 2.98Å; D105-V107 VanDerWaalsContact C-N 3.27Å; D105-V107 PolarHBondContact O-N 3.47Å; V107-V109 HydrophobicContact CG1-CG1 4.03Å; V107-L153 HydrophobicContact CG1-CD2 4.26Å; V107-L153 HydrophobicContact CG2-CD2 4.5Å; V107-L196 HydrophobicContact CB-CD2 4.47Å; V107-L196 HydrophobicContact CG1-CD2 3.32Å; V107-L196 HydrophobicContact CG2-CD2 4.32Å
108	T	95.4	Very high	96.1	Very high	84 Å²	84	49.7 Å²	49.7	52%	0.515	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	121.8	171.9	55.4	0	0	0	0	109.6	L102 P193	L102-T108 HydrophobicContact CD1-CG2 4.01Å; T108-P193 WeakPolarHBondContact O-CD 3.24Å; T108-P193 WeakPolarHBondContact OG1-CG 3.3Å
109	V	95.4	Very high	96	Very high	4 Å²	4	47 Å²	47	2%	0.024	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	148.6	174.5	-60.6	0	0	0	0	110.2	E100 V101 T103 V107 V111 L153 I156	E100-V109 WeakPolarHBondContact CA-O 3.15Å; V101-V109 PolarHBondContact N-O 3.18Å; V101-V109 PolarHBondContact O-N 3.01Å; T103-V109 HydrophobicContact CG2-CB 4.46Å; T103-V109 HydrophobicContact CG2-CG1 4.08Å; T103-V109 HydrophobicContact CG2-CG2 3.53Å; V107-V109 HydrophobicContact CG1-CG1 4.03Å; V109-V111 HydrophobicContact CB-CG2 4.47Å; V109-V111 HydrophobicContact CG2-CG2 4.01Å; V109-L153 HydrophobicContact CG1-CD1 3.6Å; V109-I156 HydrophobicContact CG2-CD1 4.48Å
110	A	96.2	Very high	95.9	Very high	18 Å²	18	51.5 Å²	51.5	15%	0.149	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	119.1	170.9	0	0	0	0	0	109.3	Q99 E100 R191	Q99-A110 WeakPolarHBondContact O-CA 3.44Å; E100-A110 HydrophobicContact CG-CB 4.03Å; A110-R191 HydrophobicContact CB-CB 4.23Å; A110-R191 PolarHBondContact N-O 2.88Å; A110-R191 PolarHBondContact O-N 3.06Å
111	V	96.2	Very high	95.8	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	132.6	-176	-178.1	0	0	0	0	110	P98 Q99 V109 L144 L148 I156 V187 D189 V190	P98-V111 WeakPolarHBondContact CA-O 3.41Å; Q99-V111 PolarHBondContact N-O 3.44Å; Q99-V111 PolarHBondContact O-N 3.43Å; V109-V111 HydrophobicContact CB-CG2 4.47Å; V109-V111 HydrophobicContact CG2-CG2 4.01Å; V111-L144 HydrophobicContact CG1-CD1 4.48Å; V111-L148 HydrophobicContact CB-CD1 3.57Å; V111-L148 HydrophobicContact CB-CD2 4.48Å; V111-L148 HydrophobicContact CG1-CD1 4.02Å; V111-L148 HydrophobicContact CG1-CD2 4.38Å; V111-L148 HydrophobicContact CG2-CD1 3.82Å; V111-L148 HydrophobicContact CG2-CD2 4.16Å; V111-I156 HydrophobicContact CG2-CG2 4.43Å; V111-V187 HydrophobicContact CG1-CG1 3.78Å; V111-D189 WeakPolarHBondContact CA-O 3.15Å; V111-V190 HydrophobicContact CG1-CG2 4.28Å; V111-V190 HydrophobicContact CG2-CB 4.45Å; V111-V190 HydrophobicContact CG2-CG1 4.1Å; V111-V190 HydrophobicContact CG2-CG2 4.12Å
112	D	96	Very high	95.6	Very high	27 Å²	27	44.3 Å²	44.3	14%	0.144	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	161.1	169	66.3	-10.6	0	0	0	111.4	P98 K188 D189	P98-D112 HydrophobicContact CB-CB 4.36Å; P98-D112 HydrophobicContact CG-CB 4.07Å; D112-K188 PolarHBondContact O-N 3.25Å; D112-K188 WeakPolarHBondContact OD1-CB 3.41Å; D112-K188 WeakPolarHBondContact OD2-CD 3.48Å; D112-D189 PolarHBondContact N-O 2.96Å; D112-D189 VanDerWaalsContact OD1-CA 3.31Å; D112-D189 WeakPolarHBondContact OD1-CA 3.42Å; D112-D189 VanDerWaalsContact OD1-CB 3.32Å; D112-D189 WeakPolarHBondContact OD1-CB 3.37Å; D112-D189 PolarHBondContact OD1-N 3.45Å
113	A	96.8	Very high	95.4	Very high	1 Å²	1	40 Å²	40	1%	0.008	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	161.8	-175	0	0	0	0	0	110.9	V96 L144 E186	V96-A113 HydrophobicContact CB-CB 4.3Å; V96-A113 WeakPolarHBondContact CB-O 3.28Å; V96-A113 HydrophobicContact CG2-CB 4.37Å; V96-A113 PolarHBondContact N-O 2.9Å; A113-L144 HydrophobicContact CB-CD2 3.94Å; A113-E186 CarbonylContact C-O 3.6Å; A113-E186 WeakPolarHBondContact CA-O 3.3Å; A113-E186 WeakPolarHBondContact CB-O 3.24Å
114	V	97.3	Very high	95.3	Very high	21 Å²	21	40.1 Å²	40.1	13%	0.127	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	134.3	173.4	-175.9	0	0	0	0	108.5	Y116 V185 E186 K188	V114-Y116 HydrophobicContact CB-CE2 4.31Å; V114-Y116 HydrophobicContact CG1-CD2 4.4Å; V114-Y116 HydrophobicContact CG1-CE2 3.85Å; V114-V185 WeakPolarHBondContact O-CA 3.23Å; V114-E186 PolarHBondContact N-O 3.15Å; V114-E186 PolarHBondContact O-N 2.88Å; V114-K188 HydrophobicContact CG2-CB 4.35Å; V114-K188 HydrophobicContact CG2-CD 4.02Å
115	V	97.8	Very high	95.1	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	129.8	178.5	-179.9	0	0	0	0	109.4	T93 F94 V96 A140 M167 L171 V182 V185	T93-V115 WeakPolarHBondContact CA-O 3.32Å; F94-V115 HydrophobicContact CD1-CB 4.26Å; F94-V115 HydrophobicContact CE1-CB 3.67Å; F94-V115 HydrophobicContact CE1-CG1 3.86Å; F94-V115 HydrophobicContact CE2-CB 4.13Å; F94-V115 HydrophobicContact CE2-CG2 4.22Å; F94-V115 HydrophobicContact CZ-CB 3.62Å; F94-V115 HydrophobicContact CZ-CG1 3.99Å; F94-V115 HydrophobicContact CZ-CG2 3.97Å; F94-V115 PolarHBondContact N-O 2.88Å; F94-V115 PolarHBondContact O-N 2.88Å; F94-V115 VanDerWaalsContact O-N 3.14Å; V96-V115 HydrophobicContact CG2-CG2 3.77Å; V115-A140 HydrophobicContact CG2-CB 4.04Å; V115-M167 HydrophobicContact CG2-CE 4.22Å; V115-L171 HydrophobicContact CG2-CD1 4.36Å; V115-V182 HydrophobicContact CG1-CG1 3.99Å; V115-V185 HydrophobicContact CG1-CG2 4.46Å; V115-V185 HydrophobicContact CG2-CG1 4.39Å; V115-V185 HydrophobicContact CG2-CG2 4.29Å
116	Y	97.7	Very high	94.9	Very high	56 Å²	56	31.6 Å²	31.6	22%	0.22	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	116.1	174.7	-59.1	-105.5	0	0	0	107.7	T93 V114 E183 R184 E186	T93-Y116 HydrophobicContact CG2-CD1 3.14Å; T93-Y116 HydrophobicContact CG2-CE1 3.34Å; T93-Y116 HydrophobicContact CG2-CG 3.83Å; V114-Y116 HydrophobicContact CB-CE2 4.31Å; V114-Y116 HydrophobicContact CG1-CD2 4.4Å; V114-Y116 HydrophobicContact CG1-CE2 3.85Å; Y116-E183 PolarHBondContact O-N 3.4Å; Y116-R184 HydrophobicContact CD2-CB 4.06Å; Y116-R184 HydrophobicContact CG-CB 4.37Å; Y116-R184 PolarHBondContact N-O 3.44Å; Y116-R184 PolarHBondContact O-N 3.45Å; Y116-E186 HydrophobicContact CE2-CG 4.08Å; Y116-E186 WeakPolarHBondContact CE2-OE2 3.37Å; Y116-E186 PolarHBondContact OH-OE2 3.47Å
117	Y	96.9	Very high	94.7	Very high	6 Å²	6	30.2 Å²	30.2	2%	0.024	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	161	179.7	77.7	-83.4	0	0	0	111.5	T91 V92 F94 D133 V180 K181	T91-Y117 CarbonylContact C-O 3.5Å; T91-Y117 WeakPolarHBondContact CA-O 3.24Å; V92-Y117 HydrophobicContact CG2-CD1 3.95Å; V92-Y117 HydrophobicContact CG2-CD2 4.15Å; V92-Y117 HydrophobicContact CG2-CE1 3.47Å; V92-Y117 VanDerWaalsContact CG2-CE1 3.47Å; V92-Y117 HydrophobicContact CG2-CE2 3.72Å; V92-Y117 HydrophobicContact CG2-CG 4.29Å; V92-Y117 PolarHBondContact N-O 3.03Å; V92-Y117 PolarHBondContact O-N 3.41Å; F94-Y117 AromaticContact CD1-CD1 3.71Å; F94-Y117 HydrophobicContact CD1-CD1 3.71Å; F94-Y117 AromaticContact CD1-CE1 3.38Å; F94-Y117 HydrophobicContact CD1-CE1 3.38Å; F94-Y117 AromaticContact CE1-CD1 3.48Å; F94-Y117 HydrophobicContact CE1-CD1 3.48Å; F94-Y117 VanDerWaalsContact CE1-CD1 3.48Å; F94-Y117 AromaticContact CE1-CE1 3.42Å; F94-Y117 HydrophobicContact CE1-CE1 3.42Å; F94-Y117 VanDerWaalsContact CE1-CE1 3.42Å; Y117-D133 WeakPolarHBondContact OH-CB 3.38Å; Y117-D133 PolarHBondContact OH-OD1 2.91Å; Y117-V180 HydrophobicContact CD2-CG1 3.57Å; Y117-V180 HydrophobicContact CE2-CG1 4.36Å; Y117-V180 HydrophobicContact CG-CG1 4.12Å; Y117-K181 CarbonylContact C-O 3.48Å; Y117-K181 VanDerWaalsContact CA-O 3.25Å; Y117-K181 WeakPolarHBondContact CA-O 3.35Å; Y117-K181 WeakPolarHBondContact CB-O 3.46Å
118	R	96.2	Very high	94.5	Very high	88 Å²	88	32.9 Å²	32.9	33%	0.332	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	155.5	170.6	63.4	178	177	83	2.8	111	Y120 K181 E183	R118-Y120 PolarHBondContact O-N 3.48Å; R118-K181 HydrophobicContact CG-CB 4.34Å; R118-K181 PolarHBondContact N-O 3.36Å; R118-K181 PolarHBondContact O-N 3.39Å; R118-E183 WeakPolarHBondContact CD-OE1 3.34Å; R118-E183 HydrophobicContact CG-CG 4.31Å; R118-E183 IonicContact CZ-OE1 2.69Å; R118-E183 IonicContact NE-OE1 2.99Å; R118-E183 PolarHBondContact NE-OE1 3.05Å
119	I	95.4	Very high	94.3	Very high	21 Å²	21	29.7 Å²	29.7	11%	0.108	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	119.9	173.2	-63.7	166.7	0	0	0	108.1	V87 L89 P122 A125 V180	V87-I119 HydrophobicContact CG1-CB 4.15Å; V87-I119 HydrophobicContact CG1-CD1 3.41Å; V87-I119 VanDerWaalsContact CG1-CD1 3.41Å; V87-I119 HydrophobicContact CG1-CG1 4.37Å; V87-I119 HydrophobicContact CG1-CG2 3.97Å; L89-I119 WeakPolarHBondContact CD2-O 3.2Å; I119-P122 HydrophobicContact CG2-CB 4.43Å; I119-A125 HydrophobicContact CD1-CB 4.34Å; I119-A125 HydrophobicContact CG1-CB 4.43Å; I119-A125 HydrophobicContact CG2-CB 3.66Å; I119-V180 HydrophobicContact CG1-CG2 4.34Å
120	Y	93.6	Very high	94.1	Very high	107 Å²	107	38 Å²	38	42%	0.42	19%	0.187	S	C	.	.	S	Bend	trans	-92.2	-33.1	175.1	88.5	-95	0	0	0	111.7	R118 G179 K181	R118-Y120 PolarHBondContact O-N 3.48Å; Y120-G179 WeakPolarHBondContact CD1-O 3.28Å; Y120-G179 VanDerWaalsContact CE1-C 3.47Å; Y120-G179 PolarHBondContact N-O 3.11Å; Y120-K181 HydrophobicContact CD1-CB 4.4Å
121	N	93.3	Very high	93.9	Very high	24 Å²	24	39.7 Å²	39.7	13%	0.128	19%	0.194	C	C	.	.			trans	-122.7	97.8	177.7	-169.7	-22.5	0	0	0	110.8	V123 V124 A125 G179	N121-V123 VanDerWaalsContact C-N 3.27Å; N121-V123 PolarHBondContact O-N 2.95Å; N121-V123 PolarHBondContact OD1-N 3.36Å; N121-V123 VanDerWaalsContact OD1-N 3.15Å; N121-V124 HydrophobicContact CB-CB 4.08Å; N121-V124 HydrophobicContact CB-CG2 4.25Å; N121-V124 WeakPolarHBondContact ND2-CG2 3.34Å; N121-V124 PolarHBondContact O-N 3.47Å; N121-V124 PolarHBondContact OD1-N 3.33Å; N121-A125 WeakPolarHBondContact O-CB 3.17Å; N121-A125 PolarHBondContact O-N 2.97Å; N121-G179 PolarHBondContact N-O 3.5Å; N121-G179 VanDerWaalsContact N-O 3.17Å
122	P	92	Very high	93.7	Very high	10 Å²	10	40.1 Å²	40.1	7%	0.065	20%	0.197	C	C	.	.	H	α-helix	trans	-69.2	-23.2	-176.2	28.4	-36.6	0	0	0	113.4	R55 V57 A69 V87 L89 I119	R55-P122 HydrophobicContact CB-CB 4.31Å; R55-P122 HydrophobicContact CB-CG 3.97Å; R55-P122 HydrophobicContact CG-CG 4.34Å; V57-P122 HydrophobicContact CG2-CB 4.23Å; A69-P122 HydrophobicContact CB-CG 3.53Å; V87-P122 HydrophobicContact CB-CB 3.84Å; V87-P122 HydrophobicContact CG1-CB 3.96Å; V87-P122 HydrophobicContact CG2-CB 3.95Å; L89-P122 HydrophobicContact CD2-CB 4.47Å; L89-P122 HydrophobicContact CD2-CG 4.39Å; I119-P122 HydrophobicContact CG2-CB 4.43Å
123	V	92.4	Very high	93.5	Very high	11 Å²	11	41.9 Å²	41.9	7%	0.067	21%	0.207	C	C	.	.	H	α-helix	trans	-68.9	-53.1	175.8	-177.8	0	0	0	0	109	L13 V57 I64 A69 N121 A125 I126 T127	L13-V123 HydrophobicContact CD1-CG1 4.01Å; V57-V123 HydrophobicContact CG2-CG2 4.3Å; I64-V123 HydrophobicContact CD1-CG1 3.85Å; I64-V123 HydrophobicContact CG2-CG1 4.46Å; A69-V123 HydrophobicContact CB-CG2 3.92Å; N121-V123 VanDerWaalsContact C-N 3.27Å; N121-V123 PolarHBondContact O-N 2.95Å; N121-V123 PolarHBondContact OD1-N 3.36Å; N121-V123 VanDerWaalsContact OD1-N 3.15Å; V123-A125 VanDerWaalsContact C-N 3.32Å; V123-A125 PolarHBondContact O-N 3.38Å; V123-I126 PolarHBondContact O-N 3.11Å; V123-T127 HydrophobicContact CG1-CG2 4.27Å; V123-T127 VanDerWaalsContact O-CG2 3.24Å; V123-T127 WeakPolarHBondContact O-CG2 3.49Å; V123-T127 PolarHBondContact O-N 2.98Å; V123-T127 PolarHBondContact O-OG1 3.17Å; V123-T127 VanDerWaalsContact O-OG1 3.11Å
124	V	92.1	Very high	93.4	Very high	6 Å²	6	47.5 Å²	47.5	4%	0.036	23%	0.228	C	C	.	.	H	α-helix	trans	-61.9	-39.5	-179.2	172.9	0	0	0	0	111.8	Y9 N121 I126 T127 N128 P177	Y9-V124 HydrophobicContact CD1-CG2 4.36Å; N121-V124 HydrophobicContact CB-CB 4.08Å; N121-V124 HydrophobicContact CB-CG2 4.25Å; N121-V124 WeakPolarHBondContact ND2-CG2 3.34Å; N121-V124 PolarHBondContact O-N 3.47Å; N121-V124 PolarHBondContact OD1-N 3.33Å; V124-I126 PolarHBondContact O-N 3.07Å; V124-T127 WeakPolarHBondContact CA-OG1 3.44Å; V124-T127 PolarHBondContact O-N 2.83Å; V124-T127 PolarHBondContact O-OG1 3.04Å; V124-N128 HydrophobicContact CG1-CB 4.29Å; V124-N128 WeakPolarHBondContact CG1-ND2 3.15Å; V124-N128 WeakPolarHBondContact O-CB 3.18Å; V124-N128 PolarHBondContact O-N 3.36Å; V124-P177 WeakPolarHBondContact CG1-O 3.45Å
125	A	92.2	Very high	93.3	Very high	8 Å²	8	47.9 Å²	47.9	7%	0.066	23%	0.231	C	C	.	.	H	α-helix	trans	-63.2	-25.7	179.6	0	0	0	0	0	114.4	I119 N121 V123 V129 W178	I119-A125 HydrophobicContact CD1-CB 4.34Å; I119-A125 HydrophobicContact CG1-CB 4.43Å; I119-A125 HydrophobicContact CG2-CB 3.66Å; N121-A125 WeakPolarHBondContact O-CB 3.17Å; N121-A125 PolarHBondContact O-N 2.97Å; V123-A125 VanDerWaalsContact C-N 3.32Å; V123-A125 PolarHBondContact O-N 3.38Å; A125-V129 VanDerWaalsContact O-CG1 3.23Å; A125-V129 WeakPolarHBondContact O-CG1 3.46Å; A125-W178 WeakPolarHBondContact CA-O 3.45Å; A125-W178 WeakPolarHBondContact CB-O 3.38Å; A125-W178 PolarHBondContact N-O 3.37Å
126	I	90.8	Very high	93.1	Very high	55 Å²	55	47.9 Å²	47.9	28%	0.282	23%	0.231	S	C	.	.	H	α-helix	trans	-94.8	-30.3	176.2	-62	172.5	0	0	0	111.4	V57 F59 R85 V87 V123 V124	V57-I126 HydrophobicContact CB-CD1 3.92Å; V57-I126 HydrophobicContact CG2-CD1 3.84Å; F59-I126 HydrophobicContact CE2-CG2 3.97Å; F59-I126 HydrophobicContact CZ-CB 4.46Å; F59-I126 HydrophobicContact CZ-CG2 3.67Å; R85-I126 HydrophobicContact CB-CD1 3.6Å; R85-I126 HydrophobicContact CG-CD1 4.4Å; V87-I126 HydrophobicContact CG2-CD1 3.4Å; V87-I126 VanDerWaalsContact CG2-CD1 3.4Å; V87-I126 HydrophobicContact CG2-CG1 3.97Å; V123-I126 PolarHBondContact O-N 3.11Å; V124-I126 PolarHBondContact O-N 3.07Å
127	T	90.7	Very high	93	Very high	63 Å²	63	49.6 Å²	49.6	39%	0.387	24%	0.237	S	C	.	.	H	α-helix	trans	-86.5	-38.3	-172.5	57.3	0	0	0	0	113.5	I64 V123 V124	I64-T127 HydrophobicContact CD1-CG2 3.59Å; V123-T127 HydrophobicContact CG1-CG2 4.27Å; V123-T127 VanDerWaalsContact O-CG2 3.24Å; V123-T127 WeakPolarHBondContact O-CG2 3.49Å; V123-T127 PolarHBondContact O-N 2.98Å; V123-T127 PolarHBondContact O-OG1 3.17Å; V123-T127 VanDerWaalsContact O-OG1 3.11Å; V124-T127 WeakPolarHBondContact CA-OG1 3.44Å; V124-T127 PolarHBondContact O-N 2.83Å; V124-T127 PolarHBondContact O-OG1 3.04Å
128	N	91.2	Very high	93	Very high	80 Å²	80	54.7 Å²	54.7	43%	0.428	26%	0.264	S	S	.	.	S	Bend	trans	-91.8	-20.9	-169.2	-71	13.3	0	0	0	112.9	V124 P177	V124-N128 HydrophobicContact CG1-CB 4.29Å; V124-N128 WeakPolarHBondContact CG1-ND2 3.15Å; V124-N128 WeakPolarHBondContact O-CB 3.18Å; V124-N128 PolarHBondContact O-N 3.36Å; N128-P177 PolarHBondContact ND2-O 2.82Å
129	V	91.2	Very high	93	Very high	18 Å²	18	52.5 Å²	52.5	11%	0.109	26%	0.259	C	S	.	.			trans	-135.9	140.4	-177	63.6	0	0	0	0	109.5	A125 A132 S135 W178	A125-V129 VanDerWaalsContact O-CG1 3.23Å; A125-V129 WeakPolarHBondContact O-CG1 3.46Å; V129-A132 HydrophobicContact CG1-CB 3.68Å; V129-S135 WeakPolarHBondContact CG2-OG 3.48Å; V129-W178 HydrophobicContact CB-CG 4.24Å; V129-W178 HydrophobicContact CG1-CB 4.14Å; V129-W178 HydrophobicContact CG1-CG 4.26Å
130	E	91.2	Very high	93	Very high	178 Å²	178	51.5 Å²	51.5	83%	0.832	25%	0.254	S	S	*	.	S	Bend	trans	-65.2	-48.3	177.9	-177	-170.3	-163.8	0	0	111.1	R134	E130-R134 IonicContact OE2-NH2 2.8Å; E130-R134 PolarHBondContact OE2-NH2 3.45Å; E130-R134 VanDerWaalsContact OE2-NH2 3.15Å
131	D	91.8	Very high	93.2	Very high	54 Å²	54	47 Å²	47	29%	0.289	24%	0.239	S	C	.	.			trans	-140.4	99.8	179.3	-176	-20.6	0	0	0	109	D133 R134 S135	D131-D133 VanDerWaalsContact C-N 3.29Å; D131-D133 PolarHBondContact O-N 3Å; D131-D133 PolarHBondContact OD1-N 3.49Å; D131-R134 HydrophobicContact CB-CB 4.03Å; D131-R134 VanDerWaalsContact CG-CB 3.41Å; D131-R134 PolarHBondContact OD1-N 2.92Å; D131-R134 VanDerWaalsContact OD2-CB 3.3Å; D131-R134 WeakPolarHBondContact OD2-CB 3.16Å; D131-S135 VanDerWaalsContact O-CB 3.28Å; D131-S135 WeakPolarHBondContact O-CB 3.32Å; D131-S135 PolarHBondContact O-N 2.9Å; D131-S135 PolarHBondContact O-OG 2.88Å
132	A	91	Very high	93.3	Very high	9 Å²	9	49.2 Å²	49.2	7%	0.074	25%	0.253	C	S	.	.	H	α-helix	trans	-61.6	-38.3	-179.8	0	0	0	0	0	111.8	V129 T136 V180	V129-A132 HydrophobicContact CG1-CB 3.68Å; A132-T136 VanDerWaalsContact O-CB 3.24Å; A132-T136 WeakPolarHBondContact O-CB 3.46Å; A132-T136 PolarHBondContact O-N 3.38Å; A132-T136 PolarHBondContact O-OG1 3.43Å; A132-V180 HydrophobicContact CB-CG2 4.21Å
133	D	92.5	Very high	93.5	Very high	63 Å²	63	49.3 Å²	49.3	34%	0.337	25%	0.254	S	S	.	.	H	α-helix	trans	-70.1	-47.2	-175.4	-61	-18.8	0	0	0	110.4	Y117 D131 R137	Y117-D133 WeakPolarHBondContact OH-CB 3.38Å; Y117-D133 PolarHBondContact OH-OD1 2.91Å; D131-D133 VanDerWaalsContact C-N 3.29Å; D131-D133 PolarHBondContact O-N 3Å; D131-D133 PolarHBondContact OD1-N 3.49Å; D133-R137 VanDerWaalsContact C-CZ 3.44Å; D133-R137 WeakPolarHBondContact O-CG 3.39Å; D133-R137 VanDerWaalsContact O-CZ 3.32Å; D133-R137 PolarHBondContact O-N 2.96Å
134	R	94.1	Very high	93.7	Very high	119 Å²	119	48.8 Å²	48.8	45%	0.449	25%	0.251	S	S	.	.	H	α-helix	trans	-66	-41.6	177.8	-175.1	179.8	69.2	174.7	-3.1	111.7	E130 D131 R137 L138	E130-R134 IonicContact OE2-NH2 2.8Å; E130-R134 PolarHBondContact OE2-NH2 3.45Å; E130-R134 VanDerWaalsContact OE2-NH2 3.15Å; D131-R134 HydrophobicContact CB-CB 4.03Å; D131-R134 VanDerWaalsContact CG-CB 3.41Å; D131-R134 PolarHBondContact OD1-N 2.92Å; D131-R134 VanDerWaalsContact OD2-CB 3.3Å; D131-R134 WeakPolarHBondContact OD2-CB 3.16Å; R134-R137 VanDerWaalsContact N-NH2 3.19Å; R134-R137 WeakPolarHBondContact O-CB 3.42Å; R134-R137 PolarHBondContact O-N 3.36Å; R134-L138 HydrophobicContact CG-CD1 4.42Å; R134-L138 WeakPolarHBondContact O-CG 3.35Å; R134-L138 PolarHBondContact O-N 3.35Å; R134-L138 VanDerWaalsContact O-N 3.16Å
135	S	94.5	Very high	93.9	Very high	29 Å²	29	54.3 Å²	54.3	20%	0.203	27%	0.271	C	S	.	.	H	α-helix	trans	-66.2	-42.7	-179.5	-54.9	0	0	0	0	111.2	V129 D131 R137 L138 L139	V129-S135 WeakPolarHBondContact CG2-OG 3.48Å; D131-S135 VanDerWaalsContact O-CB 3.28Å; D131-S135 WeakPolarHBondContact O-CB 3.32Å; D131-S135 PolarHBondContact O-N 2.9Å; D131-S135 PolarHBondContact O-OG 2.88Å; S135-R137 VanDerWaalsContact C-N 3.34Å; S135-R137 PolarHBondContact O-N 2.98Å; S135-L138 PolarHBondContact O-N 3.01Å; S135-L139 WeakPolarHBondContact O-CB 3.44Å; S135-L139 PolarHBondContact O-N 2.95Å
136	T	94.4	Very high	94	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-62.6	-39.6	175.6	-56.1	0	0	0	0	111.6	F94 A132 L139 A140 T175	F94-T136 HydrophobicContact CE1-CG2 4.08Å; F94-T136 HydrophobicContact CZ-CG2 4.07Å; A132-T136 VanDerWaalsContact O-CB 3.24Å; A132-T136 WeakPolarHBondContact O-CB 3.46Å; A132-T136 PolarHBondContact O-N 3.38Å; A132-T136 PolarHBondContact O-OG1 3.43Å; T136-L139 PolarHBondContact O-N 2.9Å; T136-A140 VanDerWaalsContact O-CB 3.3Å; T136-A140 WeakPolarHBondContact O-CB 3.37Å; T136-A140 PolarHBondContact O-N 3.11Å; T136-T175 HydrophobicContact CG2-CG2 4.16Å
137	R	95.6	Very high	94.2	Very high	93 Å²	93	56.2 Å²	56.2	35%	0.351	28%	0.28	S	S	.	.	H	α-helix	trans	-57.7	-48.7	173.8	-84.7	-175.8	-70.2	-88.1	2.8	113.4	F94 D133 R134 S135 A140 A141	F94-R137 HydrophobicContact CB-CG 4.44Å; F94-R137 HydrophobicContact CD1-CG 4.34Å; F94-R137 HydrophobicContact CD2-CB 4.39Å; F94-R137 HydrophobicContact CD2-CG 3.34Å; F94-R137 HydrophobicContact CE1-CG 4.39Å; F94-R137 HydrophobicContact CE2-CB 4.08Å; F94-R137 HydrophobicContact CE2-CG 3.44Å; F94-R137 VanDerWaalsContact CE2-CG 3.44Å; F94-R137 HydrophobicContact CG-CG 3.79Å; F94-R137 HydrophobicContact CZ-CG 3.95Å; D133-R137 VanDerWaalsContact C-CZ 3.44Å; D133-R137 WeakPolarHBondContact O-CG 3.39Å; D133-R137 VanDerWaalsContact O-CZ 3.32Å; D133-R137 PolarHBondContact O-N 2.96Å; R134-R137 VanDerWaalsContact N-NH2 3.19Å; R134-R137 WeakPolarHBondContact O-CB 3.42Å; R134-R137 PolarHBondContact O-N 3.36Å; S135-R137 VanDerWaalsContact C-N 3.34Å; S135-R137 PolarHBondContact O-N 2.98Å; R137-A140 PolarHBondContact O-N 3.32Å; R137-A141 PolarHBondContact O-N 2.91Å; R137-A141 VanDerWaalsContact O-N 3.14Å
138	L	96.2	Very high	94.5	Very high	112 Å²	112	53.2 Å²	53.2	59%	0.586	26%	0.262	S	S	*	.	H	α-helix	trans	-68.8	-39.5	-178.9	-68.2	171.4	0	0	0	112	R134 S135 A141 T142	R134-L138 HydrophobicContact CG-CD1 4.42Å; R134-L138 WeakPolarHBondContact O-CG 3.35Å; R134-L138 PolarHBondContact O-N 3.35Å; R134-L138 VanDerWaalsContact O-N 3.16Å; S135-L138 PolarHBondContact O-N 3.01Å; L138-A141 PolarHBondContact O-N 2.96Å; L138-T142 PolarHBondContact O-N 3.21Å; L138-T142 VanDerWaalsContact O-N 3.07Å; L138-T142 PolarHBondContact O-OG1 2.99Å
139	L	96	Very high	94.7	Very high	42 Å²	42	50.9 Å²	50.9	22%	0.22	26%	0.257	C	S	.	.	H	α-helix	trans	-63.6	-44.7	175.5	-176.3	63.1	0	0	0	110.9	S135 T136 A141 T142 T143 L171 A174 T175 W178	S135-L139 WeakPolarHBondContact O-CB 3.44Å; S135-L139 PolarHBondContact O-N 2.95Å; T136-L139 PolarHBondContact O-N 2.9Å; L139-A141 VanDerWaalsContact C-N 3.34Å; L139-A141 PolarHBondContact O-N 3.1Å; L139-T142 PolarHBondContact O-N 2.79Å; L139-T143 WeakPolarHBondContact O-CB 3.35Å; L139-T143 PolarHBondContact O-N 2.49Å; L139-T143 PolarHBondContact O-OG1 3.11Å; L139-L171 HydrophobicContact CD2-CD2 4.28Å; L139-L171 HydrophobicContact CG-CD2 3.84Å; L139-A174 HydrophobicContact CD1-CB 4.45Å; L139-A174 HydrophobicContact CD2-CB 3.69Å; L139-T175 HydrophobicContact CD2-CG2 3.8Å; L139-W178 HydrophobicContact CB-CH2 4.29Å; L139-W178 HydrophobicContact CB-CZ3 4.4Å; L139-W178 HydrophobicContact CD2-CH2 3.71Å; L139-W178 HydrophobicContact CD2-CZ3 3.69Å
140	A	96.7	Very high	94.9	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-56.1	-45.3	174.4	0	0	0	0	0	112.8	F94 V96 V115 T136 R137 T142 L144 M167 L171	F94-A140 HydrophobicContact CE2-CB 4.03Å; F94-A140 HydrophobicContact CZ-CB 3.97Å; V96-A140 HydrophobicContact CG2-CB 3.76Å; V115-A140 HydrophobicContact CG2-CB 4.04Å; T136-A140 VanDerWaalsContact O-CB 3.3Å; T136-A140 WeakPolarHBondContact O-CB 3.37Å; T136-A140 PolarHBondContact O-N 3.11Å; R137-A140 PolarHBondContact O-N 3.32Å; A140-T142 PolarHBondContact O-N 3.23Å; A140-L144 VanDerWaalsContact O-CB 3.24Å; A140-L144 WeakPolarHBondContact O-CB 3.31Å; A140-L144 PolarHBondContact O-N 2.87Å; A140-M167 HydrophobicContact CB-CE 4.32Å; A140-L171 HydrophobicContact CB-CD1 4.03Å; A140-L171 HydrophobicContact CB-CD2 4.32Å
141	A	96.6	Very high	95.1	Very high	13 Å²	13	47 Å²	47	11%	0.107	24%	0.243	C	C	.	.	H	α-helix	trans	-61.9	-42.6	176.7	0	0	0	0	0	112.4	V96 R137 L138 L139 R145	V96-A141 HydrophobicContact CG1-CB 4.04Å; R137-A141 PolarHBondContact O-N 2.91Å; R137-A141 VanDerWaalsContact O-N 3.14Å; L138-A141 PolarHBondContact O-N 2.96Å; L139-A141 VanDerWaalsContact C-N 3.34Å; L139-A141 PolarHBondContact O-N 3.1Å; A141-R145 WeakPolarHBondContact O-CB 3.49Å; A141-R145 PolarHBondContact O-N 3.05Å; A141-R145 VanDerWaalsContact O-N 3.09Å
142	T	96.1	Very high	95.3	Very high	70 Å²	70	46.3 Å²	46.3	43%	0.429	24%	0.239	S	C	.	.	H	α-helix	trans	-71.2	-42.2	-179	-51.5	0	0	0	0	111.5	L138 L139 A140 R145 N146	L138-T142 PolarHBondContact O-N 3.21Å; L138-T142 VanDerWaalsContact O-N 3.07Å; L138-T142 PolarHBondContact O-OG1 2.99Å; L139-T142 PolarHBondContact O-N 2.79Å; A140-T142 PolarHBondContact O-N 3.23Å; T142-R145 PolarHBondContact O-N 3.24Å; T142-N146 PolarHBondContact O-N 3.42Å; T142-N146 PolarHBondContact O-ND2 3.21Å
143	T	96.6	Very high	95.5	Very high	13 Å²	13	46.3 Å²	46.3	8%	0.08	24%	0.238	C	C	.	.	H	α-helix	trans	-65	-43.2	176.1	-56.7	0	0	0	0	111.3	L139 R145 N146 V147 M167 M170 L171	L139-T143 WeakPolarHBondContact O-CB 3.35Å; L139-T143 PolarHBondContact O-N 2.49Å; L139-T143 PolarHBondContact O-OG1 3.11Å; T143-R145 VanDerWaalsContact C-N 3.31Å; T143-R145 PolarHBondContact O-N 3.05Å; T143-N146 PolarHBondContact O-N 3.06Å; T143-V147 HydrophobicContact CG2-CG2 4.33Å; T143-V147 WeakPolarHBondContact O-CG2 3.42Å; T143-V147 PolarHBondContact O-N 3.49Å; T143-M167 HydrophobicContact CG2-CG 4.18Å; T143-M170 HydrophobicContact CG2-CB 3.79Å; T143-M170 HydrophobicContact CG2-SD 4.26Å; T143-L171 HydrophobicContact CG2-CD2 4.15Å; T143-L171 HydrophobicContact CG2-CG 4.13Å; T143-L171 WeakPolarHBondContact OG1-CD2 3.44Å
144	L	96	Very high	95.6	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-56.4	-48	174.9	179.4	60.4	0	0	0	110.6	V96 Q99 V111 A113 A140 N146 V147 L148 M167	V96-L144 HydrophobicContact CG1-CD2 3.99Å; Q99-L144 HydrophobicContact CB-CD2 4.46Å; Q99-L144 HydrophobicContact CG-CD2 3.91Å; Q99-L144 HydrophobicContact CG-CG 4.31Å; V111-L144 HydrophobicContact CG1-CD1 4.48Å; A113-L144 HydrophobicContact CB-CD2 3.94Å; A140-L144 VanDerWaalsContact O-CB 3.24Å; A140-L144 WeakPolarHBondContact O-CB 3.31Å; A140-L144 PolarHBondContact O-N 2.87Å; L144-N146 VanDerWaalsContact C-N 3.35Å; L144-N146 PolarHBondContact O-N 3.38Å; L144-V147 PolarHBondContact O-N 2.8Å; L144-L148 HydrophobicContact CD1-CD1 3.67Å; L144-L148 HydrophobicContact CD1-CD2 4.44Å; L144-L148 HydrophobicContact CD1-CG 3.94Å; L144-L148 HydrophobicContact CG-CD1 3.72Å; L144-L148 HydrophobicContact CG-CG 4.38Å; L144-L148 WeakPolarHBondContact O-CB 3.37Å; L144-L148 WeakPolarHBondContact O-CG 2.99Å; L144-L148 PolarHBondContact O-N 3.26Å; L144-M167 HydrophobicContact CB-CE 3.9Å; L144-M167 HydrophobicContact CB-SD 3.86Å; L144-M167 HydrophobicContact CD1-CE 4.49Å; L144-M167 HydrophobicContact CD1-SD 3.68Å; L144-M167 HydrophobicContact CG-SD 4.32Å
145	R	95.9	Very high	95.7	Very high	122 Å²	122	43.3 Å²	43.3	46%	0.46	24%	0.236	S	C	.	.	H	α-helix	trans	-57.3	-46.2	176.6	177.1	178.2	-59.1	165.3	3.4	112.7	V101 A141 T142 T143 G149	V101-R145 HydrophobicContact CG1-CG 4.35Å; V101-R145 HydrophobicContact CG2-CB 4.15Å; V101-R145 HydrophobicContact CG2-CG 3.81Å; A141-R145 WeakPolarHBondContact O-CB 3.49Å; A141-R145 PolarHBondContact O-N 3.05Å; A141-R145 VanDerWaalsContact O-N 3.09Å; T142-R145 PolarHBondContact O-N 3.24Å; T143-R145 VanDerWaalsContact C-N 3.31Å; T143-R145 PolarHBondContact O-N 3.05Å; R145-G149 PolarHBondContact O-N 3.21Å; R145-G149 VanDerWaalsContact O-N 3.11Å
146	N	95.4	Very high	95.7	Very high	99 Å²	99	42 Å²	42	53%	0.529	23%	0.226	S	C	.	.	H	α-helix	trans	-65.7	-42.7	-178.4	-68.2	-16.6	0	0	0	112.1	T142 T143 L144 G149	T142-N146 PolarHBondContact O-N 3.42Å; T142-N146 PolarHBondContact O-ND2 3.21Å; T143-N146 PolarHBondContact O-N 3.06Å; L144-N146 VanDerWaalsContact C-N 3.35Å; L144-N146 PolarHBondContact O-N 3.38Å; N146-G149 PolarHBondContact O-N 2.91Å
147	V	95.5	Very high	95.7	Very high	3 Å²	3	45 Å²	45	2%	0.018	24%	0.242	C	C	.	.	H	α-helix	trans	-65	-47.9	178.4	176.7	0	0	0	0	110.8	T143 L144 G149 T150 I163 M166 M170	T143-V147 HydrophobicContact CG2-CG2 4.33Å; T143-V147 WeakPolarHBondContact O-CG2 3.42Å; T143-V147 PolarHBondContact O-N 3.49Å; L144-V147 PolarHBondContact O-N 2.8Å; V147-G149 VanDerWaalsContact C-N 3.27Å; V147-G149 PolarHBondContact O-N 3.23Å; V147-T150 PolarHBondContact O-N 2.83Å; V147-T150 PolarHBondContact O-OG1 3.32Å; V147-I163 HydrophobicContact CG1-CG2 3.91Å; V147-M166 HydrophobicContact CG1-SD 4.22Å; V147-M170 HydrophobicContact CG2-CE 3.39Å; V147-M170 HydrophobicContact CG2-SD 4.24Å
148	L	95.1	Very high	95.6	Very high	1 Å²	1	45 Å²	45	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-61.7	-35.2	-179	-67.8	172.1	0	0	0	112.6	V101 V111 L144 T150 K151 I156	V101-L148 HydrophobicContact CB-CB 4.46Å; V101-L148 HydrophobicContact CG1-CB 4.35Å; V101-L148 HydrophobicContact CG2-CD1 4.44Å; V111-L148 HydrophobicContact CB-CD1 3.57Å; V111-L148 HydrophobicContact CB-CD2 4.48Å; V111-L148 HydrophobicContact CG1-CD1 4.02Å; V111-L148 HydrophobicContact CG1-CD2 4.38Å; V111-L148 HydrophobicContact CG2-CD1 3.82Å; V111-L148 HydrophobicContact CG2-CD2 4.16Å; L144-L148 HydrophobicContact CD1-CD1 3.67Å; L144-L148 HydrophobicContact CD1-CD2 4.44Å; L144-L148 HydrophobicContact CD1-CG 3.94Å; L144-L148 HydrophobicContact CG-CD1 3.72Å; L144-L148 HydrophobicContact CG-CG 4.38Å; L144-L148 WeakPolarHBondContact O-CB 3.37Å; L144-L148 WeakPolarHBondContact O-CG 2.99Å; L144-L148 PolarHBondContact O-N 3.26Å; L148-T150 PolarHBondContact O-N 2.92Å; L148-K151 PolarHBondContact O-N 3.49Å; L148-I156 HydrophobicContact CD2-CD1 3.97Å; L148-I156 HydrophobicContact CD2-CG1 4.04Å; L148-I156 HydrophobicContact CD2-CG2 4.22Å
149	G	95.4	Very high	95.6	Very high	30 Å²	30	43.6 Å²	43.6	31%	0.309	25%	0.246	S	C	.	.	H	α-helix	trans	-65.7	-19.5	176.1	0	0	0	0	0	114.4	R145 N146 V147	R145-G149 PolarHBondContact O-N 3.21Å; R145-G149 VanDerWaalsContact O-N 3.11Å; N146-G149 PolarHBondContact O-N 2.91Å; V147-G149 VanDerWaalsContact C-N 3.27Å; V147-G149 PolarHBondContact O-N 3.23Å
150	T	95.4	Very high	95.5	Very high	84 Å²	84	46.1 Å²	46.1	52%	0.515	25%	0.253	S	S	.	.	H	α-helix	trans	-91.1	-10.4	178.1	66.6	0	0	0	0	113.8	V147 L148	V147-T150 PolarHBondContact O-N 2.83Å; V147-T150 PolarHBondContact O-OG1 3.32Å; L148-T150 PolarHBondContact O-N 2.92Å
151	K	96.2	Very high	95.4	Very high	30 Å²	30	53 Å²	53	13%	0.13	29%	0.29	C	S	.	.	S	Bend	trans	-107.5	150.1	-171.1	-69.6	-71.9	178.7	170.9	0	111.7	T103 R104 L148 E155 I156 I163	T103-K151 WeakPolarHBondContact CB-O 3.47Å; R104-K151 WeakPolarHBondContact CB-O 3.45Å; R104-K151 PolarHBondContact N-O 3.36Å; L148-K151 PolarHBondContact O-N 3.49Å; K151-E155 HydrophobicContact CD-CB 4.31Å; K151-E155 WeakPolarHBondContact CD-OE2 3.5Å; K151-E155 IonicContact NZ-OE2 3.15Å; K151-E155 PolarHBondContact NZ-OE2 2.73Å; K151-I156 HydrophobicContact CB-CD1 4.16Å; K151-I156 HydrophobicContact CB-CG1 3.85Å; K151-I163 HydrophobicContact CG-CD1 4.35Å; K151-I163 HydrophobicContact CG-CG1 4.34Å
152	N	96.7	Very high	95.4	Very high	40 Å²	40	55.7 Å²	55.7	21%	0.214	31%	0.305	C	S	.	.			trans	-80.7	157.7	173.2	-62.2	-41.5	0	0	0	110.3	R104 S154 E155 I156	R104-N152 WeakPolarHBondContact CB-OD1 3.29Å; N152-S154 VanDerWaalsContact C-N 3.3Å; N152-S154 PolarHBondContact O-N 3.4Å; N152-E155 HydrophobicContact CB-CG 4.41Å; N152-E155 PolarHBondContact ND2-OE1 2.8Å; N152-E155 PolarHBondContact O-N 2.7Å; N152-I156 WeakPolarHBondContact O-CG1 3.18Å; N152-I156 PolarHBondContact O-N 2.96Å
153	L	95.2	Very high	95.4	Very high	10 Å²	10	52.4 Å²	52.4	5%	0.052	29%	0.285	C	S	.	.	H	α-helix	trans	-55.2	-44.9	177	176.4	65.3	0	0	0	112.4	D105 V107 V109 E155 I156 L157 L192 M200	D105-L153 PolarHBondContact OD1-N 3.4Å; D105-L153 VanDerWaalsContact OD1-N 3.11Å; D105-L153 WeakPolarHBondContact OD2-CB 3.42Å; D105-L153 PolarHBondContact OD2-N 3.01Å; D105-L153 VanDerWaalsContact OD2-N 3.11Å; V107-L153 HydrophobicContact CG1-CD2 4.26Å; V107-L153 HydrophobicContact CG2-CD2 4.5Å; V109-L153 HydrophobicContact CG1-CD1 3.6Å; L153-E155 VanDerWaalsContact C-N 3.33Å; L153-E155 PolarHBondContact O-N 3.11Å; L153-I156 PolarHBondContact O-N 3.2Å; L153-L157 HydrophobicContact CD1-CD1 4.11Å; L153-L157 HydrophobicContact CD1-CG 4.25Å; L153-L157 HydrophobicContact CG-CD1 4.07Å; L153-L157 WeakPolarHBondContact O-CG 3.4Å; L153-L157 PolarHBondContact O-N 3.01Å; L153-L192 HydrophobicContact CD1-CD2 3.82Å; L153-L192 HydrophobicContact CD1-CG 4.43Å; L153-L192 HydrophobicContact CD2-CD2 3.94Å; L153-L192 HydrophobicContact CG-CD2 4.46Å; L153-M200 HydrophobicContact CD2-CE 3.88Å; L153-M200 HydrophobicContact CD2-SD 3.79Å
154	S	94.5	Very high	95.3	Very high	77 Å²	77	52.4 Å²	52.4	54%	0.538	29%	0.285	S	S	.	.	H	α-helix	trans	-59.8	-44.5	-179.3	59.8	0	0	0	0	111.7	N152 I156 L157 S158	N152-S154 VanDerWaalsContact C-N 3.3Å; N152-S154 PolarHBondContact O-N 3.4Å; S154-I156 VanDerWaalsContact C-N 3.35Å; S154-I156 PolarHBondContact O-N 3.05Å; S154-L157 PolarHBondContact O-N 3.32Å; S154-S158 PolarHBondContact O-N 2.86Å; S154-S158 PolarHBondContact O-OG 3.41Å
155	E	95.8	Very high	95.3	Very high	42 Å²	42	53.7 Å²	53.7	20%	0.196	30%	0.299	C	S	.	.	H	α-helix	trans	-63.5	-40.2	177.4	-69.7	173.4	-135.3	0	0	111.3	K151 N152 L153 L157 S158 E159	K151-E155 HydrophobicContact CD-CB 4.31Å; K151-E155 WeakPolarHBondContact CD-OE2 3.5Å; K151-E155 IonicContact NZ-OE2 3.15Å; K151-E155 PolarHBondContact NZ-OE2 2.73Å; N152-E155 HydrophobicContact CB-CG 4.41Å; N152-E155 PolarHBondContact ND2-OE1 2.8Å; N152-E155 PolarHBondContact O-N 2.7Å; L153-E155 VanDerWaalsContact C-N 3.33Å; L153-E155 PolarHBondContact O-N 3.11Å; E155-L157 VanDerWaalsContact C-N 3.27Å; E155-L157 PolarHBondContact O-N 3.49Å; E155-S158 PolarHBondContact O-N 3.09Å; E155-E159 WeakPolarHBondContact O-CA 3.4Å; E155-E159 WeakPolarHBondContact O-CB 3.24Å; E155-E159 PolarHBondContact O-N 3.34Å
156	I	95.3	Very high	95.3	Very high	2 Å²	2	51.6 Å²	51.6	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-62.4	-36.8	176.4	-65.5	164.6	0	0	0	111.5	T103 V109 V111 L148 K151 N152 L153 S154 R160 I163 V190	T103-I156 HydrophobicContact CG2-CD1 3.49Å; T103-I156 VanDerWaalsContact CG2-CD1 3.49Å; V109-I156 HydrophobicContact CG2-CD1 4.48Å; V111-I156 HydrophobicContact CG2-CG2 4.43Å; L148-I156 HydrophobicContact CD2-CD1 3.97Å; L148-I156 HydrophobicContact CD2-CG1 4.04Å; L148-I156 HydrophobicContact CD2-CG2 4.22Å; K151-I156 HydrophobicContact CB-CD1 4.16Å; K151-I156 HydrophobicContact CB-CG1 3.85Å; N152-I156 WeakPolarHBondContact O-CG1 3.18Å; N152-I156 PolarHBondContact O-N 2.96Å; L153-I156 PolarHBondContact O-N 3.2Å; S154-I156 VanDerWaalsContact C-N 3.35Å; S154-I156 PolarHBondContact O-N 3.05Å; I156-R160 WeakPolarHBondContact O-CG 3.29Å; I156-I163 HydrophobicContact CB-CD1 4.16Å; I156-I163 HydrophobicContact CG1-CD1 3.81Å; I156-V190 HydrophobicContact CG2-CG1 4.15Å; I156-V190 HydrophobicContact CG2-CG2 4.06Å
157	L	93.1	Very high	95.4	Very high	63 Å²	63	46.9 Å²	46.9	33%	0.33	27%	0.27	S	S	.	.	H	α-helix	trans	-78.4	-40.1	-179.8	-66.2	176.2	0	0	0	113	L153 S154 E155 V190	L153-L157 HydrophobicContact CD1-CD1 4.11Å; L153-L157 HydrophobicContact CD1-CG 4.25Å; L153-L157 HydrophobicContact CG-CD1 4.07Å; L153-L157 WeakPolarHBondContact O-CG 3.4Å; L153-L157 PolarHBondContact O-N 3.01Å; S154-L157 PolarHBondContact O-N 3.32Å; E155-L157 VanDerWaalsContact C-N 3.27Å; E155-L157 PolarHBondContact O-N 3.49Å; L157-V190 HydrophobicContact CD2-CB 4.22Å; L157-V190 HydrophobicContact CD2-CG1 3.86Å
158	S	94.5	Very high	95.5	Very high	91 Å²	91	49.6 Å²	49.6	64%	0.636	28%	0.282	S	S	*	.	H	α-helix	trans	-94.3	-34.9	-174.6	61.5	0	0	0	0	114.7	S154 E155	S154-S158 PolarHBondContact O-N 2.86Å; S154-S158 PolarHBondContact O-OG 3.41Å; E155-S158 PolarHBondContact O-N 3.09Å
159	E	95	Very high	95.5	Very high	83 Å²	83	53.9 Å²	53.9	39%	0.388	31%	0.309	S	S	.	.			trans	-109.2	42.8	-169.6	-58.8	-174.8	176.3	0	0	112.8	E155 D161 T162 I163	E155-E159 WeakPolarHBondContact O-CA 3.4Å; E155-E159 WeakPolarHBondContact O-CB 3.24Å; E155-E159 PolarHBondContact O-N 3.34Å; E159-D161 PolarHBondContact O-N 3Å; E159-T162 HydrophobicContact CB-CG2 3.99Å; E159-T162 WeakPolarHBondContact CB-OG1 3.2Å; E159-T162 PolarHBondContact O-N 2.79Å; E159-T162 PolarHBondContact O-OG1 2.93Å; E159-I163 PolarHBondContact O-N 3.05Å
160	R	95	Very high	95.6	Very high	95 Å²	95	56.2 Å²	56.2	36%	0.358	31%	0.312	S	S	.	.	H	α-helix	trans	-55.7	-36.3	-177.3	-64.2	-178.2	-175.7	-162.3	-2.8	113.3	I156 T162 I163 S164	I156-R160 WeakPolarHBondContact O-CG 3.29Å; R160-T162 VanDerWaalsContact C-N 3.35Å; R160-T162 PolarHBondContact O-N 3.19Å; R160-I163 PolarHBondContact O-N 3.5Å; R160-S164 VanDerWaalsContact O-CB 3.29Å; R160-S164 WeakPolarHBondContact O-CB 3.37Å; R160-S164 PolarHBondContact O-N 3.3Å; R160-S164 PolarHBondContact O-OG 2.87Å
161	D	95.1	Very high	95.6	Very high	145 Å²	145	52.2 Å²	52.2	78%	0.775	29%	0.288	S	S	*	.	H	α-helix	trans	-66.8	-36.8	179.4	-62.2	-35.2	0	0	0	112.1	E159 S164 G165	E159-D161 PolarHBondContact O-N 3Å; D161-S164 PolarHBondContact O-N 2.78Å; D161-G165 PolarHBondContact O-N 3.39Å
162	T	95.3	Very high	95.6	Very high	69 Å²	69	52.3 Å²	52.3	42%	0.423	29%	0.29	S	S	.	.	H	α-helix	trans	-68.4	-41.5	179.2	74.8	0	0	0	0	111.2	E159 R160 G165 M166	E159-T162 HydrophobicContact CB-CG2 3.99Å; E159-T162 WeakPolarHBondContact CB-OG1 3.2Å; E159-T162 PolarHBondContact O-N 2.79Å; E159-T162 PolarHBondContact O-OG1 2.93Å; R160-T162 VanDerWaalsContact C-N 3.35Å; R160-T162 PolarHBondContact O-N 3.19Å; T162-G165 PolarHBondContact O-N 2.73Å; T162-M166 VanDerWaalsContact O-CB 3.29Å; T162-M166 WeakPolarHBondContact O-CB 3.31Å; T162-M166 PolarHBondContact O-N 3.37Å
163	I	95.8	Very high	95.6	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.01	30%	0.304	C	S	.	.	H	α-helix	trans	-65.5	-44.2	176.6	-66.5	173.3	0	0	0	109.8	V147 K151 I156 E159 R160 M166 M167 V187	V147-I163 HydrophobicContact CG1-CG2 3.91Å; K151-I163 HydrophobicContact CG-CD1 4.35Å; K151-I163 HydrophobicContact CG-CG1 4.34Å; I156-I163 HydrophobicContact CB-CD1 4.16Å; I156-I163 HydrophobicContact CG1-CD1 3.81Å; E159-I163 PolarHBondContact O-N 3.05Å; R160-I163 PolarHBondContact O-N 3.5Å; I163-M166 PolarHBondContact O-N 2.94Å; I163-M167 VanDerWaalsContact O-CB 3.31Å; I163-M167 WeakPolarHBondContact O-CB 3.46Å; I163-M167 PolarHBondContact O-N 3.07Å; I163-V187 HydrophobicContact CG2-CG2 4.44Å
164	S	95.6	Very high	95.6	Very high	12 Å²	12	57.2 Å²	57.2	8%	0.084	32%	0.319	C	S	.	.	H	α-helix	trans	-61.2	-46.4	177.5	-61.4	0	0	0	0	111.8	R160 D161 M167 Q168 V185	R160-S164 VanDerWaalsContact O-CB 3.29Å; R160-S164 WeakPolarHBondContact O-CB 3.37Å; R160-S164 PolarHBondContact O-N 3.3Å; R160-S164 PolarHBondContact O-OG 2.87Å; D161-S164 PolarHBondContact O-N 2.78Å; S164-M167 PolarHBondContact O-N 3.47Å; S164-Q168 VanDerWaalsContact O-CB 3.3Å; S164-Q168 WeakPolarHBondContact O-CB 3.29Å; S164-Q168 PolarHBondContact O-N 2.82Å; S164-V185 WeakPolarHBondContact CB-O 3.34Å
165	G	96.5	Very high	95.7	Very high	28 Å²	28	53.6 Å²	53.6	29%	0.289	29%	0.293	S	S	.	.	H	α-helix	trans	-66.8	-37.2	177.4	0	0	0	0	0	113.4	D161 T162 T169	D161-G165 PolarHBondContact O-N 3.39Å; T162-G165 PolarHBondContact O-N 2.73Å; G165-T169 PolarHBondContact O-N 2.95Å; G165-T169 PolarHBondContact O-OG1 3.45Å
166	M	96	Very high	95.6	Very high	77 Å²	77	54.8 Å²	54.8	38%	0.379	30%	0.301	S	S	.	.	H	α-helix	trans	-67.1	-45.2	175.8	-172.5	-176	-69	0	0	111.4	V147 T162 I163 T169 M170	V147-M166 HydrophobicContact CG1-SD 4.22Å; T162-M166 VanDerWaalsContact O-CB 3.29Å; T162-M166 WeakPolarHBondContact O-CB 3.31Å; T162-M166 PolarHBondContact O-N 3.37Å; I163-M166 PolarHBondContact O-N 2.94Å; M166-T169 PolarHBondContact O-N 3.18Å; M166-M170 HydrophobicContact CG-CE 3.43Å; M166-M170 VanDerWaalsContact CG-CE 3.43Å; M166-M170 PolarHBondContact O-N 2.87Å; M166-M170 VanDerWaalsContact O-N 3.11Å; M166-M170 HydrophobicContact SD-CE 3.82Å
167	M	96.2	Very high	95.6	Very high	1 Å²	1	58 Å²	58	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-64.4	-41.8	175.7	-179.9	173	160.9	0	0	111.7	V115 A140 T143 L144 I163 S164 T169 M170 L171 V185	V115-M167 HydrophobicContact CG2-CE 4.22Å; A140-M167 HydrophobicContact CB-CE 4.32Å; T143-M167 HydrophobicContact CG2-CG 4.18Å; L144-M167 HydrophobicContact CB-CE 3.9Å; L144-M167 HydrophobicContact CB-SD 3.86Å; L144-M167 HydrophobicContact CD1-CE 4.49Å; L144-M167 HydrophobicContact CD1-SD 3.68Å; L144-M167 HydrophobicContact CG-SD 4.32Å; I163-M167 VanDerWaalsContact O-CB 3.31Å; I163-M167 WeakPolarHBondContact O-CB 3.46Å; I163-M167 PolarHBondContact O-N 3.07Å; S164-M167 PolarHBondContact O-N 3.47Å; M167-T169 VanDerWaalsContact C-N 3.33Å; M167-T169 PolarHBondContact O-N 2.84Å; M167-M170 PolarHBondContact O-N 3.37Å; M167-L171 HydrophobicContact CE-CD1 3.58Å; M167-L171 HydrophobicContact CG-CD1 3.84Å; M167-L171 HydrophobicContact CG-CG 4.26Å; M167-L171 WeakPolarHBondContact O-CB 3.3Å; M167-L171 WeakPolarHBondContact O-CG 3.34Å; M167-L171 PolarHBondContact O-N 3.48Å; M167-V185 HydrophobicContact CB-CG1 4.42Å; M167-V185 HydrophobicContact CE-CG1 3.71Å; M167-V185 HydrophobicContact CG-CG1 4.04Å; M167-V185 HydrophobicContact CG-CG2 4.44Å; M167-V185 HydrophobicContact SD-CG1 3.65Å
168	Q	96.9	Very high	95.6	Very high	59 Å²	59	57.8 Å²	57.8	28%	0.276	32%	0.317	S	S	.	.	H	α-helix	trans	-56.3	-48.4	174.5	176.9	177.4	-0.8	0	0	111.1	S164 M170 L171 D172 V182 E183 V185	S164-Q168 VanDerWaalsContact O-CB 3.3Å; S164-Q168 WeakPolarHBondContact O-CB 3.29Å; S164-Q168 PolarHBondContact O-N 2.82Å; Q168-M170 PolarHBondContact O-N 2.95Å; Q168-L171 PolarHBondContact O-N 3.39Å; Q168-D172 VanDerWaalsContact O-CB 3.23Å; Q168-D172 WeakPolarHBondContact O-CB 3.46Å; Q168-D172 PolarHBondContact O-N 3.39Å; Q168-V182 HydrophobicContact CG-CG1 4.29Å; Q168-V182 PolarHBondContact NE2-O 3.02Å; Q168-E183 VanDerWaalsContact NE2-C 3.34Å; Q168-E183 PolarHBondContact NE2-O 2.85Å; Q168-V185 HydrophobicContact CB-CB 4.42Å; Q168-V185 HydrophobicContact CB-CG2 3.97Å
169	T	97	Very high	95.6	Very high	92 Å²	92	53.4 Å²	53.4	56%	0.564	29%	0.286	S	S	*	.	H	α-helix	trans	-61.7	-46.7	-178.7	-54.5	0	0	0	0	111.5	G165 M166 M167 D172 E173	G165-T169 PolarHBondContact O-N 2.95Å; G165-T169 PolarHBondContact O-OG1 3.45Å; M166-T169 PolarHBondContact O-N 3.18Å; M167-T169 VanDerWaalsContact C-N 3.33Å; M167-T169 PolarHBondContact O-N 2.84Å; T169-D172 PolarHBondContact O-N 2.91Å; T169-E173 PolarHBondContact O-N 2.97Å; T169-E173 VanDerWaalsContact O-N 3.13Å
170	M	96.5	Very high	95.6	Very high	78 Å²	78	49.5 Å²	49.5	38%	0.384	27%	0.268	S	S	.	.	H	α-helix	trans	-64.9	-40.1	178.5	-74.5	-167.7	-119.1	0	0	112.9	T143 V147 M166 M167 Q168 A174	T143-M170 HydrophobicContact CG2-CB 3.79Å; T143-M170 HydrophobicContact CG2-SD 4.26Å; V147-M170 HydrophobicContact CG2-CE 3.39Å; V147-M170 HydrophobicContact CG2-SD 4.24Å; M166-M170 HydrophobicContact CG-CE 3.43Å; M166-M170 VanDerWaalsContact CG-CE 3.43Å; M166-M170 PolarHBondContact O-N 2.87Å; M166-M170 VanDerWaalsContact O-N 3.11Å; M166-M170 HydrophobicContact SD-CE 3.82Å; M167-M170 PolarHBondContact O-N 3.37Å; Q168-M170 PolarHBondContact O-N 2.95Å; M170-A174 VanDerWaalsContact O-CB 3.31Å; M170-A174 WeakPolarHBondContact O-CB 3.3Å; M170-A174 PolarHBondContact O-N 3.46Å; M170-A174 VanDerWaalsContact O-N 3.15Å
171	L	96.1	Very high	95.7	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-69.2	-43.9	178.1	-73.3	177	0	0	0	111.9	V115 L139 A140 T143 M167 Q168 E173 A174 T175 V182 V185	V115-L171 HydrophobicContact CG2-CD1 4.36Å; L139-L171 HydrophobicContact CD2-CD2 4.28Å; L139-L171 HydrophobicContact CG-CD2 3.84Å; A140-L171 HydrophobicContact CB-CD1 4.03Å; A140-L171 HydrophobicContact CB-CD2 4.32Å; T143-L171 HydrophobicContact CG2-CD2 4.15Å; T143-L171 HydrophobicContact CG2-CG 4.13Å; T143-L171 WeakPolarHBondContact OG1-CD2 3.44Å; M167-L171 HydrophobicContact CE-CD1 3.58Å; M167-L171 HydrophobicContact CG-CD1 3.84Å; M167-L171 HydrophobicContact CG-CG 4.26Å; M167-L171 WeakPolarHBondContact O-CB 3.3Å; M167-L171 WeakPolarHBondContact O-CG 3.34Å; M167-L171 PolarHBondContact O-N 3.48Å; Q168-L171 PolarHBondContact O-N 3.39Å; L171-E173 PolarHBondContact O-N 3.32Å; L171-A174 PolarHBondContact O-N 3.16Å; L171-T175 WeakPolarHBondContact O-CB 3.46Å; L171-T175 VanDerWaalsContact O-CG2 3.24Å; L171-T175 WeakPolarHBondContact O-CG2 3.39Å; L171-T175 PolarHBondContact O-N 2.84Å; L171-T175 PolarHBondContact O-OG1 3.14Å; L171-V182 HydrophobicContact CB-CG2 4.07Å; L171-V185 HydrophobicContact CD1-CG2 4.12Å
172	D	96.5	Very high	95.8	Very high	31 Å²	31	41.3 Å²	41.3	17%	0.166	23%	0.228	C	C	.	.	H	α-helix	trans	-57.1	-50.8	178.3	-170	55.1	0	0	0	111	Q168 T169 A174 T175 D176 K181 V182	Q168-D172 VanDerWaalsContact O-CB 3.23Å; Q168-D172 WeakPolarHBondContact O-CB 3.46Å; Q168-D172 PolarHBondContact O-N 3.39Å; T169-D172 PolarHBondContact O-N 2.91Å; D172-A174 VanDerWaalsContact C-N 3.34Å; D172-A174 PolarHBondContact O-N 2.88Å; D172-T175 PolarHBondContact O-N 3.43Å; D172-T175 PolarHBondContact O-OG1 2.91Å; D172-D176 PolarHBondContact O-N 3.14Å; D172-K181 VanDerWaalsContact OD1-CD 3.3Å; D172-K181 WeakPolarHBondContact OD1-CD 3.44Å; D172-K181 VanDerWaalsContact OD1-CE 3.24Å; D172-K181 WeakPolarHBondContact OD1-CE 3.44Å; D172-K181 IonicContact OD1-NZ 3.26Å; D172-K181 PolarHBondContact OD1-NZ 3.45Å; D172-K181 IonicContact OD2-NZ 2.77Å; D172-K181 PolarHBondContact OD2-NZ 3.46Å; D172-V182 HydrophobicContact CB-CB 4.31Å; D172-V182 PolarHBondContact OD1-N 2.88Å
173	E	96.6	Very high	95.8	Very high	111 Å²	111	41.8 Å²	41.8	52%	0.519	23%	0.226	S	C	.	.	H	α-helix	trans	-60.2	-40.8	177.9	-176.3	174.5	-173.6	0	0	112.7	T169 L171	T169-E173 PolarHBondContact O-N 2.97Å; T169-E173 VanDerWaalsContact O-N 3.13Å; L171-E173 PolarHBondContact O-N 3.32Å
174	A	95	Very high	95.8	Very high	43 Å²	43	47.4 Å²	47.4	36%	0.355	25%	0.247	S	C	.	.	H	α-helix	trans	-75.3	-26.5	179.9	0	0	0	0	0	113.3	L139 M170 L171 D172	L139-A174 HydrophobicContact CD1-CB 4.45Å; L139-A174 HydrophobicContact CD2-CB 3.69Å; M170-A174 VanDerWaalsContact O-CB 3.31Å; M170-A174 WeakPolarHBondContact O-CB 3.3Å; M170-A174 PolarHBondContact O-N 3.46Å; M170-A174 VanDerWaalsContact O-N 3.15Å; L171-A174 PolarHBondContact O-N 3.16Å; D172-A174 VanDerWaalsContact C-N 3.34Å; D172-A174 PolarHBondContact O-N 2.88Å
175	T	95.4	Very high	95.9	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-92	-13.7	179.5	62	0	0	0	0	114.6	T136 L139 L171 D172 P177 W178 V180 V182	T136-T175 HydrophobicContact CG2-CG2 4.16Å; L139-T175 HydrophobicContact CD2-CG2 3.8Å; L171-T175 WeakPolarHBondContact O-CB 3.46Å; L171-T175 VanDerWaalsContact O-CG2 3.24Å; L171-T175 WeakPolarHBondContact O-CG2 3.39Å; L171-T175 PolarHBondContact O-N 2.84Å; L171-T175 PolarHBondContact O-OG1 3.14Å; D172-T175 PolarHBondContact O-N 3.43Å; D172-T175 PolarHBondContact O-OG1 2.91Å; T175-P177 VanDerWaalsContact C-CD 3.42Å; T175-P177 VanDerWaalsContact C-N 3.33Å; T175-W178 HydrophobicContact CG2-CE3 3.95Å; T175-W178 HydrophobicContact CG2-CZ3 3.99Å; T175-W178 WeakPolarHBondContact O-CA 3.31Å; T175-W178 WeakPolarHBondContact O-CB 3.38Å; T175-W178 PolarHBondContact O-N 2.67Å; T175-V180 HydrophobicContact CG2-CG1 4.44Å; T175-V180 PolarHBondContact OG1-O 3.27Å; T175-V182 HydrophobicContact CG2-CG2 4.49Å
176	D	94.7	Very high	95.9	Very high	68 Å²	68	48.9 Å²	48.9	36%	0.364	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-49.2	-44.5	177.8	-90.9	-15	0	0	0	113.4	D172 W178 G179	D172-D176 PolarHBondContact O-N 3.14Å; D176-W178 PolarHBondContact O-N 3.15Å; D176-W178 VanDerWaalsContact O-N 3.16Å; D176-G179 PolarHBondContact O-N 2.97Å; D176-G179 VanDerWaalsContact O-N 3.07Å
177	P	93.9	Very high	95.9	Very high	68 Å²	68	46.3 Å²	46.3	44%	0.442	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-64.8	-16.8	178	-22.4	34.9	0	0	0	114.9	V124 N128 T175	V124-P177 WeakPolarHBondContact CG1-O 3.45Å; N128-P177 PolarHBondContact ND2-O 2.82Å; T175-P177 VanDerWaalsContact C-CD 3.42Å; T175-P177 VanDerWaalsContact C-N 3.33Å
178	W	94.8	Very high	95.8	Very high	59 Å²	59	51.5 Å²	51.5	22%	0.223	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-93.9	1.6	177.3	-55.4	-24.3	0	0	0	112.5	A125 V129 L139 T175 D176 V180	A125-W178 WeakPolarHBondContact CA-O 3.45Å; A125-W178 WeakPolarHBondContact CB-O 3.38Å; A125-W178 PolarHBondContact N-O 3.37Å; V129-W178 HydrophobicContact CB-CG 4.24Å; V129-W178 HydrophobicContact CG1-CB 4.14Å; V129-W178 HydrophobicContact CG1-CG 4.26Å; L139-W178 HydrophobicContact CB-CH2 4.29Å; L139-W178 HydrophobicContact CB-CZ3 4.4Å; L139-W178 HydrophobicContact CD2-CH2 3.71Å; L139-W178 HydrophobicContact CD2-CZ3 3.69Å; T175-W178 HydrophobicContact CG2-CE3 3.95Å; T175-W178 HydrophobicContact CG2-CZ3 3.99Å; T175-W178 WeakPolarHBondContact O-CA 3.31Å; T175-W178 WeakPolarHBondContact O-CB 3.38Å; T175-W178 PolarHBondContact O-N 2.67Å; D176-W178 PolarHBondContact O-N 3.15Å; D176-W178 VanDerWaalsContact O-N 3.16Å; W178-V180 HydrophobicContact CB-CG2 4.38Å; W178-V180 PolarHBondContact O-N 2.9Å
179	G	93.8	Very high	95.7	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	73	16.2	-178.7	0	0	0	0	0	113.5	Y120 N121 D176	Y120-G179 WeakPolarHBondContact CD1-O 3.28Å; Y120-G179 VanDerWaalsContact CE1-C 3.47Å; Y120-G179 PolarHBondContact N-O 3.11Å; N121-G179 PolarHBondContact N-O 3.5Å; N121-G179 VanDerWaalsContact N-O 3.17Å; D176-G179 PolarHBondContact O-N 2.97Å; D176-G179 VanDerWaalsContact O-N 3.07Å
180	V	96.1	Very high	95.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	137.7	179.5	168.5	0	0	0	0	109.2	Y117 I119 A132 T175 W178	Y117-V180 HydrophobicContact CD2-CG1 3.57Å; Y117-V180 HydrophobicContact CE2-CG1 4.36Å; Y117-V180 HydrophobicContact CG-CG1 4.12Å; I119-V180 HydrophobicContact CG1-CG2 4.34Å; A132-V180 HydrophobicContact CB-CG2 4.21Å; T175-V180 HydrophobicContact CG2-CG1 4.44Å; T175-V180 PolarHBondContact OG1-O 3.27Å; W178-V180 HydrophobicContact CB-CG2 4.38Å; W178-V180 PolarHBondContact O-N 2.9Å
181	K	96.2	Very high	95.5	Very high	67 Å²	67	52.6 Å²	52.6	29%	0.291	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	122.3	175.4	-176	73.4	-164.6	160.9	0	109.3	Y117 R118 Y120 D172	Y117-K181 CarbonylContact C-O 3.48Å; Y117-K181 VanDerWaalsContact CA-O 3.25Å; Y117-K181 WeakPolarHBondContact CA-O 3.35Å; Y117-K181 WeakPolarHBondContact CB-O 3.46Å; R118-K181 HydrophobicContact CG-CB 4.34Å; R118-K181 PolarHBondContact N-O 3.36Å; R118-K181 PolarHBondContact O-N 3.39Å; Y120-K181 HydrophobicContact CD1-CB 4.4Å; D172-K181 VanDerWaalsContact OD1-CD 3.3Å; D172-K181 WeakPolarHBondContact OD1-CD 3.44Å; D172-K181 VanDerWaalsContact OD1-CE 3.24Å; D172-K181 WeakPolarHBondContact OD1-CE 3.44Å; D172-K181 IonicContact OD1-NZ 3.26Å; D172-K181 PolarHBondContact OD1-NZ 3.45Å; D172-K181 IonicContact OD2-NZ 2.77Å; D172-K181 PolarHBondContact OD2-NZ 3.46Å
182	V	97.3	Very high	95.4	Very high	1 Å²	1	54 Å²	54	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	114.8	175.4	-176.3	0	0	0	0	109	V115 Q168 L171 D172 T175 V185	V115-V182 HydrophobicContact CG1-CG1 3.99Å; Q168-V182 HydrophobicContact CG-CG1 4.29Å; Q168-V182 PolarHBondContact NE2-O 3.02Å; L171-V182 HydrophobicContact CB-CG2 4.07Å; D172-V182 HydrophobicContact CB-CB 4.31Å; D172-V182 PolarHBondContact OD1-N 2.88Å; T175-V182 HydrophobicContact CG2-CG2 4.49Å; V182-V185 HydrophobicContact CG1-CG2 3.93Å
183	E	95.8	Very high	95.3	Very high	80 Å²	80	55.1 Å²	55.1	37%	0.374	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	-38.3	-176.4	-62	-163.8	141.9	0	0	112.3	T91 Y116 R118 Q168	T91-E183 WeakPolarHBondContact CB-OE2 3.38Å; T91-E183 WeakPolarHBondContact CG2-OE2 3.41Å; T91-E183 PolarHBondContact OG1-OE2 2.69Å; Y116-E183 PolarHBondContact O-N 3.4Å; R118-E183 WeakPolarHBondContact CD-OE1 3.34Å; R118-E183 HydrophobicContact CG-CG 4.31Å; R118-E183 IonicContact CZ-OE1 2.69Å; R118-E183 IonicContact NE-OE1 2.99Å; R118-E183 PolarHBondContact NE-OE1 3.05Å; Q168-E183 VanDerWaalsContact NE2-C 3.34Å; Q168-E183 PolarHBondContact NE2-O 2.85Å
184	R	95.8	Very high	95.2	Very high	120 Å²	120	53.8 Å²	53.8	45%	0.453	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	150.5	179.9	-166.1	164.3	69.5	-145.9	7.1	111.2	Y116 E186	Y116-R184 HydrophobicContact CD2-CB 4.06Å; Y116-R184 HydrophobicContact CG-CB 4.37Å; Y116-R184 PolarHBondContact N-O 3.44Å; Y116-R184 PolarHBondContact O-N 3.45Å; R184-E186 HydrophobicContact CG-CG 4.25Å; R184-E186 IonicContact CZ-OE1 2.58Å; R184-E186 IonicContact NE-OE1 3.9Å; R184-E186 PolarHBondContact NE-OE1 3.05Å; R184-E186 IonicContact NH2-OE1 2.79Å; R184-E186 PolarHBondContact NH2-OE1 3.35Å
185	V	97.5	Very high	95.2	Very high	4 Å²	4	59.9 Å²	59.9	2%	0.024	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	139.5	167.7	-179.6	0	0	0	0	107.4	V114 V115 S164 M167 Q168 L171 V182	V114-V185 WeakPolarHBondContact O-CA 3.23Å; V115-V185 HydrophobicContact CG1-CG2 4.46Å; V115-V185 HydrophobicContact CG2-CG1 4.39Å; V115-V185 HydrophobicContact CG2-CG2 4.29Å; S164-V185 WeakPolarHBondContact CB-O 3.34Å; M167-V185 HydrophobicContact CB-CG1 4.42Å; M167-V185 HydrophobicContact CE-CG1 3.71Å; M167-V185 HydrophobicContact CG-CG1 4.04Å; M167-V185 HydrophobicContact CG-CG2 4.44Å; M167-V185 HydrophobicContact SD-CG1 3.65Å; Q168-V185 HydrophobicContact CB-CB 4.42Å; Q168-V185 HydrophobicContact CB-CG2 3.97Å; L171-V185 HydrophobicContact CD1-CG2 4.12Å; V182-V185 HydrophobicContact CG1-CG2 3.93Å
186	E	96.6	Very high	95.1	Very high	67 Å²	67	62.5 Å²	62.5	31%	0.313	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	132.6	177.2	-69	175.3	178.7	0	0	109.7	A113 V114 Y116 R184	A113-E186 CarbonylContact C-O 3.6Å; A113-E186 WeakPolarHBondContact CA-O 3.3Å; A113-E186 WeakPolarHBondContact CB-O 3.24Å; V114-E186 PolarHBondContact N-O 3.15Å; V114-E186 PolarHBondContact O-N 2.88Å; Y116-E186 HydrophobicContact CE2-CG 4.08Å; Y116-E186 WeakPolarHBondContact CE2-OE2 3.37Å; Y116-E186 PolarHBondContact OH-OE2 3.47Å; R184-E186 HydrophobicContact CG-CG 4.25Å; R184-E186 IonicContact CZ-OE1 2.58Å; R184-E186 IonicContact NE-OE1 3.9Å; R184-E186 PolarHBondContact NE-OE1 3.05Å; R184-E186 IonicContact NH2-OE1 2.79Å; R184-E186 PolarHBondContact NH2-OE1 3.35Å
187	V	95.9	Very high	95.1	Very high	23 Å²	23	64.6 Å²	64.6	14%	0.139	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	125	169.3	179.2	0	0	0	0	108.7	V111 I163 V190	V111-V187 HydrophobicContact CG1-CG1 3.78Å; I163-V187 HydrophobicContact CG2-CG2 4.44Å; V187-V190 HydrophobicContact CG1-CG2 4.03Å
188	K	94.2	Very high	95.2	Very high	109 Å²	109	70 Å²	70	47%	0.474	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-64.8	-173.5	178.2	175.4	178	-178	0	111.3	D95 D112 V114	D95-K188 IonicContact OD1-NZ 3.65Å; D95-K188 PolarHBondContact OD1-NZ 2.9Å; D112-K188 PolarHBondContact O-N 3.25Å; D112-K188 WeakPolarHBondContact OD1-CB 3.41Å; D112-K188 WeakPolarHBondContact OD2-CD 3.48Å; V114-K188 HydrophobicContact CG2-CB 4.35Å; V114-K188 HydrophobicContact CG2-CD 4.02Å
189	D	94.6	Very high	95.2	Very high	76 Å²	76	70 Å²	70	41%	0.406	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	151.8	179	-168.8	25.4	0	0	0	111.9	V111 D112 R191	V111-D189 WeakPolarHBondContact CA-O 3.15Å; D112-D189 PolarHBondContact N-O 2.96Å; D112-D189 VanDerWaalsContact OD1-CA 3.31Å; D112-D189 WeakPolarHBondContact OD1-CA 3.42Å; D112-D189 VanDerWaalsContact OD1-CB 3.32Å; D112-D189 WeakPolarHBondContact OD1-CB 3.37Å; D112-D189 PolarHBondContact OD1-N 3.45Å; D189-R191 WeakPolarHBondContact OD2-CG 3.41Å
190	V	95	Very high	95.3	Very high	11 Å²	11	73.3 Å²	73.3	7%	0.067	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	105.1	176	179.9	0	0	0	0	107.7	V111 I156 L157 V187 L192	V111-V190 HydrophobicContact CG1-CG2 4.28Å; V111-V190 HydrophobicContact CG2-CB 4.45Å; V111-V190 HydrophobicContact CG2-CG1 4.1Å; V111-V190 HydrophobicContact CG2-CG2 4.12Å; I156-V190 HydrophobicContact CG2-CG1 4.15Å; I156-V190 HydrophobicContact CG2-CG2 4.06Å; L157-V190 HydrophobicContact CD2-CB 4.22Å; L157-V190 HydrophobicContact CD2-CG1 3.86Å; V187-V190 HydrophobicContact CG1-CG2 4.03Å; V190-L192 HydrophobicContact CG1-CD1 4.39Å
191	R	94.7	Very high	95.2	Very high	165 Å²	165	76 Å²	76	62%	0.623	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	126.2	-178.6	-60.4	177.5	68	-167.9	1	109.9	A110 D189	A110-R191 HydrophobicContact CB-CB 4.23Å; A110-R191 PolarHBondContact N-O 2.88Å; A110-R191 PolarHBondContact O-N 3.06Å; D189-R191 WeakPolarHBondContact OD2-CG 3.41Å
192	L	94	Very high	95.2	Very high	32 Å²	32	75.6 Å²	75.6	17%	0.168	38%	0.38	C	S	.	.			trans	-105.1	153.7	175.1	-58.1	88.1	0	0	0	109.5	L153 V190 V194 L196 M200	L153-L192 HydrophobicContact CD1-CD2 3.82Å; L153-L192 HydrophobicContact CD1-CG 4.43Å; L153-L192 HydrophobicContact CD2-CD2 3.94Å; L153-L192 HydrophobicContact CG-CD2 4.46Å; V190-L192 HydrophobicContact CG1-CD1 4.39Å; L192-V194 PolarHBondContact O-N 2.68Å; L192-L196 HydrophobicContact CD2-CD2 4.48Å; L192-M200 HydrophobicContact CD2-SD 4.09Å
193	P	93.7	Very high	95.2	Very high	54 Å²	54	82.3 Å²	82.3	35%	0.351	41%	0.411	S	S	.	.			trans	-54.8	133.7	168.7	-24.2	33.1	0	0	0	110.9	T108 Q195 L196 Q197	T108-P193 WeakPolarHBondContact O-CD 3.24Å; T108-P193 WeakPolarHBondContact OG1-CG 3.3Å; P193-Q195 PolarHBondContact O-N 2.87Å; P193-Q195 VanDerWaalsContact O-N 3.11Å; P193-L196 HydrophobicContact CB-CB 4.48Å; P193-L196 PolarHBondContact O-N 2.82Å; P193-Q197 PolarHBondContact O-N 3.06Å
194	V	94.2	Very high	95.1	Very high	82 Å²	82	80.8 Å²	80.8	50%	0.497	41%	0.412	S	S	.	.	H	α-helix	trans	-56.4	-35.1	-174.2	178.7	0	0	0	0	112.2	L192 R198	L192-V194 PolarHBondContact O-N 2.68Å; V194-R198 WeakPolarHBondContact O-CB 3.25Å; V194-R198 VanDerWaalsContact O-CG 3.28Å; V194-R198 WeakPolarHBondContact O-CG 3.37Å; V194-R198 PolarHBondContact O-N 2.95Å; V194-R198 VanDerWaalsContact O-N 3.07Å
195	Q	95.2	Very high	95.1	Very high	171 Å²	171	81.7 Å²	81.7	80%	0.799	42%	0.421	S	S	*	.	H	α-helix	trans	-65.1	-47.2	177.5	-69	-178	-7.9	0	0	112.1	P193 R198 A199	P193-Q195 PolarHBondContact O-N 2.87Å; P193-Q195 VanDerWaalsContact O-N 3.11Å; Q195-R198 PolarHBondContact O-N 3.31Å; Q195-A199 WeakPolarHBondContact O-CB 3.13Å; Q195-A199 PolarHBondContact O-N 2.83Å
196	L	93.8	Very high	95.1	Very high	56 Å²	56	84.1 Å²	84.1	29%	0.293	44%	0.441	S	S	.	.	H	α-helix	trans	-65.7	-42.8	178.3	179.7	63.6	0	0	0	111.1	V107 L192 P193 R198 A199 M200	V107-L196 HydrophobicContact CB-CD2 4.47Å; V107-L196 HydrophobicContact CG1-CD2 3.32Å; V107-L196 HydrophobicContact CG2-CD2 4.32Å; L192-L196 HydrophobicContact CD2-CD2 4.48Å; P193-L196 HydrophobicContact CB-CB 4.48Å; P193-L196 PolarHBondContact O-N 2.82Å; L196-R198 VanDerWaalsContact C-N 3.3Å; L196-R198 PolarHBondContact O-N 2.56Å; L196-A199 PolarHBondContact O-N 3.35Å; L196-M200 HydrophobicContact CD1-CG 4.02Å; L196-M200 HydrophobicContact CD1-SD 4.24Å; L196-M200 HydrophobicContact CD2-SD 4.38Å; L196-M200 HydrophobicContact CG-CG 4.21Å; L196-M200 HydrophobicContact CG-SD 3.95Å; L196-M200 WeakPolarHBondContact O-CB 3.24Å; L196-M200 WeakPolarHBondContact O-CG 3.3Å; L196-M200 PolarHBondContact O-N 3.36Å
197	Q	94	Very high	95.1	Very high	112 Å²	112	82.7 Å²	82.7	52%	0.523	44%	0.441	S	S	.	.	H	α-helix	trans	-57.9	-43.6	177.3	-173	-178.4	12.1	0	0	111.7	P193 A201	P193-Q197 PolarHBondContact O-N 3.06Å; Q197-A201 WeakPolarHBondContact O-CB 3.23Å; Q197-A201 PolarHBondContact O-N 3.44Å
198	R	96	Very high	95.2	Very high	182 Å²	182	90.5 Å²	90.5	69%	0.687	47%	0.468	S	S	*	.	H	α-helix	trans	-65.5	-43.2	175.7	-73.1	175.4	-177.3	175.9	1.8	112.1	V194 Q195 L196 A201 A202	V194-R198 WeakPolarHBondContact O-CB 3.25Å; V194-R198 VanDerWaalsContact O-CG 3.28Å; V194-R198 WeakPolarHBondContact O-CG 3.37Å; V194-R198 PolarHBondContact O-N 2.95Å; V194-R198 VanDerWaalsContact O-N 3.07Å; Q195-R198 PolarHBondContact O-N 3.31Å; L196-R198 VanDerWaalsContact C-N 3.3Å; L196-R198 PolarHBondContact O-N 2.56Å; R198-A201 PolarHBondContact O-N 2.85Å; R198-A202 WeakPolarHBondContact O-CB 3.44Å; R198-A202 PolarHBondContact O-N 3.05Å
199	A	95.8	Very high	95.3	Very high	58 Å²	58	90.2 Å²	90.2	48%	0.479	47%	0.469	S	S	.	.	H	α-helix	trans	-62.6	-47.1	178.2	0	0	0	0	0	111.8	Q195 L196 A201 A202 E203	Q195-A199 WeakPolarHBondContact O-CB 3.13Å; Q195-A199 PolarHBondContact O-N 2.83Å; L196-A199 PolarHBondContact O-N 3.35Å; A199-A201 VanDerWaalsContact C-N 3.34Å; A199-A201 PolarHBondContact O-N 3.13Å; A199-A202 PolarHBondContact O-N 3.21Å; A199-E203 WeakPolarHBondContact O-CB 3.24Å; A199-E203 PolarHBondContact O-N 3.4Å
200	M	94.3	Very high	95.4	Very high	70 Å²	70	89.2 Å²	89.2	35%	0.345	47%	0.471	S	S	.	.	H	α-helix	trans	-62.5	-39.7	176.2	-71.6	179	70.8	0	0	112.2	L153 L192 L196 E203 A204	L153-M200 HydrophobicContact CD2-CE 3.88Å; L153-M200 HydrophobicContact CD2-SD 3.79Å; L192-M200 HydrophobicContact CD2-SD 4.09Å; L196-M200 HydrophobicContact CD1-CG 4.02Å; L196-M200 HydrophobicContact CD1-SD 4.24Å; L196-M200 HydrophobicContact CD2-SD 4.38Å; L196-M200 HydrophobicContact CG-CG 4.21Å; L196-M200 HydrophobicContact CG-SD 3.95Å; L196-M200 WeakPolarHBondContact O-CB 3.24Å; L196-M200 WeakPolarHBondContact O-CG 3.3Å; L196-M200 PolarHBondContact O-N 3.36Å; M200-E203 PolarHBondContact O-N 3.21Å; M200-A204 VanDerWaalsContact O-CB 3.24Å; M200-A204 WeakPolarHBondContact O-CB 3.28Å; M200-A204 PolarHBondContact O-N 3.26Å
201	A	94.5	Very high	95.5	Very high	57 Å²	57	97 Å²	97	47%	0.471	50%	0.499	S	S	.	.	H	α-helix	trans	-63.6	-45.7	176.4	0	0	0	0	0	111.5	Q197 R198 A199 A204 E205	Q197-A201 WeakPolarHBondContact O-CB 3.23Å; Q197-A201 PolarHBondContact O-N 3.44Å; R198-A201 PolarHBondContact O-N 2.85Å; A199-A201 VanDerWaalsContact C-N 3.34Å; A199-A201 PolarHBondContact O-N 3.13Å; A201-A204 PolarHBondContact O-N 3.47Å; A201-E205 WeakPolarHBondContact O-CB 3.12Å; A201-E205 PolarHBondContact O-N 3.49Å
202	A	96.5	Very high	95.7	Very high	58 Å²	58	91.9 Å²	91.9	48%	0.479	49%	0.492	S	S	.	.	H	α-helix	trans	-63.7	-41.8	177	0	0	0	0	0	112.2	R198 A199 E205 A206	R198-A202 WeakPolarHBondContact O-CB 3.44Å; R198-A202 PolarHBondContact O-N 3.05Å; A199-A202 PolarHBondContact O-N 3.21Å; A202-E205 PolarHBondContact O-N 2.92Å; A202-A206 WeakPolarHBondContact O-CB 3.11Å; A202-A206 PolarHBondContact O-N 2.8Å
203	E	96.3	Very high	95.8	Very high	142 Å²	142	96.5 Å²	96.5	66%	0.664	51%	0.51	S	S	*	.	H	α-helix	trans	-63.5	-44.8	175.4	-174.6	-177.4	175.3	0	0	111.5	A199 M200 E205 A206 A207	A199-E203 WeakPolarHBondContact O-CB 3.24Å; A199-E203 PolarHBondContact O-N 3.4Å; M200-E203 PolarHBondContact O-N 3.21Å; E203-E205 VanDerWaalsContact C-N 3.34Å; E203-E205 PolarHBondContact O-N 2.86Å; E203-A206 PolarHBondContact O-N 2.97Å; E203-A207 VanDerWaalsContact O-CB 3.29Å; E203-A207 WeakPolarHBondContact O-CB 3.41Å; E203-A207 PolarHBondContact O-N 2.62Å
204	A	94.7	Very high	96	Very high	47 Å²	47	98.7 Å²	98.7	39%	0.388	52%	0.523	S	S	.	.	H	α-helix	trans	-64.9	-38.2	178.4	0	0	0	0	0	112.3	M200 A201 R208	M200-A204 VanDerWaalsContact O-CB 3.24Å; M200-A204 WeakPolarHBondContact O-CB 3.28Å; M200-A204 PolarHBondContact O-N 3.26Å; A201-A204 PolarHBondContact O-N 3.47Å; A204-R208 WeakPolarHBondContact O-CB 3.4Å; A204-R208 WeakPolarHBondContact O-CG 3.49Å; A204-R208 PolarHBondContact O-N 2.58Å
205	E	96.2	Very high	96.2	Very high	139 Å²	139	100.9 Å²	100.9	65%	0.65	53%	0.53	S	S	*	.	H	α-helix	trans	-64.4	-50.2	174.9	-174.8	171.9	-169.5	0	0	111.1	A201 A202 E203 A207 R208 E209	A201-E205 WeakPolarHBondContact O-CB 3.12Å; A201-E205 PolarHBondContact O-N 3.49Å; A202-E205 PolarHBondContact O-N 2.92Å; E203-E205 VanDerWaalsContact C-N 3.34Å; E203-E205 PolarHBondContact O-N 2.86Å; E205-A207 VanDerWaalsContact C-N 3.35Å; E205-A207 PolarHBondContact O-N 2.77Å; E205-R208 PolarHBondContact O-N 2.79Å; E205-E209 PolarHBondContact O-N 3.38Å
206	A	97.2	Very high	96.3	Very high	55 Å²	55	95.5 Å²	95.5	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-60.4	-42.4	177.3	0	0	0	0	0	112.2	A202 E203 R208 E209 A210	A202-A206 WeakPolarHBondContact O-CB 3.11Å; A202-A206 PolarHBondContact O-N 2.8Å; E203-A206 PolarHBondContact O-N 2.97Å; A206-R208 PolarHBondContact O-N 2.94Å; A206-E209 PolarHBondContact O-N 3.48Å; A206-A210 WeakPolarHBondContact O-CB 3.46Å; A206-A210 PolarHBondContact O-N 3.07Å
207	A	96.9	Very high	96.5	Very high	37 Å²	37	95.9 Å²	95.9	31%	0.306	53%	0.526	S	S	.	.	H	α-helix	trans	-65.6	-37.7	177.1	0	0	0	0	0	112.3	E203 E205 R211	E203-A207 VanDerWaalsContact O-CB 3.29Å; E203-A207 WeakPolarHBondContact O-CB 3.41Å; E203-A207 PolarHBondContact O-N 2.62Å; E205-A207 VanDerWaalsContact C-N 3.35Å; E205-A207 PolarHBondContact O-N 2.77Å; A207-R211 WeakPolarHBondContact O-CB 3.44Å; A207-R211 WeakPolarHBondContact O-CG 3.16Å; A207-R211 PolarHBondContact O-N 2.92Å
208	R	96.7	Very high	96.6	Very high	187 Å²	187	94.2 Å²	94.2	71%	0.706	52%	0.519	S	S	*	.	H	α-helix	trans	-67.8	-43.3	174.8	-77.5	173.8	177.5	-168.7	0.3	111.5	A204 E205 A206 R211 A212	A204-R208 WeakPolarHBondContact O-CB 3.4Å; A204-R208 WeakPolarHBondContact O-CG 3.49Å; A204-R208 PolarHBondContact O-N 2.58Å; E205-R208 PolarHBondContact O-N 2.79Å; A206-R208 PolarHBondContact O-N 2.94Å; R208-R211 PolarHBondContact O-N 2.97Å; R208-A212 WeakPolarHBondContact O-CB 3.46Å; R208-A212 PolarHBondContact O-N 2.69Å
209	E	97.2	Very high	96.7	Very high	104 Å²	104	87.3 Å²	87.3	49%	0.486	50%	0.504	S	S	.	.	H	α-helix	trans	-63.7	-45.1	177.4	-167.1	-167.6	159.8	0	0	111.4	E205 A206 R211 A212 K213	E205-E209 PolarHBondContact O-N 3.38Å; A206-E209 PolarHBondContact O-N 3.48Å; E209-R211 PolarHBondContact O-N 3.07Å; E209-A212 PolarHBondContact O-N 2.99Å; E209-K213 WeakPolarHBondContact O-CG 3.44Å; E209-K213 PolarHBondContact O-N 3.07Å; E209-K213 WeakPolarHBondContact OE1-CE 3.36Å; E209-K213 IonicContact OE1-NZ 2.65Å; E209-K213 PolarHBondContact OE1-NZ 3.23Å
210	A	97.4	Very high	96.7	Very high	55 Å²	55	91 Å²	91	46%	0.455	51%	0.511	S	S	.	.	H	α-helix	trans	-59.4	-47	175.5	0	0	0	0	0	111.3	A206 A212 K213 V214	A206-A210 WeakPolarHBondContact O-CB 3.46Å; A206-A210 PolarHBondContact O-N 3.07Å; A210-A212 VanDerWaalsContact C-N 3.34Å; A210-A212 PolarHBondContact O-N 3.16Å; A210-K213 PolarHBondContact O-N 2.92Å; A210-V214 WeakPolarHBondContact O-CG2 3.25Å; A210-V214 PolarHBondContact O-N 3.4Å
211	R	96.9	Very high	96.9	Very high	175 Å²	175	93.8 Å²	93.8	66%	0.66	52%	0.518	S	S	*	.	H	α-helix	trans	-60.8	-41.8	175.9	-75.2	173.5	-173.6	165.8	4.5	112.1	A207 R208 E209 K213 V214 I215	A207-R211 WeakPolarHBondContact O-CB 3.44Å; A207-R211 WeakPolarHBondContact O-CG 3.16Å; A207-R211 PolarHBondContact O-N 2.92Å; R208-R211 PolarHBondContact O-N 2.97Å; E209-R211 PolarHBondContact O-N 3.07Å; R211-K213 PolarHBondContact O-N 2.97Å; R211-V214 PolarHBondContact O-N 3.41Å; R211-I215 VanDerWaalsContact O-CG1 3.3Å; R211-I215 WeakPolarHBondContact O-CG1 3.36Å; R211-I215 PolarHBondContact O-N 3.26Å
212	A	97.8	Very high	97	Very high	56 Å²	56	97 Å²	97	46%	0.463	52%	0.521	S	S	.	.	H	α-helix	trans	-61.3	-42.6	176.5	0	0	0	0	0	111.8	R208 E209 A210 I215 A216	R208-A212 WeakPolarHBondContact O-CB 3.46Å; R208-A212 PolarHBondContact O-N 2.69Å; E209-A212 PolarHBondContact O-N 2.99Å; A210-A212 VanDerWaalsContact C-N 3.34Å; A210-A212 PolarHBondContact O-N 3.16Å; A212-I215 PolarHBondContact O-N 3.4Å; A212-A216 WeakPolarHBondContact O-CB 3.35Å; A212-A216 PolarHBondContact O-N 3.37Å
213	K	97.4	Very high	97	Very high	129 Å²	129	96.6 Å²	96.6	56%	0.561	52%	0.518	S	S	*	.	H	α-helix	trans	-62.6	-41.2	175.1	-72.7	175.5	-175.4	165.1	0	112.6	E209 A210 R211 A216 A217	E209-K213 WeakPolarHBondContact O-CG 3.44Å; E209-K213 PolarHBondContact O-N 3.07Å; E209-K213 WeakPolarHBondContact OE1-CE 3.36Å; E209-K213 IonicContact OE1-NZ 2.65Å; E209-K213 PolarHBondContact OE1-NZ 3.23Å; A210-K213 PolarHBondContact O-N 2.92Å; R211-K213 PolarHBondContact O-N 2.97Å; K213-A216 PolarHBondContact O-N 3.25Å; K213-A217 WeakPolarHBondContact O-CB 3.42Å; K213-A217 PolarHBondContact O-N 3.32Å
214	V	98	Very high	97	Very high	101 Å²	101	93 Å²	93	61%	0.612	51%	0.508	S	S	*	.	H	α-helix	trans	-64.1	-44.8	175.3	177	0	0	0	0	111.1	A210 R211 A216 A217 E218	A210-V214 WeakPolarHBondContact O-CG2 3.25Å; A210-V214 PolarHBondContact O-N 3.4Å; R211-V214 PolarHBondContact O-N 3.41Å; V214-A216 VanDerWaalsContact C-N 3.34Å; V214-A216 PolarHBondContact O-N 3.36Å; V214-A217 PolarHBondContact O-N 3.17Å; V214-E218 WeakPolarHBondContact O-CB 3.24Å; V214-E218 PolarHBondContact O-N 3.04Å
215	I	97.2	Very high	97.1	Very high	127 Å²	127	96.8 Å²	96.8	65%	0.651	51%	0.513	S	S	*	.	H	α-helix	trans	-62.6	-41.5	178.1	-68.3	166.8	0	0	0	111	R211 A212 G219	R211-I215 VanDerWaalsContact O-CG1 3.3Å; R211-I215 WeakPolarHBondContact O-CG1 3.36Å; R211-I215 PolarHBondContact O-N 3.26Å; A212-I215 PolarHBondContact O-N 3.4Å; I215-G219 PolarHBondContact O-N 2.95Å
216	A	97.1	Very high	97.1	Very high	59 Å²	59	92.8 Å²	92.8	49%	0.488	50%	0.504	S	S	.	.	H	α-helix	trans	-63.4	-47.8	175.7	0	0	0	0	0	111.6	A212 K213 V214 E218 G219 E220	A212-A216 WeakPolarHBondContact O-CB 3.35Å; A212-A216 PolarHBondContact O-N 3.37Å; K213-A216 PolarHBondContact O-N 3.25Å; V214-A216 VanDerWaalsContact C-N 3.34Å; V214-A216 PolarHBondContact O-N 3.36Å; A216-E218 VanDerWaalsContact C-N 3.35Å; A216-E218 PolarHBondContact O-N 2.88Å; A216-G219 PolarHBondContact O-N 3.45Å; A216-E220 WeakPolarHBondContact O-CG 3.33Å; A216-E220 PolarHBondContact O-N 3.03Å
217	A	97.6	Very high	97	Very high	63 Å²	63	95.7 Å²	95.7	52%	0.521	51%	0.511	S	S	.	.	H	α-helix	trans	-62.1	-40	178.1	0	0	0	0	0	112.7	K213 V214 E220 W221	K213-A217 WeakPolarHBondContact O-CB 3.42Å; K213-A217 PolarHBondContact O-N 3.32Å; V214-A217 PolarHBondContact O-N 3.17Å; A217-E220 PolarHBondContact O-N 2.85Å; A217-W221 WeakPolarHBondContact O-CB 3.5Å; A217-W221 PolarHBondContact O-N 2.85Å
218	E	97.3	Very high	96.9	Very high	78 Å²	78	100.3 Å²	100.3	36%	0.364	52%	0.524	S	S	.	.	H	α-helix	trans	-67.6	-38.4	175	-177.9	61.1	-158.1	0	0	111.8	V214 A216 W221 K222	V214-E218 WeakPolarHBondContact O-CB 3.24Å; V214-E218 PolarHBondContact O-N 3.04Å; A216-E218 VanDerWaalsContact C-N 3.35Å; A216-E218 PolarHBondContact O-N 2.88Å; E218-W221 PolarHBondContact O-N 3.22Å; E218-K222 HydrophobicContact CG-CD 4.49Å; E218-K222 WeakPolarHBondContact O-CB 3.32Å; E218-K222 WeakPolarHBondContact O-CG 3.08Å; E218-K222 PolarHBondContact O-N 3.3Å; E218-K222 WeakPolarHBondContact OE1-CE 3.47Å; E218-K222 IonicContact OE1-NZ 2.67Å
219	G	97.7	Very high	96.9	Very high	37 Å²	37	96.7 Å²	96.7	38%	0.381	52%	0.515	S	S	.	.	H	α-helix	trans	-60.5	-49.3	172.9	0	0	0	0	0	112	I215 A216 W221 K222 A223	I215-G219 PolarHBondContact O-N 2.95Å; A216-G219 PolarHBondContact O-N 3.45Å; G219-W221 VanDerWaalsContact C-N 3.32Å; G219-W221 PolarHBondContact O-N 3.19Å; G219-K222 PolarHBondContact O-N 3.15Å; G219-A223 WeakPolarHBondContact O-CB 3.3Å; G219-A223 PolarHBondContact O-N 2.83Å
220	E	96.2	Very high	96.7	Very high	134 Å²	134	93.4 Å²	93.4	63%	0.626	51%	0.506	S	S	*	.	H	α-helix	trans	-59.9	-41.1	174.9	-72.4	-61.5	145.4	0	0	111.9	A216 A217 A223 S224	A216-E220 WeakPolarHBondContact O-CG 3.33Å; A216-E220 PolarHBondContact O-N 3.03Å; A217-E220 PolarHBondContact O-N 2.85Å; E220-A223 PolarHBondContact O-N 2.9Å; E220-S224 VanDerWaalsContact O-CB 3.23Å; E220-S224 WeakPolarHBondContact O-CB 3.27Å; E220-S224 PolarHBondContact O-N 2.9Å; E220-S224 PolarHBondContact O-OG 2.85Å
221	W	97.5	Very high	96.5	Very high	129 Å²	129	92.8 Å²	92.8	49%	0.489	50%	0.501	S	S	.	.	H	α-helix	trans	-65.4	-45.4	177.4	-179.5	85.8	0	0	0	112.3	A217 E218 G219 S224 R225	A217-W221 WeakPolarHBondContact O-CB 3.5Å; A217-W221 PolarHBondContact O-N 2.85Å; E218-W221 PolarHBondContact O-N 3.22Å; G219-W221 VanDerWaalsContact C-N 3.32Å; G219-W221 PolarHBondContact O-N 3.19Å; W221-S224 PolarHBondContact O-N 3.45Å; W221-R225 PolarHBondContact O-N 3.11Å
222	K	97.4	Very high	96.3	Very high	125 Å²	125	88.5 Å²	88.5	54%	0.543	49%	0.491	S	S	.	.	H	α-helix	trans	-61.9	-45.4	175.2	-76.8	176	179	156.6	0	111.7	E218 G219 S224 R225 A226	E218-K222 HydrophobicContact CG-CD 4.49Å; E218-K222 WeakPolarHBondContact O-CB 3.32Å; E218-K222 WeakPolarHBondContact O-CG 3.08Å; E218-K222 PolarHBondContact O-N 3.3Å; E218-K222 WeakPolarHBondContact OE1-CE 3.47Å; E218-K222 IonicContact OE1-NZ 2.67Å; G219-K222 PolarHBondContact O-N 3.15Å; K222-S224 VanDerWaalsContact C-N 3.34Å; K222-S224 PolarHBondContact O-N 3.08Å; K222-R225 PolarHBondContact O-N 2.84Å; K222-A226 PolarHBondContact O-N 2.92Å
223	A	96.4	Very high	96.1	Very high	49 Å²	49	90.3 Å²	90.3	41%	0.405	50%	0.496	S	S	.	.	H	α-helix	trans	-60.7	-44.5	175.8	0	0	0	0	0	111.3	G219 E220 R225 A226 L227	G219-A223 WeakPolarHBondContact O-CB 3.3Å; G219-A223 PolarHBondContact O-N 2.83Å; E220-A223 PolarHBondContact O-N 2.9Å; A223-R225 VanDerWaalsContact C-N 3.34Å; A223-R225 PolarHBondContact O-N 3.48Å; A223-A226 PolarHBondContact O-N 2.87Å; A223-L227 WeakPolarHBondContact O-CB 3.33Å; A223-L227 WeakPolarHBondContact O-CG 3.44Å; A223-L227 PolarHBondContact O-N 2.91Å
224	S	96.3	Very high	95.8	Very high	67 Å²	67	85.5 Å²	85.5	47%	0.469	48%	0.476	S	S	.	.	H	α-helix	trans	-62.1	-39.6	177.4	-62.9	0	0	0	0	112.5	E220 W221 K222 L227 K228	E220-S224 VanDerWaalsContact O-CB 3.23Å; E220-S224 WeakPolarHBondContact O-CB 3.27Å; E220-S224 PolarHBondContact O-N 2.9Å; E220-S224 PolarHBondContact O-OG 2.85Å; W221-S224 PolarHBondContact O-N 3.45Å; K222-S224 VanDerWaalsContact C-N 3.34Å; K222-S224 PolarHBondContact O-N 3.08Å; S224-L227 PolarHBondContact O-N 3.42Å; S224-K228 WeakPolarHBondContact O-CB 3.5Å; S224-K228 PolarHBondContact O-N 3.11Å
225	R	97.6	Very high	95.4	Very high	126 Å²	126	85.7 Å²	85.7	48%	0.475	48%	0.477	S	S	.	.	H	α-helix	trans	-64.6	-47	175.8	-179.3	-177.2	-72.4	-102.8	-0.6	111.7	W221 K222 A223 L227 K228 E229	W221-R225 PolarHBondContact O-N 3.11Å; K222-R225 PolarHBondContact O-N 2.84Å; A223-R225 VanDerWaalsContact C-N 3.34Å; A223-R225 PolarHBondContact O-N 3.48Å; R225-L227 VanDerWaalsContact C-N 3.3Å; R225-L227 PolarHBondContact O-N 3.47Å; R225-K228 WeakPolarHBondContact O-CB 3.42Å; R225-K228 PolarHBondContact O-N 3.41Å; R225-E229 PolarHBondContact O-N 2.94Å
226	A	96.1	Very high	95.2	Very high	56 Å²	56	87.4 Å²	87.4	46%	0.463	48%	0.483	S	S	.	.	H	α-helix	trans	-61.7	-39.2	177.1	0	0	0	0	0	111.9	K222 A223 E229 A230	K222-A226 PolarHBondContact O-N 2.92Å; A223-A226 PolarHBondContact O-N 2.87Å; A226-E229 PolarHBondContact O-N 3.42Å; A226-A230 WeakPolarHBondContact O-CB 3.35Å; A226-A230 PolarHBondContact O-N 2.97Å
227	L	93.6	Very high	94.9	Very high	115 Å²	115	87.2 Å²	87.2	60%	0.602	48%	0.478	S	S	*	.	H	α-helix	trans	-65.9	-38.3	174.7	-72.5	169.6	0	0	0	112.4	A223 S224 R225 A230 A231	A223-L227 WeakPolarHBondContact O-CB 3.33Å; A223-L227 WeakPolarHBondContact O-CG 3.44Å; A223-L227 PolarHBondContact O-N 2.91Å; S224-L227 PolarHBondContact O-N 3.42Å; R225-L227 VanDerWaalsContact C-N 3.3Å; R225-L227 PolarHBondContact O-N 3.47Å; L227-A230 PolarHBondContact O-N 3.16Å; L227-A231 VanDerWaalsContact O-CB 3.32Å; L227-A231 WeakPolarHBondContact O-CB 3.32Å; L227-A231 PolarHBondContact O-N 3.07Å
228	K	95.9	Very high	94.3	Very high	134 Å²	134	88.8 Å²	88.8	58%	0.583	48%	0.483	S	S	*	.	H	α-helix	trans	-61.5	-51.2	173.9	-177.7	-165.5	167.4	-173.1	0	110.9	S224 R225 A230 A231 D232	S224-K228 WeakPolarHBondContact O-CB 3.5Å; S224-K228 PolarHBondContact O-N 3.11Å; R225-K228 WeakPolarHBondContact O-CB 3.42Å; R225-K228 PolarHBondContact O-N 3.41Å; K228-A230 VanDerWaalsContact C-N 3.29Å; K228-A230 PolarHBondContact O-N 3.13Å; K228-A231 CarbonylContact O-C 3.58Å; K228-A231 WeakPolarHBondContact O-CA 3.4Å; K228-A231 WeakPolarHBondContact O-CB 3.37Å; K228-A231 PolarHBondContact O-N 3.15Å; K228-D232 PolarHBondContact O-N 3.34Å
229	E	95.7	Very high	94.1	Very high	112 Å²	112	92.1 Å²	92.1	52%	0.523	50%	0.497	S	S	.	.	H	α-helix	trans	-58.9	-42.4	178.6	-70.8	170.2	-168.7	0	0	111.2	R225 A226 A231 D232 V233	R225-E229 PolarHBondContact O-N 2.94Å; A226-E229 PolarHBondContact O-N 3.42Å; E229-A231 VanDerWaalsContact C-N 3.33Å; E229-A231 PolarHBondContact O-N 2.78Å; E229-D232 PolarHBondContact O-N 3.17Å; E229-V233 WeakPolarHBondContact O-CG2 3.43Å; E229-V233 PolarHBondContact O-N 3.23Å; E229-V233 VanDerWaalsContact O-N 3.1Å
230	A	93.2	Very high	93.8	Very high	35 Å²	35	91.8 Å²	91.8	29%	0.289	49%	0.49	S	S	.	.	H	α-helix	trans	-63.4	-36.6	173.5	0	0	0	0	0	112.9	A226 L227 K228 I234	A226-A230 WeakPolarHBondContact O-CB 3.35Å; A226-A230 PolarHBondContact O-N 2.97Å; L227-A230 PolarHBondContact O-N 3.16Å; K228-A230 VanDerWaalsContact C-N 3.29Å; K228-A230 PolarHBondContact O-N 3.13Å; A230-I234 WeakPolarHBondContact O-CB 3.2Å; A230-I234 WeakPolarHBondContact O-CD1 3.39Å; A230-I234 WeakPolarHBondContact O-CG1 3.23Å; A230-I234 PolarHBondContact O-N 3.06Å
231	A	92.9	Very high	93.6	Very high	42 Å²	42	89 Å²	89	35%	0.347	48%	0.482	S	S	.	.	H	α-helix	trans	-69.3	-39.6	177	0	0	0	0	0	112.1	L227 K228 E229 I234 T235	L227-A231 VanDerWaalsContact O-CB 3.32Å; L227-A231 WeakPolarHBondContact O-CB 3.32Å; L227-A231 PolarHBondContact O-N 3.07Å; K228-A231 CarbonylContact O-C 3.58Å; K228-A231 WeakPolarHBondContact O-CA 3.4Å; K228-A231 WeakPolarHBondContact O-CB 3.37Å; K228-A231 PolarHBondContact O-N 3.15Å; E229-A231 VanDerWaalsContact C-N 3.33Å; E229-A231 PolarHBondContact O-N 2.78Å; A231-I234 PolarHBondContact O-N 2.82Å; A231-T235 WeakPolarHBondContact O-CB 3.48Å; A231-T235 PolarHBondContact O-N 3.42Å; A231-T235 PolarHBondContact O-OG1 3.13Å
232	D	94.1	Very high	93.2	Very high	85 Å²	85	88.4 Å²	88.4	46%	0.455	49%	0.485	S	S	.	.	H	α-helix	trans	-60.2	-48.7	175.7	-68.1	-21.6	0	0	0	109.5	K228 E229 I234 T235 E236	K228-D232 PolarHBondContact O-N 3.34Å; E229-D232 PolarHBondContact O-N 3.17Å; D232-I234 PolarHBondContact O-N 2.86Å; D232-T235 PolarHBondContact O-N 3.1Å; D232-T235 VanDerWaalsContact O-N 3.16Å; D232-E236 PolarHBondContact O-N 3.07Å
233	V	92.7	Very high	93	Very high	93 Å²	93	87.7 Å²	87.7	56%	0.564	49%	0.486	S	S	*	.	H	α-helix	trans	-61.4	-39.2	175.5	174.4	0	0	0	0	112.6	E229 T235 E236	E229-V233 WeakPolarHBondContact O-CG2 3.43Å; E229-V233 PolarHBondContact O-N 3.23Å; E229-V233 VanDerWaalsContact O-N 3.1Å; V233-T235 VanDerWaalsContact C-N 3.31Å; V233-T235 PolarHBondContact O-N 3.41Å; V233-E236 WeakPolarHBondContact O-CB 3.45Å; V233-E236 PolarHBondContact O-N 2.66Å
234	I	91.7	Very high	92.7	Very high	29 Å²	29	90.9 Å²	90.9	15%	0.149	49%	0.488	C	S	.	.	H	α-helix	trans	-68.8	-33.3	178	-74.6	165.9	0	0	0	111.4	A230 A231 D232 E236 S237 A240 V241	A230-I234 WeakPolarHBondContact O-CB 3.2Å; A230-I234 WeakPolarHBondContact O-CD1 3.39Å; A230-I234 WeakPolarHBondContact O-CG1 3.23Å; A230-I234 PolarHBondContact O-N 3.06Å; A231-I234 PolarHBondContact O-N 2.82Å; D232-I234 PolarHBondContact O-N 2.86Å; I234-E236 VanDerWaalsContact C-N 3.27Å; I234-E236 PolarHBondContact O-N 2.87Å; I234-S237 CarbonylContact O-C 3.52Å; I234-S237 PolarHBondContact O-N 3.46Å; I234-A240 HydrophobicContact CG2-CB 4.22Å; I234-V241 HydrophobicContact CG2-CB 4.31Å; I234-V241 HydrophobicContact CG2-CG2 3.45Å; I234-V241 VanDerWaalsContact CG2-CG2 3.45Å
235	T	90.3	Very high	92.3	Very high	104 Å²	104	91.9 Å²	91.9	64%	0.638	48%	0.482	S	S	*	.	H	α-helix	trans	-69.7	-26.2	-179.8	-56.7	0	0	0	0	111.9	A231 D232 V233 S237	A231-T235 WeakPolarHBondContact O-CB 3.48Å; A231-T235 PolarHBondContact O-N 3.42Å; A231-T235 PolarHBondContact O-OG1 3.13Å; D232-T235 PolarHBondContact O-N 3.1Å; D232-T235 VanDerWaalsContact O-N 3.16Å; V233-T235 VanDerWaalsContact C-N 3.31Å; V233-T235 PolarHBondContact O-N 3.41Å; T235-S237 PolarHBondContact O-N 3.23Å
236	E	92.4	Very high	91.9	Very high	163 Å²	163	90.7 Å²	90.7	76%	0.762	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-22.9	173.2	-64.8	178.6	178.1	0	0	112.9	D232 V233 I234	D232-E236 PolarHBondContact O-N 3.07Å; V233-E236 WeakPolarHBondContact O-CB 3.45Å; V233-E236 PolarHBondContact O-N 2.66Å; I234-E236 VanDerWaalsContact C-N 3.27Å; I234-E236 PolarHBondContact O-N 2.87Å
237	S	90.5	Very high	91.6	Very high	56 Å²	56	93.9 Å²	93.9	39%	0.392	49%	0.49	S	S	.	.			trans	-127.3	106.4	177.2	-179.9	0	0	0	0	111.8	I234 T235 F239 A240	I234-S237 CarbonylContact O-C 3.52Å; I234-S237 PolarHBondContact O-N 3.46Å; T235-S237 PolarHBondContact O-N 3.23Å; S237-F239 PolarHBondContact O-N 3.44Å; S237-F239 VanDerWaalsContact O-N 3.11Å; S237-A240 VanDerWaalsContact O-CB 3.31Å; S237-A240 WeakPolarHBondContact O-CB 3.47Å; S237-A240 PolarHBondContact O-N 3.24Å
238	P	85	Confident	91.4	Very high	96 Å²	96	91.9 Å²	91.9	62%	0.623	48%	0.482	S	S	*	.	H	α-helix	trans	-61.2	-27	-176.9	22.2	-32.2	0	0	0	113.6
239	F	92.2	Very high	90.7	Very high	148 Å²	148	86.9 Å²	86.9	65%	0.649	46%	0.462	S	S	*	.	H	α-helix	trans	-72.1	-27.1	174.4	-70.4	-73.4	0	0	0	112.9	S237 V241 Q242 L243	S237-F239 PolarHBondContact O-N 3.44Å; S237-F239 VanDerWaalsContact O-N 3.11Å; F239-V241 VanDerWaalsContact C-N 3.35Å; F239-V241 PolarHBondContact O-N 3.06Å; F239-Q242 PolarHBondContact O-N 3.19Å; F239-L243 WeakPolarHBondContact O-CG 3.45Å; F239-L243 PolarHBondContact O-N 3.17Å
240	A	92.6	Very high	90.1	Very high	30 Å²	30	85.4 Å²	85.4	25%	0.248	46%	0.464	C	S	.	.	H	α-helix	trans	-65.4	-37.3	178.5	0	0	0	0	0	112.2	I234 S237 Q242 L243 R244	I234-A240 HydrophobicContact CG2-CB 4.22Å; S237-A240 VanDerWaalsContact O-CB 3.31Å; S237-A240 WeakPolarHBondContact O-CB 3.47Å; S237-A240 PolarHBondContact O-N 3.24Å; A240-Q242 VanDerWaalsContact C-N 3.35Å; A240-Q242 PolarHBondContact O-N 3.07Å; A240-L243 PolarHBondContact O-N 3.42Å; A240-R244 PolarHBondContact O-N 2.67Å
241	V	91.6	Very high	89.7	Confident	75 Å²	75	87.8 Å²	87.8	46%	0.455	48%	0.475	S	S	.	.	H	α-helix	trans	-59.8	-45.1	174.1	178.2	0	0	0	0	110.9	I234 F239 R244 Y245	I234-V241 HydrophobicContact CG2-CB 4.31Å; I234-V241 HydrophobicContact CG2-CG2 3.45Å; I234-V241 VanDerWaalsContact CG2-CG2 3.45Å; F239-V241 VanDerWaalsContact C-N 3.35Å; F239-V241 PolarHBondContact O-N 3.06Å; V241-R244 PolarHBondContact O-N 3.25Å; V241-Y245 WeakPolarHBondContact O-CB 3.24Å; V241-Y245 PolarHBondContact O-N 3.31Å
242	Q	89.1	Confident	89.2	Confident	116 Å²	116	89 Å²	89	54%	0.542	48%	0.475	S	S	.	.	H	α-helix	trans	-65.3	-41.4	179	-67.2	178.4	-6.7	0	0	112	F239 A240 Y245 L246	F239-Q242 PolarHBondContact O-N 3.19Å; A240-Q242 VanDerWaalsContact C-N 3.35Å; A240-Q242 PolarHBondContact O-N 3.07Å; Q242-Y245 WeakPolarHBondContact O-CB 3.29Å; Q242-Y245 PolarHBondContact O-N 3.35Å; Q242-L246 WeakPolarHBondContact O-CG 3.45Å; Q242-L246 PolarHBondContact O-N 3.18Å
243	L	92.4	Very high	88.4	Confident	110 Å²	110	88 Å²	88	58%	0.576	47%	0.474	S	S	*	.	H	α-helix	trans	-62.3	-43.3	174.5	-69.6	176.7	0	0	0	111.5	F239 A240 Y245 L246 Q247	F239-L243 WeakPolarHBondContact O-CG 3.45Å; F239-L243 PolarHBondContact O-N 3.17Å; A240-L243 PolarHBondContact O-N 3.42Å; L243-Y245 VanDerWaalsContact C-N 3.35Å; L243-L246 PolarHBondContact O-N 3.43Å; L243-Q247 WeakPolarHBondContact O-CB 3.46Å; L243-Q247 VanDerWaalsContact O-CG 3.3Å; L243-Q247 WeakPolarHBondContact O-CG 3.49Å; L243-Q247 PolarHBondContact O-N 3.12Å
244	R	90.7	Very high	87.8	Confident	117 Å²	117	87.2 Å²	87.2	44%	0.442	48%	0.478	S	S	.	.	H	α-helix	trans	-64.2	-39	175.4	-177.1	167.8	-96.2	-167.3	-6.4	111.7	A240 V241 Q247 T248	A240-R244 PolarHBondContact O-N 2.67Å; V241-R244 PolarHBondContact O-N 3.25Å; R244-Q247 PolarHBondContact O-N 3.27Å; R244-T248 PolarHBondContact O-N 3.12Å; R244-T248 PolarHBondContact O-OG1 3.24Å; R244-T248 VanDerWaalsContact O-OG1 3.1Å
245	Y	88	Confident	87.3	Confident	88 Å²	88	92.5 Å²	92.5	35%	0.345	50%	0.502	S	S	.	.	H	α-helix	trans	-60.5	-48.2	173.4	176.9	-103.7	0	0	0	111.9	V241 Q242 L243 Q247 T248 L249 F262 P263	V241-Y245 WeakPolarHBondContact O-CB 3.24Å; V241-Y245 PolarHBondContact O-N 3.31Å; Q242-Y245 WeakPolarHBondContact O-CB 3.29Å; Q242-Y245 PolarHBondContact O-N 3.35Å; L243-Y245 VanDerWaalsContact C-N 3.35Å; Y245-Q247 VanDerWaalsContact C-N 3.33Å; Y245-Q247 PolarHBondContact O-N 2.68Å; Y245-T248 PolarHBondContact O-N 2.81Å; Y245-L249 HydrophobicContact CD1-CD1 3.86Å; Y245-L249 HydrophobicContact CD1-CG 4.46Å; Y245-L249 HydrophobicContact CE1-CD1 3.33Å; Y245-L249 HydrophobicContact CE1-CG 4.14Å; Y245-L249 HydrophobicContact CE2-CD1 4.4Å; Y245-L249 HydrophobicContact CE2-CG 4.42Å; Y245-L249 WeakPolarHBondContact O-CG 3.41Å; Y245-L249 PolarHBondContact O-N 3.42Å; Y245-F262 HydrophobicContact CE1-CE2 4.24Å; Y245-F262 HydrophobicContact CE1-CZ 4.02Å; Y245-P263 WeakPolarHBondContact OH-CD 3.44Å
246	L	89.6	Confident	86.4	Confident	100 Å²	100	96.6 Å²	96.6	52%	0.524	51%	0.511	S	S	.	.	H	α-helix	trans	-63.8	-36	175.7	-70.3	176.9	0	0	0	112.6	Q242 L243 L249 S250	Q242-L246 WeakPolarHBondContact O-CG 3.45Å; Q242-L246 PolarHBondContact O-N 3.18Å; L243-L246 PolarHBondContact O-N 3.43Å; L246-L249 HydrophobicContact CD2-CD1 4.36Å; L246-L249 PolarHBondContact O-N 3.35Å; L246-S250 WeakPolarHBondContact O-CB 3.41Å; L246-S250 PolarHBondContact O-N 3.06Å
247	Q	88.8	Confident	84.8	Confident	124 Å²	124	93 Å²	93	58%	0.579	50%	0.496	S	S	*	.	H	α-helix	trans	-63.8	-48.2	173.5	-76.8	174.9	-19.6	0	0	111.5	L243 R244 Y245 L249 S250 T251	L243-Q247 WeakPolarHBondContact O-CB 3.46Å; L243-Q247 VanDerWaalsContact O-CG 3.3Å; L243-Q247 WeakPolarHBondContact O-CG 3.49Å; L243-Q247 PolarHBondContact O-N 3.12Å; R244-Q247 PolarHBondContact O-N 3.27Å; Y245-Q247 VanDerWaalsContact C-N 3.33Å; Y245-Q247 PolarHBondContact O-N 2.68Å; Q247-L249 VanDerWaalsContact C-N 3.31Å; Q247-L249 PolarHBondContact O-N 2.96Å; Q247-S250 WeakPolarHBondContact O-CB 3.47Å; Q247-S250 PolarHBondContact O-N 3.22Å; Q247-S250 VanDerWaalsContact O-N 3.15Å; Q247-T251 PolarHBondContact O-N 2.85Å; Q247-T251 PolarHBondContact O-OG1 3.1Å; Q247-T251 VanDerWaalsContact O-OG1 3.12Å
248	T	89.3	Confident	83.3	Confident	73 Å²	73	96.1 Å²	96.1	45%	0.448	52%	0.518	S	S	.	.	H	α-helix	trans	-60.5	-41.5	175.7	-59.1	0	0	0	0	111.3	R244 Y245 S250 T251 I252	R244-T248 PolarHBondContact O-N 3.12Å; R244-T248 PolarHBondContact O-OG1 3.24Å; R244-T248 VanDerWaalsContact O-OG1 3.1Å; Y245-T248 PolarHBondContact O-N 2.81Å; T248-S250 VanDerWaalsContact C-N 3.34Å; T248-S250 PolarHBondContact O-N 3.25Å; T248-T251 PolarHBondContact O-N 2.98Å; T248-I252 HydrophobicContact CG2-CD1 3.86Å; T248-I252 HydrophobicContact CG2-CG1 4.44Å; T248-I252 VanDerWaalsContact O-CG1 3.25Å; T248-I252 WeakPolarHBondContact O-CG1 3.31Å; T248-I252 PolarHBondContact O-N 3.47Å
249	L	81.4	Confident	82.6	Confident	29 Å²	29	96.4 Å²	96.4	15%	0.152	52%	0.518	C	S	.	.	H	α-helix	trans	-61.4	-41.5	173.8	-75.1	-179.8	0	0	0	112.5	Y245 L246 Q247 I252 S253 F262	Y245-L249 HydrophobicContact CD1-CD1 3.86Å; Y245-L249 HydrophobicContact CD1-CG 4.46Å; Y245-L249 HydrophobicContact CE1-CD1 3.33Å; Y245-L249 HydrophobicContact CE1-CG 4.14Å; Y245-L249 HydrophobicContact CE2-CD1 4.4Å; Y245-L249 HydrophobicContact CE2-CG 4.42Å; Y245-L249 WeakPolarHBondContact O-CG 3.41Å; Y245-L249 PolarHBondContact O-N 3.42Å; L246-L249 HydrophobicContact CD2-CD1 4.36Å; L246-L249 PolarHBondContact O-N 3.35Å; Q247-L249 VanDerWaalsContact C-N 3.31Å; Q247-L249 PolarHBondContact O-N 2.96Å; L249-I252 PolarHBondContact O-N 2.88Å; L249-S253 WeakPolarHBondContact O-CB 3.18Å; L249-S253 PolarHBondContact O-N 3.41Å; L249-F262 HydrophobicContact CD1-CD2 4.22Å; L249-F262 HydrophobicContact CD1-CE2 3.63Å; L249-F262 HydrophobicContact CD1-CZ 4.47Å
250	S	84	Confident	81.2	Confident	80 Å²	80	93.9 Å²	93.9	56%	0.559	51%	0.511	S	S	*	.	H	α-helix	trans	-62.5	-44	175.6	-176.2	0	0	0	0	111.5	L246 Q247 T248 S253 A254	L246-S250 WeakPolarHBondContact O-CB 3.41Å; L246-S250 PolarHBondContact O-N 3.06Å; Q247-S250 WeakPolarHBondContact O-CB 3.47Å; Q247-S250 PolarHBondContact O-N 3.22Å; Q247-S250 VanDerWaalsContact O-N 3.15Å; T248-S250 VanDerWaalsContact C-N 3.34Å; T248-S250 PolarHBondContact O-N 3.25Å; S250-S253 PolarHBondContact O-N 3.37Å; S250-A254 WeakPolarHBondContact O-CB 3.43Å; S250-A254 PolarHBondContact O-N 3.44Å
251	T	85	Confident	80.1	Confident	86 Å²	86	99 Å²	99	53%	0.528	53%	0.532	S	S	.	.	H	α-helix	trans	-61.7	-46	175	-54.7	0	0	0	0	111.9	Q247 T248 S253 A254 E255	Q247-T251 PolarHBondContact O-N 2.85Å; Q247-T251 PolarHBondContact O-OG1 3.1Å; Q247-T251 VanDerWaalsContact O-OG1 3.12Å; T248-T251 PolarHBondContact O-N 2.98Å; T251-S253 VanDerWaalsContact C-N 3.32Å; T251-S253 PolarHBondContact O-N 2.93Å; T251-A254 PolarHBondContact O-N 3.37Å; T251-E255 PolarHBondContact O-N 2.75Å
252	I	82.8	Confident	78.9	Confident	68 Å²	68	100.6 Å²	100.6	35%	0.349	53%	0.534	S	S	.	.	H	α-helix	trans	-61.9	-41.4	177	-67.1	165.5	0	0	0	110.8	T248 L249 A254 E255 N257	T248-I252 HydrophobicContact CG2-CD1 3.86Å; T248-I252 HydrophobicContact CG2-CG1 4.44Å; T248-I252 VanDerWaalsContact O-CG1 3.25Å; T248-I252 WeakPolarHBondContact O-CG1 3.31Å; T248-I252 PolarHBondContact O-N 3.47Å; L249-I252 PolarHBondContact O-N 2.88Å; I252-A254 VanDerWaalsContact C-N 3.31Å; I252-A254 PolarHBondContact O-N 3.48Å; I252-E255 PolarHBondContact O-N 3.22Å; I252-N257 HydrophobicContact CG2-CB 4.32Å
253	S	77	Confident	77.7	Confident	62 Å²	62	99.4 Å²	99.4	43%	0.434	54%	0.536	S	S	.	.	H	α-helix	trans	-66.8	-32.8	176.7	-174.9	0	0	0	0	112.3	L249 S250 T251 K256	L249-S253 WeakPolarHBondContact O-CB 3.18Å; L249-S253 PolarHBondContact O-N 3.41Å; S250-S253 PolarHBondContact O-N 3.37Å; T251-S253 VanDerWaalsContact C-N 3.32Å; T251-S253 PolarHBondContact O-N 2.93Å; S253-K256 PolarHBondContact O-N 2.96Å
254	A	79.1	Confident	76.7	Confident	77 Å²	77	98.7 Å²	98.7	64%	0.636	53%	0.532	S	S	*	.	H	α-helix	trans	-72.2	-30.9	179.5	0	0	0	0	0	112.8	S250 T251 I252 K256	S250-A254 WeakPolarHBondContact O-CB 3.43Å; S250-A254 PolarHBondContact O-N 3.44Å; T251-A254 PolarHBondContact O-N 3.37Å; I252-A254 VanDerWaalsContact C-N 3.31Å; I252-A254 PolarHBondContact O-N 3.48Å; A254-K256 PolarHBondContact O-N 3.26Å
255	E	81.3	Confident	75.5	Confident	141 Å²	141	96.7 Å²	96.7	66%	0.659	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	6.4	174.6	-74.7	-168.2	165.8	0	0	114.1	T251 I252 N257	T251-E255 PolarHBondContact O-N 2.75Å; I252-E255 PolarHBondContact O-N 3.22Å; E255-N257 PolarHBondContact O-N 3.46Å
256	K	70.9	Confident	74.9	Confident	190 Å²	190	97.7 Å²	97.7	83%	0.826	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.7	25.5	-177.3	-53.6	178.3	-179.5	175.2	0	113.6	S253 A254 S258	S253-K256 PolarHBondContact O-N 2.96Å; A254-K256 PolarHBondContact O-N 3.26Å; K256-S258 PolarHBondContact O-N 3.31Å
257	N	60.1	Low	74.2	Confident	86 Å²	86	98.4 Å²	98.4	46%	0.46	55%	0.554	S	S	.	*			trans	-66.7	106.9	166	-76.6	-34.7	0	0	0	108.2	I252 E255 T259	I252-N257 HydrophobicContact CG2-CB 4.32Å; E255-N257 PolarHBondContact O-N 3.46Å; N257-T259 PolarHBondContact O-N 3.47Å; N257-T259 VanDerWaalsContact O-N 3.08Å
258	S	57.7	Low	73	Confident	122 Å²	122	96.8 Å²	96.8	85%	0.853	55%	0.549	S	S	*	.	S	Bend	trans	-71.5	-2.4	-171.2	75.8	0	0	0	0	114.5	K256	K256-S258 PolarHBondContact O-N 3.31Å
259	T	70.1	Confident	71.7	Confident	102 Å²	102	96 Å²	96	63%	0.626	54%	0.544	S	S	*	.			trans	-121	101.2	-177.9	-54.9	0	0	0	0	109.7	N257 I261	N257-T259 PolarHBondContact O-N 3.47Å; N257-T259 VanDerWaalsContact O-N 3.08Å; T259-I261 HydrophobicContact CG2-CG1 4.06Å
260	I	64.5	Low	71	Confident	96 Å²	96	97.9 Å²	97.9	49%	0.492	56%	0.556	S	S	.	*			trans	-89.8	105.1	172.7	-57.7	174.3	0	0	0	107.6	F262	I260-F262 PolarHBondContact O-N 2.66Å
261	I	67.9	Low	69.9	Low	136 Å²	136	101.3 Å²	101.3	70%	0.697	56%	0.563	S	S	*	*			trans	-83.5	112	176	-57.6	174.4	0	0	0	107.7	T259 P263	T259-I261 HydrophobicContact CG2-CG1 4.06Å; I261-P263 WeakPolarHBondContact O-CD 2.97Å
262	F	66.9	Low	68.8	Low	110 Å²	110	104.9 Å²	104.9	48%	0.482	57%	0.572	S	S	.	*			trans	-101.1	106.6	175.3	-145.1	-85.1	0	0	0	109.5	Y245 L249 I260 L264	Y245-F262 HydrophobicContact CE1-CE2 4.24Å; Y245-F262 HydrophobicContact CE1-CZ 4.02Å; L249-F262 HydrophobicContact CD1-CD2 4.22Å; L249-F262 HydrophobicContact CD1-CE2 3.63Å; L249-F262 HydrophobicContact CD1-CZ 4.47Å; I260-F262 PolarHBondContact O-N 2.66Å; F262-L264 VanDerWaalsContact C-N 3.33Å; F262-L264 HydrophobicContact CD1-CD2 3.45Å; F262-L264 VanDerWaalsContact CD1-CD2 3.45Å; F262-L264 HydrophobicContact CD1-CG 3.78Å; F262-L264 HydrophobicContact CE1-CD2 3.63Å; F262-L264 HydrophobicContact CE1-CG 4.46Å; F262-L264 PolarHBondContact O-N 2.95Å
263	P	65	Low	67.8	Low	90 Å²	90	108.3 Å²	108.3	58%	0.584	59%	0.588	S	S	*	*			trans	-71.4	93.6	171.2	28.8	-32.8	0	0	0	108.4	Y245 I261	Y245-P263 WeakPolarHBondContact OH-CD 3.44Å; I261-P263 WeakPolarHBondContact O-CD 2.97Å
264	L	71.2	Confident	66.7	Low	95 Å²	95	113.3 Å²	113.3	50%	0.497	60%	0.604	S	S	.	*			trans	-82.1	126.2	166.8	-68.6	174.7	0	0	0	108.1	F262 V266 L268 V269	F262-L264 VanDerWaalsContact C-N 3.33Å; F262-L264 HydrophobicContact CD1-CD2 3.45Å; F262-L264 VanDerWaalsContact CD1-CD2 3.45Å; F262-L264 HydrophobicContact CD1-CG 3.78Å; F262-L264 HydrophobicContact CE1-CD2 3.63Å; F262-L264 HydrophobicContact CE1-CG 4.46Å; F262-L264 PolarHBondContact O-N 2.95Å; L264-V266 PolarHBondContact O-N 3.32Å; L264-L268 HydrophobicContact CD2-CD1 4.43Å; L264-V269 HydrophobicContact CB-CG2 4.23Å
265	P	65.4	Low	65.5	Low	76 Å²	76	116.2 Å²	116.2	49%	0.494	61%	0.609	S	S	.	*			trans	-49.3	131.6	168.2	-23.9	30.7	0	0	0	109.4	D267 L268	P265-D267 PolarHBondContact O-N 3.27Å; P265-L268 PolarHBondContact O-N 3.36Å
266	V	74.5	Confident	64	Low	108 Å²	108	115.8 Å²	115.8	66%	0.655	61%	0.611	S	S	*	*	H	α-helix	trans	-54	-28.2	-179.6	-68.5	0	0	0	0	111.7	L264 L268 V269 T270	L264-V266 PolarHBondContact O-N 3.32Å; V266-L268 VanDerWaalsContact C-N 3.29Å; V266-L268 PolarHBondContact O-N 2.76Å; V266-V269 CarbonylContact O-C 3.58Å; V266-V269 WeakPolarHBondContact O-CA 3.31Å; V266-V269 PolarHBondContact O-N 3.28Å; V266-T270 WeakPolarHBondContact O-CG2 3.37Å; V266-T270 PolarHBondContact O-N 3.36Å; V266-T270 PolarHBondContact O-OG1 3.49Å
267	D	74.3	Confident	62.8	Low	116 Å²	116	114 Å²	114	62%	0.62	61%	0.611	S	S	*	*	H	α-helix	trans	-60.3	-34	176.3	-63.7	-30.3	0	0	0	114.1	P265 T270 H271	P265-D267 PolarHBondContact O-N 3.27Å; D267-T270 WeakPolarHBondContact CA-OG1 3.29Å; D267-T270 PolarHBondContact O-OG1 3.02Å; D267-T270 VanDerWaalsContact O-OG1 3.1Å; D267-H271 PolarHBondContact O-N 3.32Å
268	L	63.7	Low	62	Low	90 Å²	90	119.7 Å²	119.7	47%	0.471	63%	0.634	S	S	.	*	H	α-helix	trans	-69.7	-42.7	172.7	-84.6	169	0	0	0	110.1	L264 P265 V266 H271 F272	L264-L268 HydrophobicContact CD2-CD1 4.43Å; P265-L268 PolarHBondContact O-N 3.36Å; V266-L268 VanDerWaalsContact C-N 3.29Å; V266-L268 PolarHBondContact O-N 2.76Å; L268-H271 PolarHBondContact O-N 3.47Å; L268-F272 WeakPolarHBondContact O-CD2 3.33Å; L268-F272 PolarHBondContact O-N 3.13Å
269	V	61.9	Low	61.1	Low	56 Å²	56	117 Å²	117	34%	0.339	63%	0.626	S	S	.	*	H	α-helix	trans	-68	-39.3	179.8	-174.8	0	0	0	0	111.3	L264 V266 H271 F272 M273	L264-V269 HydrophobicContact CB-CG2 4.23Å; V266-V269 CarbonylContact O-C 3.58Å; V266-V269 WeakPolarHBondContact O-CA 3.31Å; V266-V269 PolarHBondContact O-N 3.28Å; V269-H271 VanDerWaalsContact C-N 3.34Å; V269-H271 PolarHBondContact O-N 2.76Å; V269-F272 CarbonylContact O-C 3.59Å; V269-F272 PolarHBondContact O-N 3.45Å; V269-F272 VanDerWaalsContact O-N 3.15Å; V269-M273 HydrophobicContact CG1-CE 4.16Å; V269-M273 HydrophobicContact CG1-CG 4.38Å; V269-M273 PolarHBondContact O-N 3.42Å
270	T	66.7	Low	59.4	Low	69 Å²	69	118 Å²	118	42%	0.423	64%	0.636	S	S	.	*	H	α-helix	trans	-68.1	-33.8	178.6	58.4	0	0	0	0	111.4	V266 D267 F272 M273 H274	V266-T270 WeakPolarHBondContact O-CG2 3.37Å; V266-T270 PolarHBondContact O-N 3.36Å; V266-T270 PolarHBondContact O-OG1 3.49Å; D267-T270 WeakPolarHBondContact CA-OG1 3.29Å; D267-T270 PolarHBondContact O-OG1 3.02Å; D267-T270 VanDerWaalsContact O-OG1 3.1Å; T270-F272 VanDerWaalsContact C-N 3.28Å; T270-F272 PolarHBondContact O-N 2.62Å; T270-M273 PolarHBondContact O-N 3.21Å; T270-H274 WeakPolarHBondContact O-CA 3.47Å; T270-H274 WeakPolarHBondContact O-CB 3.2Å; T270-H274 PolarHBondContact O-N 2.95Å
271	H	62.6	Low	57.8	Low	152 Å²	152	121 Å²	121	70%	0.704	65%	0.654	S	S	*	*	H	α-helix	trans	-60.7	-39	170.8	-98.8	67.8	0	0	0	112.2	D267 L268 V269	D267-H271 PolarHBondContact O-N 3.32Å; L268-H271 PolarHBondContact O-N 3.47Å; V269-H271 VanDerWaalsContact C-N 3.34Å; V269-H271 PolarHBondContact O-N 2.76Å
272	F	61.7	Low	56.2	Low	161 Å²	161	121.7 Å²	121.7	71%	0.706	66%	0.659	S	S	*	*	H	α-helix	trans	-75.7	-29.9	176.2	-68.6	-66.9	0	0	0	113.4	L268 V269 T270	L268-F272 WeakPolarHBondContact O-CD2 3.33Å; L268-F272 PolarHBondContact O-N 3.13Å; V269-F272 CarbonylContact O-C 3.59Å; V269-F272 PolarHBondContact O-N 3.45Å; V269-F272 VanDerWaalsContact O-N 3.15Å; T270-F272 VanDerWaalsContact C-N 3.28Å; T270-F272 PolarHBondContact O-N 2.62Å
273	M	62	Low	54.5	Low	139 Å²	139	125 Å²	125	69%	0.685	67%	0.673	S	S	*	*	H	α-helix	trans	-83.3	-34.3	176.3	-74.9	-158.5	-175.5	0	0	113.8	V269 T270 N275 N276	V269-M273 HydrophobicContact CG1-CE 4.16Å; V269-M273 HydrophobicContact CG1-CG 4.38Å; V269-M273 PolarHBondContact O-N 3.42Å; T270-M273 PolarHBondContact O-N 3.21Å; M273-N275 PolarHBondContact O-N 2.92Å; M273-N276 PolarHBondContact O-N 3.28Å
274	H	53.5	Low	52.9	Low	168 Å²	168	126.7 Å²	126.7	78%	0.778	68%	0.677	S	S	*	*	H	α-helix	trans	-70.8	-13.2	-175.6	-165	72.7	0	0	0	112.7	T270 N276	T270-H274 WeakPolarHBondContact O-CA 3.47Å; T270-H274 WeakPolarHBondContact O-CB 3.2Å; T270-H274 PolarHBondContact O-N 2.95Å; H274-N276 VanDerWaalsContact C-N 3.33Å
275	N	53.5	Low	51.1	Low	137 Å²	137	128.6 Å²	128.6	73%	0.733	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-5.7	175.8	-151.8	31.2	0	0	0	114.4	M273	M273-N275 PolarHBondContact O-N 2.92Å
276	N	49.3	Very low	49.3	Very low	132 Å²	132	130.3 Å²	130.3	71%	0.706	70%	0.697	S	S	*	*	S	Bend	trans	-107.9	-2.4	-173.9	-79.5	0.8	0	0	0	116.4	M273 H274	M273-N276 PolarHBondContact O-N 3.28Å; H274-N276 VanDerWaalsContact C-N 3.33Å
277	N	45.8	Very low	47.2	Very low	154 Å²	154	130.6 Å²	130.6	82%	0.824	70%	0.699	S	S	*	*			trans	-122	60.9	180	-80	-5.8	0	0	0	112.7	G279	N277-G279 VanDerWaalsContact C-N 3.33Å; N277-G279 PolarHBondContact O-N 3.5Å
278	H	44.1	Very low	45.1	Very low	205 Å²	205	132.6 Å²	132.6	95%	0.949	71%	0.71	S	S	*	*			trans	-88.2	75.6	162	-138.5	-74.7	0	0	0	108.9
279	G	38.5	Very low	43.5	Very low	65 Å²	65	135.8 Å²	135.8	67%	0.67	73%	0.728	S	S	*	*			trans	-164.7	92.2	-176.5	0	0	0	0	0	114.4	N277	N277-G279 VanDerWaalsContact C-N 3.33Å; N277-G279 PolarHBondContact O-N 3.5Å
280	S	33.5	Very low	42.1	Very low	122 Å²	122	142.3 Å²	142.3	85%	0.853	75%	0.754	S	S	*	*			trans	73.5	99.4	154.3	-137.4	0	0	0	0	120.1
281	N	32.2	Very low	40.4	Very low	160 Å²	160	147.7 Å²	147.7	86%	0.856	78%	0.775	S	S	*	*			trans	1	124.3	136.8	-83.3	-29.4	0	0	0	117.3
282	N	33.4	Very low	38.9	Very low	151 Å²	151	148.2 Å²	148.2	81%	0.807	78%	0.782	S	S	*	*				-166.3	120.9	110	-153.4	0.6	0	0	0	113
283	K	32.4	Very low	37.4	Very low	178 Å²	178	150.3 Å²	150.3	77%	0.774	79%	0.791	S	S	*	*			trans	-25	137	153.8	-114	154.2	178	166.4	0	115.7
284	N	30.4	Very low	35.9	Very low	127 Å²	127	150 Å²	150	68%	0.679	80%	0.798	S	S	*	*				169.9	133.7	111.4	-83.8	-22.6	0	0	0	114.9
285	N	33.6	Very low	34.7	Very low	134 Å²	134	151.8 Å²	151.8	72%	0.717	80%	0.803	S	S	*	*			trans	70.9	108.3	142.3	-56.1	-11.1	0	0	0	119.9
286	T	28.3	Very low	33.5	Very low	113 Å²	113	153.1 Å²	153.1	69%	0.693	81%	0.809	S	S	*	*				90	124.2	74.1	-56.4	0	0	0	0	113.4
287	T	28.8	Very low	32.7	Very low	114 Å²	114	152.9 Å²	152.9	70%	0.699	81%	0.812	S	S	*	*			trans	70.6	111.5	157.8	49.5	0	0	0	0	120.9
288	N	32.1	Very low	32.4	Very low	157 Å²	157	150.8 Å²	150.8	84%	0.84	81%	0.807	S	S	*	*				-178.7	103.7	101.2	-88.8	-25.4	0	0	0	111.9
289	N	30.2	Very low	32.4	Very low	158 Å²	158	146.5 Å²	146.5	85%	0.845	80%	0.797	S	S	*	*			trans	-90.5	111.2	167.2	-97.7	-21.6	0	0	0	108.6
290	Q	31.4	Very low	32.4	Very low	192 Å²	192	149.3 Å²	149.3	90%	0.897	80%	0.803	S	S	*	*			trans	-134.8	113	153.6	-75.9	-170.2	3	0	0	109.6
291	Q	31.3	Very low	32.4	Very low	183 Å²	183	155.6 Å²	155.6	86%	0.855	81%	0.808	S	S	*	*			trans	-72.1	116.6	177.5	-67.4	166.5	-8.8	0	0	109.3
292	N	31.9	Very low	32.5	Very low	162 Å²	162	155.9 Å²	155.9	87%	0.866	81%	0.809	S	S	*	*			trans	-112.7	106	163.6	-95	-13.6	0	0	0	109.7
293	K	28.3	Very low	32.4	Very low	205 Å²	205	156.4 Å²	156.4	89%	0.891	81%	0.812	S	S	*	*			trans	-83.9	118.6	166.9	-91.4	177.4	172	174	0	108.8
294	T	30.5	Very low	32.3	Very low	134 Å²	134	154.4 Å²	154.4	82%	0.822	81%	0.814	S	S	*	*			trans	-140.4	102.5	161.9	46.1	0	0	0	0	112.5
295	K	28.4	Very low	32.1	Very low	205 Å²	205	151.7 Å²	151.7	89%	0.891	82%	0.816	S	S	*	*			trans	22.5	115.8	142.2	-144.5	172.4	-174.7	-173.1	0	119.4
296	I	30	Very low	31.9	Very low	165 Å²	165	151.4 Å²	151.4	85%	0.846	82%	0.82	S	S	*	*			trans	-74.1	129.3	177.2	-61	157.5	0	0	0	110.7
297	T	31.6	Very low	31.9	Very low	126 Å²	126	152.8 Å²	152.8	77%	0.773	83%	0.828	S	S	*	*			trans	-130.6	133.2	163	-42.7	0	0	0	0	107.7
298	P	39.6	Very low	31.7	Very low	110 Å²	110	152.7 Å²	152.7	71%	0.714	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-82.7	154.2	-162.8	32.4	-34.5	0	0	0	113.4
299	P	43.2	Very low	31.7	Very low	115 Å²	115	151 Å²	151	75%	0.747	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-85.5	162	-170.1	34	-34.7	0	0	0	113.9
300	P	38.6	Very low	31.8	Very low	124 Å²	124	149.6 Å²	149.6	81%	0.805	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-78.3	147.5	-177	-6.4	24.8	0	0	0	112.8
301	R	33.5	Very low	31.6	Very low	254 Å²	254	146.7 Å²	146.7	96%	0.958	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-72.2	128.3	-177.2	-66.6	-177.9	176.6	-170.7	-2.3	111.8
302	L	34.2	Very low	31.6	Very low	167 Å²	167	143.2 Å²	143.2	87%	0.874	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-81.2	129.4	179.6	-138.9	82.5	0	0	0	111
303	N	31.8	Very low	31.5	Very low	162 Å²	162	142.6 Å²	142.6	87%	0.866	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-84.1	127	178.3	-153.9	20.1	0	0	0	109.4	G305	N303-G305 PolarHBondContact O-N 2.86Å
304	V	31.4	Very low	31.4	Very low	135 Å²	135	136.7 Å²	136.7	82%	0.818	81%	0.81	S	S	*	*			trans	-85.5	103.6	-175.3	176.3	0	0	0	0	109.5
305	G	26.3	Very low	31.2	Very low	70 Å²	70	137.6 Å²	137.6	72%	0.722	81%	0.808	S	S	*	*			trans	-102.1	130.1	168.6	0	0	0	0	0	110.6	N303	N303-G305 PolarHBondContact O-N 2.86Å
306	T	28.3	Very low	31.1	Very low	128 Å²	128	135.4 Å²	135.4	79%	0.785	81%	0.805	S	S	*	*			trans	-91	117.6	-177.6	50.5	0	0	0	0	111.2
307	T	28.1	Very low	31.1	Very low	143 Å²	143	132.7 Å²	132.7	88%	0.877	80%	0.796	S	S	*	*			trans	-148.6	142.5	157.4	52.4	0	0	0	0	111.7
308	S	25.6	Very low	31	Very low	111 Å²	111	132.7 Å²	132.7	78%	0.776	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-67.3	163.3	-169.5	38	0	0	0	0	116.2
309	P	31.3	Very low	30.6	Very low	121 Å²	121	133.2 Å²	133.2	79%	0.786	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-91.9	144.9	-154.1	34.5	-33	0	0	0	114.1
310	P	32	Very low	29.9	Very low	129 Å²	129	132.2 Å²	132.2	84%	0.838	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-91.9	152.5	171.6	35	-29.7	0	0	0	112.7
311	T	28.5	Very low	29.6	Very low	131 Å²	131	131.1 Å²	131.1	80%	0.804	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-84.9	148	-175	-3.7	0	0	0	0	112.8
312	T	29.7	Very low	29.7	Very low	111 Å²	111	125.9 Å²	125.9	68%	0.681	78%	0.781	S	S	*	*			trans	92.8	120.3	139.8	-57.6	0	0	0	0	119.2
313	N	29.9	Very low	29.8	Very low	149 Å²	149	122 Å²	122	80%	0.797	77%	0.768	S	S	*	*			trans	69.7	77.2	152.9	-60.8	-6	0	0	0	119.5
314	G	27.3	Very low	29.8	Very low	80 Å²	80	119.6 Å²	119.6	83%	0.825	76%	0.755	S	S	*	*				53	91.4	107.9	0	0	0	0	0	118.1
315	I	27.2	Very low	29.8	Very low	153 Å²	153	118.9 Å²	118.9	79%	0.785	75%	0.751	S	S	*	*			trans	-139.8	129.3	148.3	-60.9	-177	0	0	0	108.3	T317	I315-T317 PolarHBondContact O-N 2.85Å
316	I	25.8	Very low	30.2	Very low	160 Å²	160	121.3 Å²	121.3	82%	0.821	75%	0.752	S	S	*	*			trans	-66.1	113	174.5	-61.8	168.2	0	0	0	107.7	V318	I316-V318 HydrophobicContact CG2-CG2 4.49Å
317	T	29.4	Very low	30.6	Very low	107 Å²	107	119.3 Å²	119.3	66%	0.656	74%	0.743	S	S	*	*			trans	-118.5	105.8	170	-45.5	0	0	0	0	109	I315 V319	I315-T317 PolarHBondContact O-N 2.85Å; T317-V319 HydrophobicContact CG2-CG2 4.1Å; T317-V319 PolarHBondContact O-N 3.31Å
318	V	30.4	Very low	30.7	Very low	127 Å²	127	118.7 Å²	118.7	77%	0.77	73%	0.734	S	S	*	*			trans	-73.5	98.5	164.3	178.9	0	0	0	0	105.8	I316 P320	I316-V318 HydrophobicContact CG2-CG2 4.49Å; V318-P320 WeakPolarHBondContact O-CD 3.21Å
319	V	29.4	Very low	31.2	Very low	120 Å²	120	117.9 Å²	117.9	73%	0.727	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-79.3	116	171.2	-176.5	0	0	0	0	106.8	T317	T317-V319 HydrophobicContact CG2-CG2 4.1Å; T317-V319 PolarHBondContact O-N 3.31Å
320	P	30.1	Very low	31.6	Very low	94 Å²	94	117.1 Å²	117.1	61%	0.61	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-67.1	151.6	176.6	28.1	-31.4	0	0	0	110	V318	V318-P320 WeakPolarHBondContact O-CD 3.21Å
321	S	32	Very low	31.8	Very low	102 Å²	102	118.5 Å²	118.5	71%	0.713	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-46.3	143.4	178.9	-172.5	0	0	0	0	112.4	S323	S321-S323 VanDerWaalsContact C-N 3.26Å; S321-S323 PolarHBondContact O-N 3.47Å
322	V	34.1	Very low	32.1	Very low	144 Å²	144	117.6 Å²	117.6	87%	0.873	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	81.1	-178.3	-178.9	0	0	0	0	110.2
323	S	37.3	Very low	32.5	Very low	86 Å²	86	118.2 Å²	118.2	60%	0.601	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.5	-17	159.6	58.9	0	0	0	0	113.8	S321	S321-S323 VanDerWaalsContact C-N 3.26Å; S321-S323 PolarHBondContact O-N 3.47Å
324	D	32.2	Very low	33	Very low	111 Å²	111	115 Å²	115	59%	0.594	69%	0.685	S	S	*	*	S	Bend	trans	-107.1	-1.2	-169.6	-65.8	-2.8	0	0	0	115.7	T326	D324-T326 VanDerWaalsContact C-N 3.29Å; D324-T326 PolarHBondContact O-N 2.88Å
325	V	31.9	Very low	33.4	Very low	120 Å²	120	118.4 Å²	118.4	73%	0.727	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	1.9	-176.1	-167.6	0	0	0	0	113.7
326	T	33.8	Very low	34.1	Very low	121 Å²	121	116.7 Å²	116.7	74%	0.742	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.7	5.6	174.8	51.6	0	0	0	0	115	D324	D324-T326 VanDerWaalsContact C-N 3.29Å; D324-T326 PolarHBondContact O-N 2.88Å
327	S	36.9	Very low	34.7	Very low	86 Å²	86	115.3 Å²	115.3	60%	0.601	67%	0.666	S	S	*	*	S	Bend	trans	-102.4	-10.7	175.8	69.3	0	0	0	0	115.5
328	L	30.2	Very low	35.1	Very low	130 Å²	130	117.2 Å²	117.2	68%	0.681	67%	0.672	S	S	*	*	S	Bend	trans	-99.8	-7.4	-176.7	-80.5	163.5	0	0	0	115.4
329	T	36.4	Very low	35.4	Very low	93 Å²	93	118 Å²	118	57%	0.571	67%	0.672	S	S	*	*	H	α-helix	trans	-92.2	-10.5	173	51.6	0	0	0	0	114.1
330	T	38.3	Very low	35.7	Very low	105 Å²	105	119.3 Å²	119.3	64%	0.644	68%	0.675	S	S	*	*	H	α-helix	trans	-83	-17.8	174.6	-44.6	0	0	0	0	112.8
331	K	36.4	Very low	36	Very low	159 Å²	159	122.2 Å²	122.2	69%	0.691	69%	0.686	S	S	*	*	H	α-helix	trans	-80.4	-35.7	178.9	-131.9	175.3	-175.2	178.2	0	112.9	S334	K331-S334 PolarHBondContact O-OG 2.98Å
332	D	36	Very low	36.2	Very low	111 Å²	111	124.7 Å²	124.7	59%	0.594	69%	0.691	S	S	*	*	H	α-helix	trans	-86.9	-22.7	-179.3	-71.9	-20.2	0	0	0	114.1	S334 M335	D332-S334 VanDerWaalsContact C-N 3.28Å; D332-S334 PolarHBondContact O-N 3Å; D332-M335 PolarHBondContact O-N 2.92Å
333	Q	37.5	Very low	36.2	Very low	125 Å²	125	125.1 Å²	125.1	58%	0.584	69%	0.688	S	S	*	*	H	α-helix	trans	-69.1	-28.8	172.1	-137.1	93.4	50	0	0	112	M335 I336	Q333-M335 PolarHBondContact O-N 3.22Å; Q333-I336 PolarHBondContact O-N 3.28Å
334	S	39.4	Very low	36.1	Very low	81 Å²	81	128.6 Å²	128.6	57%	0.566	70%	0.7	S	S	*	*	H	α-helix	trans	-72.1	-15.3	175	74.1	0	0	0	0	114.1	K331 D332	K331-S334 PolarHBondContact O-OG 2.98Å; D332-S334 VanDerWaalsContact C-N 3.28Å; D332-S334 PolarHBondContact O-N 3Å
335	M	36.5	Very low	36.2	Very low	152 Å²	152	131.3 Å²	131.3	75%	0.749	72%	0.715	S	S	*	*	H	α-helix	trans	-96.2	-9	176	-80.5	-162	174.9	0	0	114.5	D332 Q333	D332-M335 PolarHBondContact O-N 2.92Å; Q333-M335 PolarHBondContact O-N 3.22Å
336	I	42.2	Very low	36.4	Very low	117 Å²	117	134.5 Å²	134.5	60%	0.6	72%	0.722	S	S	*	*	H	α-helix	trans	-98.2	-25.6	176.2	-59	175.8	0	0	0	111.8	Q333 N338	Q333-I336 PolarHBondContact O-N 3.28Å; I336-N338 VanDerWaalsContact C-N 3.25Å; I336-N338 PolarHBondContact O-N 3.2Å
337	D	38.5	Very low	36.5	Very low	130 Å²	130	138.5 Å²	138.5	70%	0.695	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-5	177.4	-72.3	-13.9	0	0	0	114.3
338	N	38	Very low	36.1	Very low	147 Å²	147	142.4 Å²	142.4	79%	0.786	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	4.1	176.2	-152.7	24.1	0	0	0	114.7	I336	I336-N338 VanDerWaalsContact C-N 3.25Å; I336-N338 PolarHBondContact O-N 3.2Å
339	N	35.8	Very low	36.8	Very low	143 Å²	143	146.6 Å²	146.6	77%	0.765	77%	0.774	S	S	*	*	S	Bend	trans	-114.1	6	178.4	-158.3	26.6	0	0	0	114.7
340	N	35.5	Very low	36.8	Very low	149 Å²	149	149.3 Å²	149.3	80%	0.797	78%	0.784	S	S	*	*	S	Bend	trans	-114.8	17.6	-177.5	-140.3	11.9	0	0	0	115
341	N	36.4	Very low	36.7	Very low	155 Å²	155	151.6 Å²	151.6	83%	0.829	79%	0.791	S	S	*	*	S	Bend	trans	-117.6	20.1	-179.3	-134.4	10.2	0	0	0	115.1
342	N	36.6	Very low	36.7	Very low	153 Å²	153	151.2 Å²	151.2	82%	0.818	80%	0.797	S	S	*	*	S	Bend	trans	-120.3	12.8	-177.9	-128.8	11.8	0	0	0	116.5
343	N	35.1	Very low	36.8	Very low	153 Å²	153	153.5 Å²	153.5	82%	0.818	81%	0.809	S	S	*	*	S	Bend	trans	-117.1	10.7	-177.6	-90.7	2	0	0	0	117.1
344	N	34.7	Very low	36.7	Very low	159 Å²	159	155.3 Å²	155.3	85%	0.85	82%	0.823	S	S	*	*	S	Bend	trans	-119	34.4	-179.1	-80.7	-3.3	0	0	0	115.4
345	N	35	Very low	36.5	Very low	168 Å²	168	160.3 Å²	160.3	90%	0.898	84%	0.84	S	S	*	*	S	Bend	trans	-135.2	31.8	175.1	-114.8	22	0	0	0	116.3
346	Q	34.8	Very low	36.6	Very low	187 Å²	187	160.9 Å²	160.9	87%	0.874	85%	0.846	S	S	*	*			trans	-133.5	68.9	168.4	-109	-177.1	-3.4	0	0	111.8
347	F	35.8	Very low	36.1	Very low	206 Å²	206	164.2 Å²	164.2	90%	0.904	87%	0.865	S	S	*	*			trans	-150.5	81.2	154.1	-103.3	-78.1	0	0	0	107.9
348	N	29.6	Very low	35.9	Very low	168 Å²	168	167.1 Å²	167.1	90%	0.898	88%	0.879	S	S	*	*			trans	-171.1	79.3	160.1	-110.1	-6.4	0	0	0	110.4
349	V	43.8	Very low	35.7	Very low	217 Å²	217	168.9 Å²	168.9	100%	1.315	89%	0.888	S	S	*	*				-161.8	0	129.7	179.6	0	0	0	0	104.3

Retrieved 349 of 349 residues in 288.9 ms (Link to these results)

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