A0A077ZBH6_TRITR Loading...

F-actin-capping protein subunit beta

F-actin-capping proteins bind in a Ca(2+)-independent manner to the fast growing ends of actin filaments (barbed end) thereby blocking the exchange of subunits at these ends. Unlike other capping proteins (such as gelsolin and severin), these proteins do not sever actin filaments.

AlphaFold DB , UniProt , Accession A0A077ZBH6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 279 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	84.1	Confident	86.5	Confident	74 Å²	74	86.4 Å²	86.4	37%	0.365	42%	0.42	S	S	.	.				0	-63	0	-162.8	53.8	165.4	0	0	112.6	C3 A4 L5 D33 L34 A37	M1-C3 PolarHBondContact O-N 2.98Å; M1-A4 WeakPolarHBondContact O-CA 3.35Å; M1-A4 VanDerWaalsContact O-CB 3.27Å; M1-A4 WeakPolarHBondContact O-CB 3.3Å; M1-A4 PolarHBondContact O-N 2.72Å; M1-L5 HydrophobicContact CE-CD1 4.26Å; M1-L5 HydrophobicContact CE-CD2 4.24Å; M1-L5 HydrophobicContact CE-CG 4.4Å; M1-L5 HydrophobicContact CG-CD1 4.19Å; M1-L5 PolarHBondContact O-N 3Å; M1-L5 VanDerWaalsContact O-N 3.1Å; M1-L5 HydrophobicContact SD-CG 4.44Å; M1-D33 HydrophobicContact CE-CB 3.59Å; M1-D33 VanDerWaalsContact CE-O 3.29Å; M1-D33 WeakPolarHBondContact CE-O 3.28Å; M1-D33 HydrophobicContact SD-CB 4.06Å; M1-L34 HydrophobicContact CE-CD2 4.49Å; M1-L34 HydrophobicContact SD-CD2 3.9Å; M1-L34 HydrophobicContact SD-CG 4.43Å; M1-A37 HydrophobicContact CE-CB 3.53Å
2	D	88	Confident	85.8	Confident	133 Å²	133	84 Å²	84	71%	0.711	42%	0.417	S	S	*	.	H	α-helix	trans	-56	-44	-173.5	-60.8	-21	0	0	0	114.6	A4 L5 D6	D2-A4 VanDerWaalsContact C-N 3.28Å; D2-A4 PolarHBondContact O-N 3.11Å; D2-L5 PolarHBondContact O-N 3.16Å; D2-D6 PolarHBondContact O-N 3.07Å
3	C	90.2	Very high	85.2	Confident	110 Å²	110	81.1 Å²	81.1	74%	0.743	41%	0.407	S	S	*	.	H	α-helix	trans	-63.3	-34.2	177	-57.3	0	0	0	0	112.8	M1 L7	M1-C3 PolarHBondContact O-N 2.98Å; C3-L7 WeakPolarHBondContact O-CB 3.18Å; C3-L7 PolarHBondContact O-N 3.28Å
4	A	87.6	Confident	84.4	Confident	14 Å²	14	80.6 Å²	80.6	12%	0.116	40%	0.403	C	S	.	.	H	α-helix	trans	-67.6	-46	177.6	0	0	0	0	0	111	M1 D2 L7 M8 L23 L34	M1-A4 WeakPolarHBondContact O-CA 3.35Å; M1-A4 VanDerWaalsContact O-CB 3.27Å; M1-A4 WeakPolarHBondContact O-CB 3.3Å; M1-A4 PolarHBondContact O-N 2.72Å; D2-A4 VanDerWaalsContact C-N 3.28Å; D2-A4 PolarHBondContact O-N 3.11Å; A4-L7 PolarHBondContact O-N 2.97Å; A4-M8 WeakPolarHBondContact O-CG 3.32Å; A4-M8 PolarHBondContact O-N 3.01Å; A4-L23 HydrophobicContact CB-CD2 3.34Å; A4-L34 HydrophobicContact CB-CD2 3.61Å
5	L	86.6	Confident	84.1	Confident	34 Å²	34	82.6 Å²	82.6	18%	0.178	41%	0.408	C	S	.	.	H	α-helix	trans	-64	-41.1	175.7	-61.2	177.7	0	0	0	111.5	M1 D2 L7 M8 R9 A37 I38	M1-L5 HydrophobicContact CE-CD1 4.26Å; M1-L5 HydrophobicContact CE-CD2 4.24Å; M1-L5 HydrophobicContact CE-CG 4.4Å; M1-L5 HydrophobicContact CG-CD1 4.19Å; M1-L5 PolarHBondContact O-N 3Å; M1-L5 VanDerWaalsContact O-N 3.1Å; M1-L5 HydrophobicContact SD-CG 4.44Å; D2-L5 PolarHBondContact O-N 3.16Å; L5-L7 VanDerWaalsContact C-N 3.33Å; L5-L7 PolarHBondContact O-N 3.32Å; L5-M8 PolarHBondContact O-N 3.02Å; L5-R9 WeakPolarHBondContact O-CG 3.36Å; L5-R9 PolarHBondContact O-N 3.45Å; L5-R9 VanDerWaalsContact O-N 3.11Å; L5-A37 HydrophobicContact CD2-CB 3.81Å; L5-I38 HydrophobicContact CD2-CD1 4.05Å; L5-I38 HydrophobicContact CD2-CG1 3.61Å
6	D	88.4	Confident	84	Confident	62 Å²	62	78.3 Å²	78.3	33%	0.332	39%	0.389	S	S	.	.	H	α-helix	trans	-63.8	-38.8	175.6	-167.8	63.3	0	0	0	111.9	D2 R9 R10	D2-D6 PolarHBondContact O-N 3.07Å; D6-R9 PolarHBondContact O-N 3.34Å; D6-R10 WeakPolarHBondContact O-CG 3.38Å; D6-R10 PolarHBondContact O-N 2.94Å; D6-R10 IonicContact OD1-NE 2.77Å; D6-R10 IonicContact OD1-NH2 3.01Å; D6-R10 PolarHBondContact OD1-NH2 3.33Å; D6-R10 IonicContact OD2-CZ 3.25Å; D6-R10 IonicContact OD2-NE 3.49Å; D6-R10 PolarHBondContact OD2-NE 3.29Å; D6-R10 IonicContact OD2-NH2 3.34Å; D6-R10 PolarHBondContact OD2-NH2 2.88Å
7	L	88.4	Confident	83.9	Confident	74 Å²	74	78.6 Å²	78.6	39%	0.387	39%	0.389	S	S	.	.	H	α-helix	trans	-62.2	-46.3	175.9	-171	65.8	0	0	0	111.1	C3 A4 L5 R9 R10 L11 L23	C3-L7 WeakPolarHBondContact O-CB 3.18Å; C3-L7 PolarHBondContact O-N 3.28Å; A4-L7 PolarHBondContact O-N 2.97Å; L5-L7 VanDerWaalsContact C-N 3.33Å; L5-L7 PolarHBondContact O-N 3.32Å; L7-R9 VanDerWaalsContact C-N 3.25Å; L7-R9 PolarHBondContact O-N 3.08Å; L7-R10 PolarHBondContact O-N 3.48Å; L7-L11 HydrophobicContact CD1-CD1 4.43Å; L7-L11 HydrophobicContact CD1-CG 4.4Å; L7-L11 HydrophobicContact CD2-CD1 4.23Å; L7-L11 HydrophobicContact CG-CD1 3.82Å; L7-L11 HydrophobicContact CG-CG 4.2Å; L7-L11 WeakPolarHBondContact O-CG 3.42Å; L7-L11 PolarHBondContact O-N 3.36Å; L7-L23 HydrophobicContact CD2-CD1 3.78Å
8	M	85.2	Confident	84.1	Confident	25 Å²	25	83.7 Å²	83.7	12%	0.123	40%	0.403	C	S	.	.	H	α-helix	trans	-64.3	-28.5	179.3	-69	-59.8	-69.1	0	0	113.3	A4 L5 R10 L11 C16 L20 L23 I38	A4-M8 WeakPolarHBondContact O-CG 3.32Å; A4-M8 PolarHBondContact O-N 3.01Å; L5-M8 PolarHBondContact O-N 3.02Å; M8-R10 VanDerWaalsContact C-N 3.27Å; M8-R10 PolarHBondContact O-N 3.05Å; M8-L11 HydrophobicContact SD-CD1 4.21Å; M8-C16 HydrophobicContact CE-CB 4.43Å; M8-C16 WeakPolarHBondContact CE-SG 3.44Å; M8-L20 HydrophobicContact CE-CB 4.21Å; M8-L23 HydrophobicContact CG-CD1 4.35Å; M8-L23 HydrophobicContact SD-CD1 4.15Å; M8-I38 HydrophobicContact CB-CD1 4.43Å; M8-I38 HydrophobicContact CE-CG2 3.98Å; M8-I38 HydrophobicContact CG-CD1 3.76Å; M8-I38 HydrophobicContact CG-CG1 4.46Å
9	R	83.7	Confident	84.4	Confident	196 Å²	196	81.8 Å²	81.8	74%	0.74	39%	0.392	S	S	*	.	H	α-helix	trans	-70.9	-19.3	172.2	-70	174.2	-168.9	157.7	3.4	113.9	L5 D6 L7	L5-R9 WeakPolarHBondContact O-CG 3.36Å; L5-R9 PolarHBondContact O-N 3.45Å; L5-R9 VanDerWaalsContact O-N 3.11Å; D6-R9 PolarHBondContact O-N 3.34Å; L7-R9 VanDerWaalsContact C-N 3.25Å; L7-R9 PolarHBondContact O-N 3.08Å
10	R	85.1	Confident	84.5	Confident	182 Å²	182	78 Å²	78	69%	0.687	37%	0.373	S	S	*	.	H	α-helix	trans	-100.7	-23.5	-177.9	-65.6	173.8	-171.3	-82	-5.1	113.1	D6 L7 M8	D6-R10 WeakPolarHBondContact O-CG 3.38Å; D6-R10 PolarHBondContact O-N 2.94Å; D6-R10 IonicContact OD1-NE 2.77Å; D6-R10 IonicContact OD1-NH2 3.01Å; D6-R10 PolarHBondContact OD1-NH2 3.33Å; D6-R10 IonicContact OD2-CZ 3.25Å; D6-R10 IonicContact OD2-NE 3.49Å; D6-R10 PolarHBondContact OD2-NE 3.29Å; D6-R10 IonicContact OD2-NH2 3.34Å; D6-R10 PolarHBondContact OD2-NH2 2.88Å; L7-R10 PolarHBondContact O-N 3.48Å; M8-R10 VanDerWaalsContact C-N 3.27Å; M8-R10 PolarHBondContact O-N 3.05Å
11	L	84.4	Confident	84.7	Confident	46 Å²	46	75.7 Å²	75.7	24%	0.241	37%	0.37	C	S	.	.	S	Bend	trans	-78	151.3	-178.3	-71.3	175	0	0	0	111.5	L7 M8 Y19	L7-L11 HydrophobicContact CD1-CD1 4.43Å; L7-L11 HydrophobicContact CD1-CG 4.4Å; L7-L11 HydrophobicContact CD2-CD1 4.23Å; L7-L11 HydrophobicContact CG-CD1 3.82Å; L7-L11 HydrophobicContact CG-CG 4.2Å; L7-L11 WeakPolarHBondContact O-CG 3.42Å; L7-L11 PolarHBondContact O-N 3.36Å; M8-L11 HydrophobicContact SD-CD1 4.21Å; L11-Y19 HydrophobicContact CB-CD2 3.64Å; L11-Y19 HydrophobicContact CB-CE2 3.73Å; L11-Y19 HydrophobicContact CB-CG 4.32Å; L11-Y19 HydrophobicContact CD1-CD1 4.01Å; L11-Y19 HydrophobicContact CD1-CD2 3.85Å; L11-Y19 HydrophobicContact CD1-CE2 4.38Å; L11-Y19 HydrophobicContact CD1-CG 3.64Å; L11-Y19 HydrophobicContact CD2-CE2 4.37Å; L11-Y19 HydrophobicContact CG-CD2 4.25Å; L11-Y19 HydrophobicContact CG-CE2 4.39Å; L11-Y19 HydrophobicContact CG-CG 4.48Å
12	P	78.7	Confident	85	Confident	58 Å²	58	76.1 Å²	76.1	38%	0.377	37%	0.373	S	S	.	.			trans	-56.8	121.1	177.1	-26.4	33.3	0	0	0	112	Q14 K15 Y19	P12-Q14 PolarHBondContact O-N 3.16Å; P12-K15 PolarHBondContact O-N 3.25Å; P12-K15 VanDerWaalsContact O-N 3.13Å; P12-Y19 HydrophobicContact CB-CE2 4.4Å; P12-Y19 HydrophobicContact CG-CE2 4.45Å; P12-Y19 WeakPolarHBondContact O-CE2 3.21Å
13	P	77.6	Confident	85.1	Confident	46 Å²	46	70.2 Å²	70.2	30%	0.299	34%	0.342	S	S	.	.	G	3₁₀ helix	trans	-66	-22.6	-173	28	-37.8	0	0	0	113	K15 C16 S183	P13-K15 PolarHBondContact O-N 3.04Å; P13-K15 VanDerWaalsContact O-N 3.12Å; P13-C16 VanDerWaalsContact O-CB 3.28Å; P13-C16 WeakPolarHBondContact O-CB 3.48Å; P13-C16 PolarHBondContact O-N 2.91Å; P13-C16 VanDerWaalsContact O-N 3.1Å; P13-S183 WeakPolarHBondContact CG-OG 3.37Å
14	Q	73.4	Confident	85	Confident	75 Å²	75	66.6 Å²	66.6	35%	0.35	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-63.3	-20.3	177	-53.3	89.6	-19.2	0	0	113.1	P12 N181 S183	P12-Q14 PolarHBondContact O-N 3.16Å; Q14-N181 PolarHBondContact NE2-ND2 3.05Å; Q14-N181 VanDerWaalsContact NE2-ND2 3.16Å; Q14-N181 PolarHBondContact NE2-OD1 3.17Å; Q14-S183 PolarHBondContact NE2-OG 3.46Å; Q14-S183 PolarHBondContact OE1-OG 3.1Å
15	K	80.8	Confident	85.2	Confident	110 Å²	110	71.9 Å²	71.9	48%	0.478	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-113.3	20.8	-179.7	-62	-177.6	-175	176.6	0	111.4	P12 P13 E17 R18 Y19	P12-K15 PolarHBondContact O-N 3.25Å; P12-K15 VanDerWaalsContact O-N 3.13Å; P13-K15 PolarHBondContact O-N 3.04Å; P13-K15 VanDerWaalsContact O-N 3.12Å; K15-E17 VanDerWaalsContact C-N 3.29Å; K15-E17 PolarHBondContact O-N 3.44Å; K15-R18 PolarHBondContact O-N 2.93Å; K15-Y19 HydrophobicContact CB-CD2 3.88Å; K15-Y19 HydrophobicContact CB-CE2 3.44Å; K15-Y19 VanDerWaalsContact CB-CE2 3.44Å; K15-Y19 WeakPolarHBondContact O-CD2 3.28Å; K15-Y19 PolarHBondContact O-N 3.04Å
16	C	82.1	Confident	85.4	Confident	14 Å²	14	76.5 Å²	76.5	10%	0.095	36%	0.363	C	S	.	.	H	α-helix	trans	-49.7	-49.3	-178.4	-173	0	0	0	0	111.5	M8 P13 R18 Y19 L20	M8-C16 HydrophobicContact CE-CB 4.43Å; M8-C16 WeakPolarHBondContact CE-SG 3.44Å; P13-C16 VanDerWaalsContact O-CB 3.28Å; P13-C16 WeakPolarHBondContact O-CB 3.48Å; P13-C16 PolarHBondContact O-N 2.91Å; P13-C16 VanDerWaalsContact O-N 3.1Å; C16-R18 VanDerWaalsContact C-N 3.34Å; C16-R18 PolarHBondContact O-N 3.2Å; C16-Y19 PolarHBondContact O-N 2.99Å; C16-Y19 VanDerWaalsContact O-N 3.16Å; C16-L20 WeakPolarHBondContact O-CB 3.5Å; C16-L20 PolarHBondContact O-N 3.35Å
17	E	82.5	Confident	85.6	Confident	83 Å²	83	75.6 Å²	75.6	39%	0.388	36%	0.36	S	S	.	.	H	α-helix	trans	-57.1	-45.2	179.1	-63.5	-171.5	-162.1	0	0	112.8	K15 L20 G21 K43	K15-E17 VanDerWaalsContact C-N 3.29Å; K15-E17 PolarHBondContact O-N 3.44Å; E17-L20 PolarHBondContact O-N 3.05Å; E17-G21 PolarHBondContact O-N 3.35Å; E17-K43 VanDerWaalsContact CD-NZ 3.27Å; E17-K43 WeakPolarHBondContact OE1-CE 3.33Å; E17-K43 IonicContact OE1-NZ 2.82Å; E17-K43 PolarHBondContact OE1-NZ 3.46Å; E17-K43 WeakPolarHBondContact OE2-CE 3.41Å; E17-K43 IonicContact OE2-NZ 2.72Å; E17-K43 PolarHBondContact OE2-NZ 3.5Å
18	R	87.9	Confident	85.7	Confident	171 Å²	171	76.1 Å²	76.1	65%	0.645	37%	0.368	S	S	*	.	H	α-helix	trans	-65.5	-43.2	179.4	178.7	177.8	174	170.5	-0.8	111	K15 C16 L22	K15-R18 PolarHBondContact O-N 2.93Å; C16-R18 VanDerWaalsContact C-N 3.34Å; C16-R18 PolarHBondContact O-N 3.2Å; R18-L22 HydrophobicContact CG-CD1 4.33Å; R18-L22 WeakPolarHBondContact O-CG 3.48Å; R18-L22 PolarHBondContact O-N 3.36Å; R18-L22 VanDerWaalsContact O-N 3.08Å
19	Y	88.4	Confident	86	Confident	48 Å²	48	82.9 Å²	82.9	19%	0.188	40%	0.399	C	S	.	.	H	α-helix	trans	-69.6	-38.9	-179.3	-63.4	-45.3	0	0	0	111.8	L11 P12 K15 C16 L22 L23	L11-Y19 HydrophobicContact CB-CD2 3.64Å; L11-Y19 HydrophobicContact CB-CE2 3.73Å; L11-Y19 HydrophobicContact CB-CG 4.32Å; L11-Y19 HydrophobicContact CD1-CD1 4.01Å; L11-Y19 HydrophobicContact CD1-CD2 3.85Å; L11-Y19 HydrophobicContact CD1-CE2 4.38Å; L11-Y19 HydrophobicContact CD1-CG 3.64Å; L11-Y19 HydrophobicContact CD2-CE2 4.37Å; L11-Y19 HydrophobicContact CG-CD2 4.25Å; L11-Y19 HydrophobicContact CG-CE2 4.39Å; L11-Y19 HydrophobicContact CG-CG 4.48Å; P12-Y19 HydrophobicContact CB-CE2 4.4Å; P12-Y19 HydrophobicContact CG-CE2 4.45Å; P12-Y19 WeakPolarHBondContact O-CE2 3.21Å; K15-Y19 HydrophobicContact CB-CD2 3.88Å; K15-Y19 HydrophobicContact CB-CE2 3.44Å; K15-Y19 VanDerWaalsContact CB-CE2 3.44Å; K15-Y19 WeakPolarHBondContact O-CD2 3.28Å; K15-Y19 PolarHBondContact O-N 3.04Å; C16-Y19 PolarHBondContact O-N 2.99Å; C16-Y19 VanDerWaalsContact O-N 3.16Å; Y19-L22 PolarHBondContact O-N 3.29Å; Y19-L23 WeakPolarHBondContact O-CB 3.4Å; Y19-L23 PolarHBondContact O-N 3.49Å
20	L	87.2	Confident	86.3	Confident	4 Å²	4	75.2 Å²	75.2	2%	0.021	37%	0.373	C	S	.	.	H	α-helix	trans	-62	-45.4	174.7	-175.8	57.8	0	0	0	111.1	M8 C16 E17 L22 L23 I24 L34 L35 I38 Q40	M8-L20 HydrophobicContact CE-CB 4.21Å; C16-L20 WeakPolarHBondContact O-CB 3.5Å; C16-L20 PolarHBondContact O-N 3.35Å; E17-L20 PolarHBondContact O-N 3.05Å; L20-L22 PolarHBondContact O-N 3.11Å; L20-L23 WeakPolarHBondContact O-CB 3.36Å; L20-L23 PolarHBondContact O-N 3.38Å; L20-L23 VanDerWaalsContact O-N 3.09Å; L20-I24 HydrophobicContact CD1-CD1 4.22Å; L20-I24 HydrophobicContact CD1-CG1 4.39Å; L20-I24 HydrophobicContact CG-CD1 3.99Å; L20-I24 VanDerWaalsContact O-CG1 3.31Å; L20-I24 WeakPolarHBondContact O-CG1 3.28Å; L20-I24 PolarHBondContact O-N 3.33Å; L20-L34 HydrophobicContact CD1-CB 4.06Å; L20-L35 HydrophobicContact CD2-CD2 3.98Å; L20-I38 HydrophobicContact CD1-CB 4.45Å; L20-I38 HydrophobicContact CD1-CD1 3.65Å; L20-Q40 VanDerWaalsContact CD2-CD 3.42Å; L20-Q40 HydrophobicContact CD2-CG 3.81Å
21	G	88	Confident	86.3	Confident	30 Å²	30	68.6 Å²	68.6	31%	0.309	35%	0.354	S	S	.	.	H	α-helix	trans	-57.1	-47.9	174.3	0	0	0	0	0	112.6	E17 L23 I24 D25	E17-G21 PolarHBondContact O-N 3.35Å; G21-L23 VanDerWaalsContact C-N 3.27Å; G21-L23 PolarHBondContact O-N 3.05Å; G21-I24 PolarHBondContact O-N 3.5Å; G21-D25 VanDerWaalsContact O-CG 3.3Å; G21-D25 PolarHBondContact O-N 2.93Å
22	L	90.7	Very high	86.3	Confident	83 Å²	83	74.1 Å²	74.1	44%	0.435	38%	0.378	S	S	.	.	H	α-helix	trans	-62.5	-34.2	175.5	-69.8	171.9	0	0	0	112.7	R18 Y19 L20 D25 M26	R18-L22 HydrophobicContact CG-CD1 4.33Å; R18-L22 WeakPolarHBondContact O-CG 3.48Å; R18-L22 PolarHBondContact O-N 3.36Å; R18-L22 VanDerWaalsContact O-N 3.08Å; Y19-L22 PolarHBondContact O-N 3.29Å; L20-L22 PolarHBondContact O-N 3.11Å; L22-D25 PolarHBondContact O-N 2.81Å; L22-M26 VanDerWaalsContact O-CG 3.3Å; L22-M26 WeakPolarHBondContact O-CG 3.39Å; L22-M26 PolarHBondContact O-N 2.87Å
23	L	89.4	Confident	86.7	Confident	9 Å²	9	75.5 Å²	75.5	5%	0.047	38%	0.382	C	S	.	.	H	α-helix	trans	-70.3	-40.6	179	-134.2	120.7	0	0	0	111.9	A4 L7 M8 Y19 L20 G21 M26 V27 L34	A4-L23 HydrophobicContact CB-CD2 3.34Å; L7-L23 HydrophobicContact CD2-CD1 3.78Å; M8-L23 HydrophobicContact CG-CD1 4.35Å; M8-L23 HydrophobicContact SD-CD1 4.15Å; Y19-L23 WeakPolarHBondContact O-CB 3.4Å; Y19-L23 PolarHBondContact O-N 3.49Å; L20-L23 WeakPolarHBondContact O-CB 3.36Å; L20-L23 PolarHBondContact O-N 3.38Å; L20-L23 VanDerWaalsContact O-N 3.09Å; G21-L23 VanDerWaalsContact C-N 3.27Å; G21-L23 PolarHBondContact O-N 3.05Å; L23-M26 HydrophobicContact CG-CE 4.28Å; L23-M26 PolarHBondContact O-N 2.82Å; L23-V27 PolarHBondContact O-N 2.8Å; L23-L34 HydrophobicContact CD2-CD1 3.63Å; L23-L34 HydrophobicContact CD2-CD2 3.87Å; L23-L34 HydrophobicContact CD2-CG 4.42Å
24	I	89.9	Confident	87.1	Confident	34 Å²	34	73.3 Å²	73.3	17%	0.174	37%	0.368	C	S	.	.	H	α-helix	trans	-63.5	-43.3	174	-68.8	168.2	0	0	0	110	L20 G21 M26 V27 P28 C31 L34 L35	L20-I24 HydrophobicContact CD1-CD1 4.22Å; L20-I24 HydrophobicContact CD1-CG1 4.39Å; L20-I24 HydrophobicContact CG-CD1 3.99Å; L20-I24 VanDerWaalsContact O-CG1 3.31Å; L20-I24 WeakPolarHBondContact O-CG1 3.28Å; L20-I24 PolarHBondContact O-N 3.33Å; G21-I24 PolarHBondContact O-N 3.5Å; I24-M26 VanDerWaalsContact C-N 3.29Å; I24-M26 PolarHBondContact O-N 2.79Å; I24-V27 CarbonylContact O-C 3.28Å; I24-V27 VanDerWaalsContact O-C 3.3Å; I24-V27 PolarHBondContact O-N 3.3Å; I24-P28 WeakPolarHBondContact O-CA 3.35Å; I24-P28 WeakPolarHBondContact O-CG 3.48Å; I24-P28 VanDerWaalsContact O-N 3.08Å; I24-C31 HydrophobicContact CG2-CB 3.96Å; I24-L34 HydrophobicContact CG1-CD1 4.38Å; I24-L35 HydrophobicContact CD1-CD2 4.1Å; I24-L35 HydrophobicContact CD1-CG 4.13Å
25	D	91.7	Very high	87.6	Confident	125 Å²	125	71.5 Å²	71.5	67%	0.668	36%	0.361	S	S	*	.	H	α-helix	trans	-62.1	-36.7	176.5	-70.2	-19.2	0	0	0	112.3	G21 L22	G21-D25 VanDerWaalsContact O-CG 3.3Å; G21-D25 PolarHBondContact O-N 2.93Å; L22-D25 PolarHBondContact O-N 2.81Å
26	M	91.1	Very high	87.7	Confident	131 Å²	131	69.3 Å²	69.3	65%	0.645	36%	0.363	S	S	*	.	H	α-helix	trans	-75.5	-36	178.2	-74.9	-170.4	-51.4	0	0	113.3	L22 L23 I24	L22-M26 VanDerWaalsContact O-CG 3.3Å; L22-M26 WeakPolarHBondContact O-CG 3.39Å; L22-M26 PolarHBondContact O-N 2.87Å; L23-M26 HydrophobicContact CG-CE 4.28Å; L23-M26 PolarHBondContact O-N 2.82Å; I24-M26 VanDerWaalsContact C-N 3.29Å; I24-M26 PolarHBondContact O-N 2.79Å
27	V	91.1	Very high	87.8	Confident	43 Å²	43	71 Å²	71	26%	0.261	38%	0.378	S	S	.	.			trans	-135.8	72.1	-175.3	-165.9	0	0	0	0	109.9	L23 I24 E29 L30	L23-V27 PolarHBondContact O-N 2.8Å; I24-V27 CarbonylContact O-C 3.28Å; I24-V27 VanDerWaalsContact O-C 3.3Å; I24-V27 PolarHBondContact O-N 3.3Å; V27-E29 HydrophobicContact CG1-CG 3.63Å; V27-E29 PolarHBondContact O-N 3.11Å; V27-L30 HydrophobicContact CG1-CB 4.19Å; V27-L30 HydrophobicContact CG1-CD1 3.73Å; V27-L30 HydrophobicContact CG1-CG 3.79Å; V27-L30 PolarHBondContact O-N 2.78Å; V27-L30 VanDerWaalsContact O-N 3.08Å
28	P	90.9	Very high	87.9	Confident	85 Å²	85	67.7 Å²	67.7	55%	0.552	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-62.9	-28.7	-172	-22.3	33.2	0	0	0	113.6	I24 L30 C31	I24-P28 WeakPolarHBondContact O-CA 3.35Å; I24-P28 WeakPolarHBondContact O-CG 3.48Å; I24-P28 VanDerWaalsContact O-N 3.08Å; P28-L30 PolarHBondContact O-N 3.25Å; P28-C31 WeakPolarHBondContact O-CB 2.82Å; P28-C31 PolarHBondContact O-N 2.8Å; P28-C31 VanDerWaalsContact O-N 3.07Å
29	E	92.1	Very high	87.6	Confident	167 Å²	167	61.5 Å²	61.5	78%	0.78	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-60.2	-23.2	176.2	61.3	-151.8	-163.8	0	0	114.1	V27	V27-E29 HydrophobicContact CG1-CG 3.63Å; V27-E29 PolarHBondContact O-N 3.11Å
30	L	89.2	Confident	87.5	Confident	36 Å²	36	61.2 Å²	61.2	19%	0.188	34%	0.343	C	S	.	.	G	3₁₀ helix	trans	-98.7	6.3	176.8	-64.6	-180	0	0	0	113.1	V27 P28 Q32 D33 L34	V27-L30 HydrophobicContact CG1-CB 4.19Å; V27-L30 HydrophobicContact CG1-CD1 3.73Å; V27-L30 HydrophobicContact CG1-CG 3.79Å; V27-L30 PolarHBondContact O-N 2.78Å; V27-L30 VanDerWaalsContact O-N 3.08Å; P28-L30 PolarHBondContact O-N 3.25Å; L30-Q32 PolarHBondContact O-N 2.87Å; L30-D33 PolarHBondContact O-N 3.49Å; L30-L34 HydrophobicContact CB-CD1 3.8Å; L30-L34 HydrophobicContact CB-CG 3.93Å; L30-L34 WeakPolarHBondContact O-CB 3.31Å; L30-L34 WeakPolarHBondContact O-CG 3.15Å; L30-L34 PolarHBondContact O-N 2.97Å
31	C	85.7	Confident	87.5	Confident	42 Å²	42	63 Å²	63	28%	0.284	36%	0.355	S	S	.	.	H	α-helix	trans	-51.7	-51	-172.7	179.8	0	0	0	0	113.1	I24 P28 L34 L35	I24-C31 HydrophobicContact CG2-CB 3.96Å; P28-C31 WeakPolarHBondContact O-CB 2.82Å; P28-C31 PolarHBondContact O-N 2.8Å; P28-C31 VanDerWaalsContact O-N 3.07Å; C31-L34 PolarHBondContact O-N 3.1Å; C31-L35 WeakPolarHBondContact O-CG 3.48Å; C31-L35 PolarHBondContact O-N 3.18Å
32	Q	83.9	Confident	87.7	Confident	162 Å²	162	61.9 Å²	61.9	76%	0.757	34%	0.342	S	S	*	.	H	α-helix	trans	-65.9	-44.5	-177.4	-169.7	174.4	2.4	0	0	111.9	L30 L34 A36	L30-Q32 PolarHBondContact O-N 2.87Å; Q32-L34 VanDerWaalsContact C-N 3.34Å; Q32-L34 PolarHBondContact O-N 3.12Å; Q32-A36 WeakPolarHBondContact O-CB 3.31Å; Q32-A36 PolarHBondContact O-N 3.15Å
33	D	86.9	Confident	87.8	Confident	87 Å²	87	62.4 Å²	62.4	47%	0.465	34%	0.34	S	S	.	.	H	α-helix	trans	-63.5	-41.7	178.1	-68.6	-22.8	0	0	0	111.3	M1 L30 A36 A37	M1-D33 HydrophobicContact CE-CB 3.59Å; M1-D33 VanDerWaalsContact CE-O 3.29Å; M1-D33 WeakPolarHBondContact CE-O 3.28Å; M1-D33 HydrophobicContact SD-CB 4.06Å; L30-D33 PolarHBondContact O-N 3.49Å; D33-A36 PolarHBondContact O-N 2.89Å; D33-A37 WeakPolarHBondContact O-CB 3.19Å; D33-A37 PolarHBondContact O-N 3.38Å
34	L	86.8	Confident	88.1	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-66.4	-45	-179.5	-71.1	170.2	0	0	0	111.9	M1 A4 L20 L23 I24 L30 C31 Q32 A36 A37 I38	M1-L34 HydrophobicContact CE-CD2 4.49Å; M1-L34 HydrophobicContact SD-CD2 3.9Å; M1-L34 HydrophobicContact SD-CG 4.43Å; A4-L34 HydrophobicContact CB-CD2 3.61Å; L20-L34 HydrophobicContact CD1-CB 4.06Å; L23-L34 HydrophobicContact CD2-CD1 3.63Å; L23-L34 HydrophobicContact CD2-CD2 3.87Å; L23-L34 HydrophobicContact CD2-CG 4.42Å; I24-L34 HydrophobicContact CG1-CD1 4.38Å; L30-L34 HydrophobicContact CB-CD1 3.8Å; L30-L34 HydrophobicContact CB-CG 3.93Å; L30-L34 WeakPolarHBondContact O-CB 3.31Å; L30-L34 WeakPolarHBondContact O-CG 3.15Å; L30-L34 PolarHBondContact O-N 2.97Å; C31-L34 PolarHBondContact O-N 3.1Å; Q32-L34 VanDerWaalsContact C-N 3.34Å; Q32-L34 PolarHBondContact O-N 3.12Å; L34-A36 VanDerWaalsContact C-N 3.3Å; L34-A36 PolarHBondContact O-N 3.13Å; L34-A37 PolarHBondContact O-N 3.43Å; L34-I38 HydrophobicContact CB-CD1 4.13Å; L34-I38 HydrophobicContact CD2-CD1 3.7Å; L34-I38 VanDerWaalsContact O-CB 3.29Å; L34-I38 WeakPolarHBondContact O-CB 3.43Å; L34-I38 WeakPolarHBondContact O-CG1 3.28Å; L34-I38 PolarHBondContact O-N 2.71Å
35	L	84.3	Confident	88.3	Confident	38 Å²	38	64.5 Å²	64.5	20%	0.199	36%	0.358	C	S	.	.	H	α-helix	trans	-61.3	-40.9	175.4	-71.7	168.7	0	0	0	111.1	L20 I24 C31 A37	L20-L35 HydrophobicContact CD2-CD2 3.98Å; I24-L35 HydrophobicContact CD1-CD2 4.1Å; I24-L35 HydrophobicContact CD1-CG 4.13Å; C31-L35 WeakPolarHBondContact O-CG 3.48Å; C31-L35 PolarHBondContact O-N 3.18Å; L35-A37 PolarHBondContact O-N 2.87Å
36	A	82.9	Confident	88.5	Confident	63 Å²	63	63.5 Å²	63.5	52%	0.521	35%	0.352	S	S	.	.	H	α-helix	trans	-70.6	-29.2	178.4	0	0	0	0	0	113.9	Q32 D33 L34	Q32-A36 WeakPolarHBondContact O-CB 3.31Å; Q32-A36 PolarHBondContact O-N 3.15Å; D33-A36 PolarHBondContact O-N 2.89Å; L34-A36 VanDerWaalsContact C-N 3.3Å; L34-A36 PolarHBondContact O-N 3.13Å
37	A	84.2	Confident	88.8	Confident	49 Å²	49	57.3 Å²	57.3	41%	0.405	32%	0.321	S	S	.	.	H	α-helix	trans	-98.9	-18.1	-173.1	0	0	0	0	0	114.6	M1 L5 D33 L34 L35	M1-A37 HydrophobicContact CE-CB 3.53Å; L5-A37 HydrophobicContact CD2-CB 3.81Å; D33-A37 WeakPolarHBondContact O-CB 3.19Å; D33-A37 PolarHBondContact O-N 3.38Å; L34-A37 PolarHBondContact O-N 3.43Å; L35-A37 PolarHBondContact O-N 2.87Å
38	I	83.7	Confident	88.9	Confident	14 Å²	14	59.6 Å²	59.6	7%	0.072	34%	0.337	C	S	.	.	S	Bend	trans	-111.6	106.3	-174.8	-61.9	161.2	0	0	0	109.3	L5 M8 L20 L34 Q40	L5-I38 HydrophobicContact CD2-CD1 4.05Å; L5-I38 HydrophobicContact CD2-CG1 3.61Å; M8-I38 HydrophobicContact CB-CD1 4.43Å; M8-I38 HydrophobicContact CE-CG2 3.98Å; M8-I38 HydrophobicContact CG-CD1 3.76Å; M8-I38 HydrophobicContact CG-CG1 4.46Å; L20-I38 HydrophobicContact CD1-CB 4.45Å; L20-I38 HydrophobicContact CD1-CD1 3.65Å; L34-I38 HydrophobicContact CB-CD1 4.13Å; L34-I38 HydrophobicContact CD2-CD1 3.7Å; L34-I38 VanDerWaalsContact O-CB 3.29Å; L34-I38 WeakPolarHBondContact O-CB 3.43Å; L34-I38 WeakPolarHBondContact O-CG1 3.28Å; L34-I38 PolarHBondContact O-N 2.71Å; I38-Q40 PolarHBondContact O-N 3.18Å
39	D	82.6	Confident	88.9	Confident	41 Å²	41	60 Å²	60	22%	0.219	34%	0.338	C	S	.	.			trans	-63.5	132.2	173.7	-67.1	-49.8	0	0	0	111	I146 T167 M169	D39-I146 HydrophobicContact CB-CD1 3.89Å; D39-T167 HydrophobicContact CB-CG2 4.19Å; D39-T167 WeakPolarHBondContact OD2-CB 3.31Å; D39-T167 WeakPolarHBondContact OD2-CG2 3.28Å; D39-T167 PolarHBondContact OD2-OG1 3.38Å; D39-M169 VanDerWaalsContact C-CE 3.41Å; D39-M169 HydrophobicContact CB-CE 3.2Å; D39-M169 WeakPolarHBondContact O-CE 3.21Å
40	Q	84.7	Confident	89	Confident	42 Å²	42	56.7 Å²	56.7	20%	0.196	33%	0.325	C	S	.	.			trans	-108.7	153.8	176	-64.5	178	74.6	0	0	110.9	L20 I38 L42	L20-Q40 VanDerWaalsContact CD2-CD 3.42Å; L20-Q40 HydrophobicContact CD2-CG 3.81Å; I38-Q40 PolarHBondContact O-N 3.18Å; Q40-L42 PolarHBondContact O-N 2.9Å
41	P	87.8	Confident	89.2	Confident	41 Å²	41	57.6 Å²	57.6	27%	0.266	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-52.8	135.2	171.3	-25.6	34.9	0	0	0	111.4	K43 M169	P41-K43 PolarHBondContact O-N 2.81Å; P41-M169 HydrophobicContact CG-SD 4.39Å
42	L	92.9	Very high	89.6	Confident	7 Å²	7	60.7 Å²	60.7	4%	0.037	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-70.1	132.9	-174.7	-64.8	172.8	0	0	0	110.6	Q40 L55 C57 L128 K130 D144 I146	Q40-L42 PolarHBondContact O-N 2.9Å; L42-L55 HydrophobicContact CB-CD2 4.42Å; L42-L55 HydrophobicContact CD1-CD1 4.18Å; L42-C57 HydrophobicContact CD2-CB 4.23Å; L42-L128 HydrophobicContact CD1-CB 4.07Å; L42-L128 HydrophobicContact CD2-CD1 4.14Å; L42-L128 HydrophobicContact CD2-CD2 4.2Å; L42-K130 HydrophobicContact CB-CD 4.24Å; L42-K130 HydrophobicContact CD1-CB 4.49Å; L42-K130 WeakPolarHBondContact O-CD 3.24Å; L42-K130 VanDerWaalsContact O-CE 3.23Å; L42-K130 WeakPolarHBondContact O-CE 3.18Å; L42-K130 PolarHBondContact O-NZ 3.36Å; L42-D144 HydrophobicContact CD1-CB 4.08Å; L42-D144 HydrophobicContact CG-CB 4.21Å; L42-D144 PolarHBondContact N-OD2 3.09Å; L42-I146 HydrophobicContact CD1-CG1 4.15Å; L42-I146 HydrophobicContact CD2-CD1 4.09Å; L42-I146 HydrophobicContact CD2-CG1 4.05Å; L42-I146 HydrophobicContact CG-CD1 4.37Å; L42-I146 HydrophobicContact CG-CG1 4.21Å
43	K	92.2	Very high	90.2	Very high	94 Å²	94	58.1 Å²	58.1	41%	0.409	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	152.6	174.5	-63.4	176.9	-179.1	178.1	0	110.2	E17 P41 L55 L56	E17-K43 VanDerWaalsContact CD-NZ 3.27Å; E17-K43 WeakPolarHBondContact OE1-CE 3.33Å; E17-K43 IonicContact OE1-NZ 2.82Å; E17-K43 PolarHBondContact OE1-NZ 3.46Å; E17-K43 WeakPolarHBondContact OE2-CE 3.41Å; E17-K43 IonicContact OE2-NZ 2.72Å; E17-K43 PolarHBondContact OE2-NZ 3.5Å; P41-K43 PolarHBondContact O-N 2.81Å; K43-L55 CarbonylContact O-C 3.58Å; K43-L55 WeakPolarHBondContact O-CA 3.4Å; K43-L56 HydrophobicContact CB-CB 4.1Å; K43-L56 HydrophobicContact CB-CD1 4.08Å; K43-L56 HydrophobicContact CB-CG 4.23Å; K43-L56 PolarHBondContact O-N 3.06Å
44	V	94.8	Very high	90.7	Very high	62 Å²	62	54 Å²	54	38%	0.376	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	133.9	178.3	-178.7	0	0	0	0	108.9	E53 L55 I111 K130	V44-E53 HydrophobicContact CG1-CB 4.07Å; V44-E53 HydrophobicContact CG1-CG 4.27Å; V44-L55 HydrophobicContact CG2-CD2 4.04Å; V44-I111 HydrophobicContact CB-CD1 4.18Å; V44-I111 HydrophobicContact CG1-CD1 3.48Å; V44-I111 VanDerWaalsContact CG1-CD1 3.48Å; V44-I111 HydrophobicContact CG2-CD1 3.56Å; V44-K130 HydrophobicContact CG2-CD 3.87Å
45	A	95.5	Very high	91.2	Very high	26 Å²	26	54 Å²	54	22%	0.215	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	160.5	168	0	0	0	0	0	110.3	E53 F54 L56	A45-E53 CarbonylContact O-C 3.3Å; A45-E53 VanDerWaalsContact O-CA 3.28Å; A45-E53 WeakPolarHBondContact O-CA 3.47Å; A45-F54 HydrophobicContact CB-CD1 4.22Å; A45-F54 HydrophobicContact CB-CE1 3.69Å; A45-F54 HydrophobicContact CB-CE2 4.09Å; A45-F54 HydrophobicContact CB-CZ 3.63Å; A45-F54 PolarHBondContact N-O 3.3Å; A45-F54 WeakPolarHBondContact O-CD1 3.23Å; A45-F54 PolarHBondContact O-N 3.31Å; A45-L56 HydrophobicContact CB-CD1 4.09Å; A45-L56 HydrophobicContact CB-CD2 3.58Å; A45-L56 HydrophobicContact CB-CG 3.97Å
46	L	96.3	Very high	91.7	Very high	104 Å²	104	53.5 Å²	53.5	55%	0.545	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	131.1	174.4	-173.1	75.3	0	0	0	109	P48 E53	L46-P48 WeakPolarHBondContact O-CD 3.44Å; L46-E53 HydrophobicContact CD1-CG 4Å
47	D	95.5	Very high	92.2	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	109.2	167.1	-176.1	-27.8	0	0	0	109	T49 L50 G51 K52 F54 S68 S71 F75	D47-T49 PolarHBondContact O-N 2.88Å; D47-T49 WeakPolarHBondContact OD1-CA 3.46Å; D47-T49 VanDerWaalsContact OD1-CB 3.24Å; D47-T49 WeakPolarHBondContact OD1-CB 3.43Å; D47-T49 PolarHBondContact OD1-N 3.41Å; D47-L50 PolarHBondContact O-N 3.48Å; D47-L50 PolarHBondContact OD1-N 3.24Å; D47-G51 VanDerWaalsContact O-CA 3.25Å; D47-G51 WeakPolarHBondContact O-CA 3.27Å; D47-G51 PolarHBondContact O-N 3.23Å; D47-K52 VanDerWaalsContact CB-O 3.31Å; D47-K52 WeakPolarHBondContact CB-O 3.44Å; D47-K52 PolarHBondContact N-O 2.91Å; D47-F54 HydrophobicContact CB-CD1 4.15Å; D47-F54 HydrophobicContact CB-CE1 4.2Å; D47-S68 VanDerWaalsContact OD2-CB 3.24Å; D47-S68 WeakPolarHBondContact OD2-CB 3.2Å; D47-S68 PolarHBondContact OD2-OG 3.31Å; D47-S71 PolarHBondContact OD1-OG 3.43Å; D47-S71 WeakPolarHBondContact OD2-CB 3.18Å; D47-S71 PolarHBondContact OD2-N 2.96Å; D47-S71 PolarHBondContact OD2-OG 3.28Å; D47-F75 HydrophobicContact CB-CE2 4.44Å; D47-F75 WeakPolarHBondContact OD1-CZ 3.29Å
48	P	93.4	Very high	92.4	Very high	91 Å²	91	51.3 Å²	51.3	59%	0.591	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-18.9	-178.6	29.4	-37.3	0	0	0	113.6	L46 F75	L46-P48 WeakPolarHBondContact O-CD 3.44Å; P48-F75 VanDerWaalsContact CD-CE1 3.41Å; P48-F75 HydrophobicContact CG-CD1 3.63Å; P48-F75 HydrophobicContact CG-CE1 3.22Å; P48-F75 HydrophobicContact CG-CG 4.48Å; P48-F75 HydrophobicContact CG-CZ 3.77Å
49	T	92.3	Very high	92.8	Very high	95 Å²	95	54.1 Å²	54.1	58%	0.583	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-39.8	-179.4	-52.8	0	0	0	0	111.3	D47	D47-T49 PolarHBondContact O-N 2.88Å; D47-T49 WeakPolarHBondContact OD1-CA 3.46Å; D47-T49 VanDerWaalsContact OD1-CB 3.24Å; D47-T49 WeakPolarHBondContact OD1-CB 3.43Å; D47-T49 PolarHBondContact OD1-N 3.41Å
50	L	93	Very high	93.4	Very high	97 Å²	97	52.3 Å²	52.3	51%	0.508	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.3	-7.4	-174.6	-68.1	172.4	0	0	0	114	D47 K52 W70	D47-L50 PolarHBondContact O-N 3.48Å; D47-L50 PolarHBondContact OD1-N 3.24Å; L50-K52 VanDerWaalsContact C-N 3.27Å; L50-K52 PolarHBondContact O-N 3.07Å; L50-W70 HydrophobicContact CD1-CB 3.54Å
51	G	93.5	Very high	93.8	Very high	55 Å²	55	54.2 Å²	54.2	57%	0.567	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	26.4	-178.6	0	0	0	0	0	113.8	D47	D47-G51 VanDerWaalsContact O-CA 3.25Å; D47-G51 WeakPolarHBondContact O-CA 3.27Å; D47-G51 PolarHBondContact O-N 3.23Å
52	K	94.7	Very high	93.9	Very high	107 Å²	107	54.5 Å²	54.5	47%	0.465	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	139.8	-178.1	-70.5	-169.4	175.4	-168.8	0	111.5	D47 L50 W70	D47-K52 VanDerWaalsContact CB-O 3.31Å; D47-K52 WeakPolarHBondContact CB-O 3.44Å; D47-K52 PolarHBondContact N-O 2.91Å; L50-K52 VanDerWaalsContact C-N 3.27Å; L50-K52 PolarHBondContact O-N 3.07Å; K52-W70 HydrophobicContact CB-CD2 4.39Å; K52-W70 HydrophobicContact CB-CG 4.01Å; K52-W70 HydrophobicContact CD-CD2 4Å; K52-W70 HydrophobicContact CD-CE3 4.35Å; K52-W70 HydrophobicContact CD-CG 4.12Å
53	E	96.7	Very high	93.7	Very high	108 Å²	108	56.5 Å²	56.5	51%	0.505	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	147.4	175.7	-63.2	-179.3	130.2	0	0	111.3	V44 A45 L46 W70 I111	V44-E53 HydrophobicContact CG1-CB 4.07Å; V44-E53 HydrophobicContact CG1-CG 4.27Å; A45-E53 CarbonylContact O-C 3.3Å; A45-E53 VanDerWaalsContact O-CA 3.28Å; A45-E53 WeakPolarHBondContact O-CA 3.47Å; L46-E53 HydrophobicContact CD1-CG 4Å; E53-W70 PolarHBondContact O-NE1 2.77Å; E53-I111 HydrophobicContact CB-CD1 3.96Å; E53-I111 HydrophobicContact CB-CG1 4.33Å; E53-I111 HydrophobicContact CB-CG2 4.36Å; E53-I111 WeakPolarHBondContact OE2-CD1 3.14Å
54	F	97.6	Very high	93.6	Very high	1 Å²	1	58 Å²	58	0%	0.004	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	161.5	174.9	68.9	-82.9	0	0	0	111.3	A45 D47 L56 P69 F75 S113 Y115	A45-F54 HydrophobicContact CB-CD1 4.22Å; A45-F54 HydrophobicContact CB-CE1 3.69Å; A45-F54 HydrophobicContact CB-CE2 4.09Å; A45-F54 HydrophobicContact CB-CZ 3.63Å; A45-F54 PolarHBondContact N-O 3.3Å; A45-F54 WeakPolarHBondContact O-CD1 3.23Å; A45-F54 PolarHBondContact O-N 3.31Å; D47-F54 HydrophobicContact CB-CD1 4.15Å; D47-F54 HydrophobicContact CB-CE1 4.2Å; F54-L56 HydrophobicContact CD2-CD2 3.84Å; F54-L56 HydrophobicContact CE2-CD2 3.31Å; F54-L56 HydrophobicContact CZ-CD2 3.99Å; F54-P69 VanDerWaalsContact CB-CD 3.48Å; F54-P69 HydrophobicContact CB-CG 3.92Å; F54-F75 HydrophobicContact CE1-CD2 4.38Å; F54-F75 HydrophobicContact CZ-CD2 4.2Å; F54-S113 WeakPolarHBondContact CA-OG 3.38Å; F54-Y115 VanDerWaalsContact CD2-OH 3.32Å; F54-Y115 WeakPolarHBondContact CD2-OH 3.49Å
55	L	97.4	Very high	93.6	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	135.5	-175.4	-61.3	172.1	0	0	0	111.5	L42 K43 V44 I111 S113 Y115 L128 K130	L42-L55 HydrophobicContact CB-CD2 4.42Å; L42-L55 HydrophobicContact CD1-CD1 4.18Å; K43-L55 CarbonylContact O-C 3.58Å; K43-L55 WeakPolarHBondContact O-CA 3.4Å; V44-L55 HydrophobicContact CG2-CD2 4.04Å; L55-I111 HydrophobicContact CD1-CG2 4.38Å; L55-I111 HydrophobicContact CD2-CB 4.1Å; L55-I111 HydrophobicContact CD2-CG2 3.99Å; L55-I111 HydrophobicContact CG-CB 4.33Å; L55-I111 HydrophobicContact CG-CG2 3.85Å; L55-S113 PolarHBondContact N-OG 3.25Å; L55-Y115 WeakPolarHBondContact O-CE2 3.39Å; L55-Y115 PolarHBondContact O-OH 3.11Å; L55-L128 HydrophobicContact CB-CB 4.19Å; L55-L128 HydrophobicContact CB-CD1 3.96Å; L55-L128 HydrophobicContact CD1-CB 3.68Å; L55-K130 HydrophobicContact CD1-CB 3.99Å; L55-K130 HydrophobicContact CD2-CB 3.59Å; L55-K130 HydrophobicContact CD2-CD 4.04Å; L55-K130 HydrophobicContact CD2-CG 4.43Å; L55-K130 HydrophobicContact CG-CB 4.46Å
56	L	94.9	Very high	93.6	Very high	26 Å²	26	56.5 Å²	56.5	14%	0.136	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	132.9	177.4	-49	-173.2	0	0	0	110.3	K43 A45 F54 Y66	K43-L56 HydrophobicContact CB-CB 4.1Å; K43-L56 HydrophobicContact CB-CD1 4.08Å; K43-L56 HydrophobicContact CB-CG 4.23Å; K43-L56 PolarHBondContact O-N 3.06Å; A45-L56 HydrophobicContact CB-CD1 4.09Å; A45-L56 HydrophobicContact CB-CD2 3.58Å; A45-L56 HydrophobicContact CB-CG 3.97Å; F54-L56 HydrophobicContact CD2-CD2 3.84Å; F54-L56 HydrophobicContact CE2-CD2 3.31Å; F54-L56 HydrophobicContact CZ-CD2 3.99Å; L56-Y66 HydrophobicContact CB-CD1 3.91Å; L56-Y66 HydrophobicContact CB-CE1 3.88Å; L56-Y66 HydrophobicContact CB-CG 4.46Å; L56-Y66 HydrophobicContact CD1-CD1 4.48Å; L56-Y66 HydrophobicContact CD1-CD2 4.17Å; L56-Y66 HydrophobicContact CD1-CE1 4.48Å; L56-Y66 HydrophobicContact CD1-CE2 4.19Å; L56-Y66 HydrophobicContact CD1-CG 4.31Å; L56-Y66 HydrophobicContact CD2-CD1 3.85Å; L56-Y66 HydrophobicContact CD2-CD2 4.27Å; L56-Y66 HydrophobicContact CD2-CG 3.67Å; L56-Y66 HydrophobicContact CG-CD1 4.31Å; L56-Y66 HydrophobicContact CG-CG 4.37Å
57	C	91.7	Very high	93.7	Very high	18 Å²	18	52 Å²	52	12%	0.122	29%	0.289	C	S	.	.			trans	-149.3	177.2	168.4	67	0	0	0	0	109.5	L42 Y59 N60 L128	L42-C57 HydrophobicContact CD2-CB 4.23Å; C57-Y59 HydrophobicContact CB-CD2 4.36Å; C57-Y59 PolarHBondContact O-N 3.31Å; C57-Y59 PolarHBondContact SG-N 3.05Å; C57-Y59 VanDerWaalsContact SG-N 3.43Å; C57-N60 PolarHBondContact N-OD1 2.98Å; C57-N60 PolarHBondContact O-N 3.43Å; C57-N60 PolarHBondContact O-OD1 3.38Å; C57-L128 HydrophobicContact CB-CD1 3.97Å; C57-L128 WeakPolarHBondContact SG-CD1 3.42Å
58	D	89.4	Confident	93.8	Very high	49 Å²	49	52 Å²	52	26%	0.262	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-68.9	-21.1	177.4	-68.6	-52.3	0	0	0	112.5	N60 R61	D58-N60 VanDerWaalsContact C-N 3.33Å; D58-N60 PolarHBondContact O-N 3.35Å; D58-R61 PolarHBondContact O-N 3.29Å; D58-R61 IonicContact OD1-NH1 3.4Å
59	Y	91.7	Very high	93.9	Very high	73 Å²	73	47.8 Å²	47.8	29%	0.286	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-74.2	-16.6	179.8	-52.8	-68.4	0	0	0	114.8	C57 W117 A126 I146 V148	C57-Y59 HydrophobicContact CB-CD2 4.36Å; C57-Y59 PolarHBondContact O-N 3.31Å; C57-Y59 PolarHBondContact SG-N 3.05Å; C57-Y59 VanDerWaalsContact SG-N 3.43Å; Y59-W117 AromaticContact CD1-CH2 3.59Å; Y59-W117 HydrophobicContact CD1-CH2 3.59Å; Y59-W117 HydrophobicContact CD1-CZ2 4.13Å; Y59-W117 HydrophobicContact CD1-CZ3 4.12Å; Y59-W117 HydrophobicContact CE1-CH2 4.25Å; Y59-W117 AromaticContact CG-CH2 3.99Å; Y59-W117 HydrophobicContact CG-CH2 3.99Å; Y59-W117 HydrophobicContact CG-CZ3 4.14Å; Y59-A126 HydrophobicContact CD2-CB 3.65Å; Y59-A126 HydrophobicContact CE2-CB 4.43Å; Y59-A126 HydrophobicContact CG-CB 3.91Å; Y59-I146 HydrophobicContact CE2-CG2 4.42Å; Y59-V148 HydrophobicContact CD2-CG2 4.47Å; Y59-V148 HydrophobicContact CE1-CG2 4.39Å; Y59-V148 HydrophobicContact CE2-CG2 3.61Å; Y59-V148 WeakPolarHBondContact OH-CG2 3.49Å
60	N	94.5	Very high	94.1	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.011	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-115.1	12.3	173.1	77.9	-46.2	0	0	0	113	C57 D58 Y66 R67 Y115	C57-N60 PolarHBondContact N-OD1 2.98Å; C57-N60 PolarHBondContact O-N 3.43Å; C57-N60 PolarHBondContact O-OD1 3.38Å; D58-N60 VanDerWaalsContact C-N 3.33Å; D58-N60 PolarHBondContact O-N 3.35Å; N60-Y66 CarbonylContact O-C 3.56Å; N60-Y66 WeakPolarHBondContact O-CA 3.11Å; N60-R67 PolarHBondContact ND2-O 3.28Å; N60-R67 PolarHBondContact O-N 3.37Å; N60-Y115 HydrophobicContact CB-CD1 3.55Å; N60-Y115 HydrophobicContact CB-CD2 3.68Å; N60-Y115 HydrophobicContact CB-CE1 3.6Å; N60-Y115 HydrophobicContact CB-CE2 3.7Å; N60-Y115 HydrophobicContact CB-CG 3.59Å; N60-Y115 PolarHBondContact ND2-OH 3.05Å; N60-Y115 VanDerWaalsContact ND2-OH 3.14Å
61	R	93	Very high	94.2	Very high	83 Å²	83	42.1 Å²	42.1	31%	0.313	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	139	-178.8	-172	-178.3	177	-169.7	-3.4	110.7	D58 G63 D64 S65 Y66	D58-R61 PolarHBondContact O-N 3.29Å; D58-R61 IonicContact OD1-NH1 3.4Å; R61-G63 WeakPolarHBondContact CG-O 3.43Å; R61-G63 PolarHBondContact NE-O 2.93Å; R61-G63 PolarHBondContact NH2-O 2.9Å; R61-D64 IonicContact NH2-OD1 2.79Å; R61-D64 PolarHBondContact NH2-OD1 3.08Å; R61-S65 CarbonylContact C-O 3.44Å; R61-S65 WeakPolarHBondContact CA-O 3.23Å; R61-Y66 HydrophobicContact CB-CD1 3.86Å; R61-Y66 HydrophobicContact CB-CE1 3.63Å; R61-Y66 HydrophobicContact CG-CD1 4.15Å; R61-Y66 HydrophobicContact CG-CE1 3.7Å; R61-Y66 HydrophobicContact CG-CE2 4.47Å
62	D	91	Very high	94.4	Very high	46 Å²	46	40.7 Å²	40.7	25%	0.246	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	116	166.7	-165.4	-13.3	0	0	0	109	D64 S65 Y74 L78 G81 V82	D62-D64 PolarHBondContact O-N 3.39Å; D62-D64 VanDerWaalsContact O-N 3.15Å; D62-S65 PolarHBondContact N-O 2.96Å; D62-S65 PolarHBondContact O-N 3.18Å; D62-Y74 HydrophobicContact CB-CD1 4.27Å; D62-Y74 HydrophobicContact CB-CE1 3.47Å; D62-Y74 VanDerWaalsContact CB-CE1 3.47Å; D62-L78 HydrophobicContact CB-CD2 4.13Å; D62-G81 WeakPolarHBondContact OD2-CA 3.33Å; D62-V82 PolarHBondContact OD2-N 2.99Å; D62-V82 VanDerWaalsContact OD2-N 3.09Å
63	G	88.7	Confident	94.4	Very high	49 Å²	49	38.3 Å²	38.3	51%	0.505	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.3	-116.6	-166.7	0	0	0	0	0	111.3	R61	R61-G63 WeakPolarHBondContact CG-O 3.43Å; R61-G63 PolarHBondContact NE-O 2.93Å; R61-G63 PolarHBondContact NH2-O 2.9Å
64	D	90.2	Very high	94.4	Very high	126 Å²	126	33.8 Å²	33.8	67%	0.674	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.4	13.9	175.9	-64.9	-39.3	0	0	0	113.2	R61 D62	R61-D64 IonicContact NH2-OD1 2.79Å; R61-D64 PolarHBondContact NH2-OD1 3.08Å; D62-D64 PolarHBondContact O-N 3.39Å; D62-D64 VanDerWaalsContact O-N 3.15Å
65	S	94.3	Very high	94.2	Very high	8 Å²	8	35.8 Å²	35.8	6%	0.056	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	148.1	-178.4	-55	0	0	0	0	111.2	R61 D62 F75 P76	R61-S65 CarbonylContact C-O 3.44Å; R61-S65 WeakPolarHBondContact CA-O 3.23Å; D62-S65 PolarHBondContact N-O 2.96Å; D62-S65 PolarHBondContact O-N 3.18Å; S65-F75 WeakPolarHBondContact CA-O 3.15Å; S65-P76 VanDerWaalsContact CB-O 3.23Å; S65-P76 WeakPolarHBondContact CB-O 3.16Å; S65-P76 PolarHBondContact OG-O 3.38Å
66	Y	96.3	Very high	94.1	Very high	49 Å²	49	39.6 Å²	39.6	19%	0.192	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	131.5	-179.7	-65	-93	0	0	0	111.5	L56 N60 R61 Y74 F75	L56-Y66 HydrophobicContact CB-CD1 3.91Å; L56-Y66 HydrophobicContact CB-CE1 3.88Å; L56-Y66 HydrophobicContact CB-CG 4.46Å; L56-Y66 HydrophobicContact CD1-CD1 4.48Å; L56-Y66 HydrophobicContact CD1-CD2 4.17Å; L56-Y66 HydrophobicContact CD1-CE1 4.48Å; L56-Y66 HydrophobicContact CD1-CE2 4.19Å; L56-Y66 HydrophobicContact CD1-CG 4.31Å; L56-Y66 HydrophobicContact CD2-CD1 3.85Å; L56-Y66 HydrophobicContact CD2-CD2 4.27Å; L56-Y66 HydrophobicContact CD2-CG 3.67Å; L56-Y66 HydrophobicContact CG-CD1 4.31Å; L56-Y66 HydrophobicContact CG-CG 4.37Å; N60-Y66 CarbonylContact O-C 3.56Å; N60-Y66 WeakPolarHBondContact O-CA 3.11Å; R61-Y66 HydrophobicContact CB-CD1 3.86Å; R61-Y66 HydrophobicContact CB-CE1 3.63Å; R61-Y66 HydrophobicContact CG-CD1 4.15Å; R61-Y66 HydrophobicContact CG-CE1 3.7Å; R61-Y66 HydrophobicContact CG-CE2 4.47Å; Y66-Y74 CarbonylContact O-C 3.53Å; Y66-Y74 WeakPolarHBondContact O-CA 3.46Å; Y66-F75 PolarHBondContact N-O 3.46Å; Y66-F75 PolarHBondContact O-N 2.93Å
67	R	97.1	Very high	94	Very high	9 Å²	9	44 Å²	44	3%	0.034	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	124.7	177.8	-167.1	167.8	60.2	82.2	2.8	110.1	N60 N72 Y74 E92 Y115	N60-R67 PolarHBondContact ND2-O 3.28Å; N60-R67 PolarHBondContact O-N 3.37Å; R67-N72 PolarHBondContact NH1-OD1 2.73Å; R67-Y74 HydrophobicContact CB-CD1 4.06Å; R67-Y74 HydrophobicContact CB-CD2 4.25Å; R67-Y74 HydrophobicContact CB-CE1 3.72Å; R67-Y74 HydrophobicContact CB-CE2 3.9Å; R67-Y74 HydrophobicContact CB-CG 4.33Å; R67-Y74 HydrophobicContact CG-CD2 4.32Å; R67-Y74 HydrophobicContact CG-CE2 4Å; R67-E92 IonicContact CZ-OE1 3.95Å; R67-E92 IonicContact CZ-OE2 3.58Å; R67-E92 IonicContact NH1-OE1 3.43Å; R67-E92 PolarHBondContact NH1-OE1 3.11Å; R67-E92 VanDerWaalsContact NH1-OE1 3.09Å; R67-E92 IonicContact NH1-OE2 2.58Å; R67-E92 PolarHBondContact NH1-OE2 3.34Å; R67-E92 IonicContact NH2-OE1 3.82Å; R67-E92 PolarHBondContact NH2-OE1 2.93Å; R67-E92 IonicContact NH2-OE2 3.79Å; R67-Y115 VanDerWaalsContact O-CE1 3.28Å; R67-Y115 WeakPolarHBondContact O-CE1 2.92Å
68	S	97.3	Very high	94	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.254	C	S	.	.			trans	-75.5	135.4	170	169.4	0	0	0	0	110.6	D47 W70 S71 N72 T73	D47-S68 VanDerWaalsContact OD2-CB 3.24Å; D47-S68 WeakPolarHBondContact OD2-CB 3.2Å; D47-S68 PolarHBondContact OD2-OG 3.31Å; S68-W70 PolarHBondContact O-N 3.01Å; S68-W70 PolarHBondContact OG-N 2.95Å; S68-W70 VanDerWaalsContact OG-N 3.11Å; S68-S71 WeakPolarHBondContact CB-OG 3.27Å; S68-N72 VanDerWaalsContact O-CA 3.28Å; S68-N72 WeakPolarHBondContact O-CA 3.34Å; S68-N72 PolarHBondContact O-N 3.45Å; S68-N72 VanDerWaalsContact O-N 3.09Å; S68-T73 PolarHBondContact N-O 2.93Å
69	P	97.3	Very high	93.8	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.013	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-15.6	175	31.6	-32.2	0	0	0	111.6	F54 R89 Y115	F54-P69 VanDerWaalsContact CB-CD 3.48Å; F54-P69 HydrophobicContact CB-CG 3.92Å; P69-R89 VanDerWaalsContact O-CZ 3.27Å; P69-R89 PolarHBondContact O-NH1 3.46Å; P69-R89 PolarHBondContact O-NH2 3.1Å; P69-Y115 HydrophobicContact CB-CD1 4.31Å; P69-Y115 HydrophobicContact CB-CE1 3.76Å; P69-Y115 HydrophobicContact CG-CE1 3.94Å
70	W	96.6	Very high	93.7	Very high	45 Å²	45	57 Å²	57	17%	0.17	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-60.1	-175.6	-46	118.9	0	0	0	111.8	L50 K52 E53 S68 R89 N96	L50-W70 HydrophobicContact CD1-CB 3.54Å; K52-W70 HydrophobicContact CB-CD2 4.39Å; K52-W70 HydrophobicContact CB-CG 4.01Å; K52-W70 HydrophobicContact CD-CD2 4Å; K52-W70 HydrophobicContact CD-CE3 4.35Å; K52-W70 HydrophobicContact CD-CG 4.12Å; E53-W70 PolarHBondContact O-NE1 2.77Å; S68-W70 PolarHBondContact O-N 3.01Å; S68-W70 PolarHBondContact OG-N 2.95Å; S68-W70 VanDerWaalsContact OG-N 3.11Å; W70-R89 PolarHBondContact O-NH2 3.49Å; W70-R89 VanDerWaalsContact O-NH2 3.17Å; W70-N96 HydrophobicContact CH2-CB 4.47Å; W70-N96 HydrophobicContact CZ3-CB 4.07Å
71	S	95.3	Very high	93.3	Very high	28 Å²	28	57.6 Å²	57.6	20%	0.196	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-14.5	-179.2	52.2	0	0	0	0	113.9	D47 S68 T73	D47-S71 PolarHBondContact OD1-OG 3.43Å; D47-S71 WeakPolarHBondContact OD2-CB 3.18Å; D47-S71 PolarHBondContact OD2-N 2.96Å; D47-S71 PolarHBondContact OD2-OG 3.28Å; S68-S71 WeakPolarHBondContact CB-OG 3.27Å; S71-T73 PolarHBondContact O-N 3.4Å; S71-T73 PolarHBondContact OG-N 3.28Å; S71-T73 PolarHBondContact OG-OG1 2.73Å
72	N	95.9	Very high	93.3	Very high	25 Å²	25	58.6 Å²	58.6	13%	0.134	33%	0.331	C	S	.	.			trans	59.9	21.8	-169.1	-155.1	40.1	0	0	0	114.1	R67 S68 Q83	R67-N72 PolarHBondContact NH1-OD1 2.73Å; S68-N72 VanDerWaalsContact O-CA 3.28Å; S68-N72 WeakPolarHBondContact O-CA 3.34Å; S68-N72 PolarHBondContact O-N 3.45Å; S68-N72 VanDerWaalsContact O-N 3.09Å; N72-Q83 PolarHBondContact ND2-OE1 3.46Å
73	T	95.1	Very high	93.3	Very high	57 Å²	57	61.7 Å²	61.7	35%	0.35	34%	0.344	S	S	.	.			trans	-109.9	151.9	178.2	57.8	0	0	0	0	111.5	S68 S71 F75	S68-T73 PolarHBondContact N-O 2.93Å; S71-T73 PolarHBondContact O-N 3.4Å; S71-T73 PolarHBondContact OG-N 3.28Å; S71-T73 PolarHBondContact OG-OG1 2.73Å; T73-F75 WeakPolarHBondContact O-CE2 3.4Å; T73-F75 VanDerWaalsContact OG1-CE2 3.32Å; T73-F75 WeakPolarHBondContact OG1-CE2 3.35Å; T73-F75 WeakPolarHBondContact OG1-CZ 3.42Å
74	Y	96.3	Very high	93.6	Very high	14 Å²	14	60 Å²	60	6%	0.055	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	143.7	176.2	-81.5	-90.3	0	0	0	111.8	D62 Y66 R67 P76 P77 L78 V82	D62-Y74 HydrophobicContact CB-CD1 4.27Å; D62-Y74 HydrophobicContact CB-CE1 3.47Å; D62-Y74 VanDerWaalsContact CB-CE1 3.47Å; Y66-Y74 CarbonylContact O-C 3.53Å; Y66-Y74 WeakPolarHBondContact O-CA 3.46Å; R67-Y74 HydrophobicContact CB-CD1 4.06Å; R67-Y74 HydrophobicContact CB-CD2 4.25Å; R67-Y74 HydrophobicContact CB-CE1 3.72Å; R67-Y74 HydrophobicContact CB-CE2 3.9Å; R67-Y74 HydrophobicContact CB-CG 4.33Å; R67-Y74 HydrophobicContact CG-CD2 4.32Å; R67-Y74 HydrophobicContact CG-CE2 4Å; Y74-P76 CarbonylContact C-O 3.47Å; Y74-P76 CarbonylContact O-C 3.6Å; Y74-P77 WeakPolarHBondContact O-CA 3.43Å; Y74-L78 HydrophobicContact CG-CB 4.29Å; Y74-V82 PolarHBondContact OH-O 2.83Å
75	F	94.2	Very high	93.9	Very high	42 Å²	42	57.4 Å²	57.4	18%	0.184	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	118.2	174.6	-59.8	-72.3	0	0	0	110.4	D47 P48 F54 S65 Y66 T73	D47-F75 HydrophobicContact CB-CE2 4.44Å; D47-F75 WeakPolarHBondContact OD1-CZ 3.29Å; P48-F75 VanDerWaalsContact CD-CE1 3.41Å; P48-F75 HydrophobicContact CG-CD1 3.63Å; P48-F75 HydrophobicContact CG-CE1 3.22Å; P48-F75 HydrophobicContact CG-CG 4.48Å; P48-F75 HydrophobicContact CG-CZ 3.77Å; F54-F75 HydrophobicContact CE1-CD2 4.38Å; F54-F75 HydrophobicContact CZ-CD2 4.2Å; S65-F75 WeakPolarHBondContact CA-O 3.15Å; Y66-F75 PolarHBondContact N-O 3.46Å; Y66-F75 PolarHBondContact O-N 2.93Å; T73-F75 WeakPolarHBondContact O-CE2 3.4Å; T73-F75 VanDerWaalsContact OG1-CE2 3.32Å; T73-F75 WeakPolarHBondContact OG1-CE2 3.35Å; T73-F75 WeakPolarHBondContact OG1-CZ 3.42Å
76	P	94.3	Very high	93.9	Very high	80 Å²	80	64.5 Å²	64.5	52%	0.519	35%	0.345	S	S	.	.	S	Bend	cis	-55	161.7	-8.4	-24.1	35.6	0	0	0	114.4	S65 Y74 L78	S65-P76 VanDerWaalsContact CB-O 3.23Å; S65-P76 WeakPolarHBondContact CB-O 3.16Å; S65-P76 PolarHBondContact OG-O 3.38Å; Y74-P76 CarbonylContact C-O 3.47Å; Y74-P76 CarbonylContact O-C 3.6Å; P76-L78 PolarHBondContact O-N 3.36Å
77	P	93.4	Very high	93.7	Very high	120 Å²	120	68.9 Å²	68.9	78%	0.779	36%	0.361	S	S	*	.			trans	-59.3	135.5	179.9	-24.1	34.4	0	0	0	112.2	Y74	Y74-P77 WeakPolarHBondContact O-CA 3.43Å
78	L	92.1	Very high	93.6	Very high	68 Å²	68	68.8 Å²	68.8	36%	0.356	36%	0.362	S	S	.	.			trans	-133.1	128.7	178.9	-159.5	95.7	0	0	0	108.5	D62 Y74 P76	D62-L78 HydrophobicContact CB-CD2 4.13Å; Y74-L78 HydrophobicContact CG-CB 4.29Å; P76-L78 PolarHBondContact O-N 3.36Å
79	E	85.3	Confident	93.6	Very high	194 Å²	194	70.2 Å²	70.2	91%	0.907	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-40.2	-176.3	-71.2	-174.4	164	0	0	112.5
80	D	88.7	Confident	93.5	Very high	151 Å²	151	77.4 Å²	77.4	81%	0.807	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	33.6	-173.3	-64.9	-32.6	0	0	0	113.2
81	G	87.8	Confident	93.5	Very high	14 Å²	14	76 Å²	76	14%	0.144	39%	0.389	C	S	.	.			trans	-69.3	139.5	-177.5	0	0	0	0	0	113	D62 Q83	D62-G81 WeakPolarHBondContact OD2-CA 3.33Å; G81-Q83 PolarHBondContact O-N 2.94Å; G81-Q83 VanDerWaalsContact O-N 3.16Å
82	V	91.2	Very high	93.6	Very high	103 Å²	103	74.6 Å²	74.6	62%	0.624	38%	0.38	S	S	*	.			trans	-61	118.5	176.5	-178.7	0	0	0	0	110.5	D62 Y74	D62-V82 PolarHBondContact OD2-N 2.99Å; D62-V82 VanDerWaalsContact OD2-N 3.09Å; Y74-V82 PolarHBondContact OH-O 2.83Å
83	Q	92.2	Very high	93.7	Very high	111 Å²	111	77 Å²	77	52%	0.519	39%	0.392	S	S	.	.			trans	-117.3	143.8	177.1	-66.4	-167.7	7	0	0	111.5	N72 G81	N72-Q83 PolarHBondContact ND2-OE1 3.46Å; G81-Q83 PolarHBondContact O-N 2.94Å; G81-Q83 VanDerWaalsContact O-N 3.16Å
84	P	94.9	Very high	93.7	Very high	14 Å²	14	78.9 Å²	78.9	9%	0.091	40%	0.397	C	S	.	.			trans	-65.2	152.5	173.2	27.3	-33.2	0	0	0	111	L88 R89 D118	P84-L88 HydrophobicContact CB-CB 4.14Å; P84-L88 HydrophobicContact CB-CD2 4.06Å; P84-L88 HydrophobicContact CB-CG 4.21Å; P84-R89 HydrophobicContact CG-CB 4.11Å; P84-D118 WeakPolarHBondContact CA-OD2 3.29Å
85	T	95.4	Very high	93.8	Very high	72 Å²	72	78.4 Å²	78.4	44%	0.442	40%	0.395	S	S	.	.			trans	-57.3	155.5	171.9	60	0	0	0	0	111.7	R87 L88 R89 D118	T85-R87 PolarHBondContact O-N 3.15Å; T85-R87 VanDerWaalsContact O-N 3.15Å; T85-L88 CarbonylContact O-C 3.59Å; T85-L88 PolarHBondContact O-N 3.27Å; T85-L88 WeakPolarHBondContact OG1-CB 3.37Å; T85-L88 PolarHBondContact OG1-N 3.43Å; T85-R89 WeakPolarHBondContact O-CB 3.48Å; T85-R89 PolarHBondContact O-N 2.72Å; T85-D118 WeakPolarHBondContact CG2-OD1 3.4Å; T85-D118 WeakPolarHBondContact CG2-OD2 3.18Å; T85-D118 PolarHBondContact N-OD2 3.03Å; T85-D118 PolarHBondContact OG1-OD1 3.33Å; T85-D118 PolarHBondContact OG1-OD2 3.49Å
86	E	94.6	Very high	93.9	Very high	156 Å²	156	76.5 Å²	76.5	73%	0.729	39%	0.387	S	S	*	.	H	α-helix	trans	-58.3	-33	-178.3	-172.1	-178.7	-178.4	0	0	113.2	R90	E86-R90 PolarHBondContact O-N 2.98Å; E86-R90 PolarHBondContact O-NE 2.99Å
87	R	93	Very high	94.1	Very high	141 Å²	141	76.9 Å²	76.9	53%	0.532	39%	0.385	S	S	.	.	H	α-helix	trans	-64.6	-50	172.2	175.8	-180	163.1	-174.8	-12.2	110.4	T85 R90 L91 E153	T85-R87 PolarHBondContact O-N 3.15Å; T85-R87 VanDerWaalsContact O-N 3.15Å; R87-R90 PolarHBondContact O-N 3.31Å; R87-L91 PolarHBondContact O-N 3.38Å; R87-E153 IonicContact NH2-OE1 2.84Å; R87-E153 PolarHBondContact NH2-OE1 3.41Å; R87-E153 IonicContact NH2-OE2 3.93Å
88	L	95.4	Very high	94.2	Very high	8 Å²	8	73 Å²	73	4%	0.042	36%	0.363	C	S	.	.	H	α-helix	trans	-69.7	-34.8	-176.7	-169.4	63.4	0	0	0	112	P84 T85 R90 L91 E92 L116 D118 F123	P84-L88 HydrophobicContact CB-CB 4.14Å; P84-L88 HydrophobicContact CB-CD2 4.06Å; P84-L88 HydrophobicContact CB-CG 4.21Å; T85-L88 CarbonylContact O-C 3.59Å; T85-L88 PolarHBondContact O-N 3.27Å; T85-L88 WeakPolarHBondContact OG1-CB 3.37Å; T85-L88 PolarHBondContact OG1-N 3.43Å; L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 3.06Å; L88-L91 HydrophobicContact CD1-CD2 4.18Å; L88-L91 CarbonylContact O-C 3.56Å; L88-L91 WeakPolarHBondContact O-CB 3.45Å; L88-L91 PolarHBondContact O-N 2.79Å; L88-L91 VanDerWaalsContact O-N 3.15Å; L88-E92 WeakPolarHBondContact O-CB 3.18Å; L88-E92 PolarHBondContact O-N 2.89Å; L88-L116 HydrophobicContact CD1-CB 3.91Å; L88-L116 HydrophobicContact CD1-CD1 3.75Å; L88-L116 HydrophobicContact CD1-CG 4.47Å; L88-L116 HydrophobicContact CD2-CB 3.94Å; L88-L116 HydrophobicContact CG-CB 3.74Å; L88-L116 HydrophobicContact CG-CD1 4.26Å; L88-D118 HydrophobicContact CD2-CB 4.33Å; L88-F123 HydrophobicContact CD1-CB 3.72Å; L88-F123 HydrophobicContact CD1-CD1 4.23Å; L88-F123 HydrophobicContact CD1-CD2 3.76Å; L88-F123 HydrophobicContact CD1-CE2 4.43Å; L88-F123 HydrophobicContact CD1-CG 3.64Å; L88-F123 HydrophobicContact CD2-CB 4Å
89	R	96.8	Very high	94.5	Very high	29 Å²	29	70 Å²	70	11%	0.109	35%	0.347	C	S	.	.	H	α-helix	trans	-61.6	-39.2	174.4	-178.3	55.6	-177	156.9	5.5	112.4	P69 W70 P84 T85 L91 E92 I93	P69-R89 VanDerWaalsContact O-CZ 3.27Å; P69-R89 PolarHBondContact O-NH1 3.46Å; P69-R89 PolarHBondContact O-NH2 3.1Å; W70-R89 PolarHBondContact O-NH2 3.49Å; W70-R89 VanDerWaalsContact O-NH2 3.17Å; P84-R89 HydrophobicContact CG-CB 4.11Å; T85-R89 WeakPolarHBondContact O-CB 3.48Å; T85-R89 PolarHBondContact O-N 2.72Å; R89-L91 VanDerWaalsContact C-N 3.34Å; R89-E92 WeakPolarHBondContact CD-OE2 3.49Å; R89-E92 IonicContact CZ-OE2 3.28Å; R89-E92 IonicContact NE-OE2 2.8Å; R89-E92 IonicContact NH1-OE2 2.99Å; R89-E92 PolarHBondContact NH1-OE2 3.04Å; R89-E92 WeakPolarHBondContact O-CB 3.28Å; R89-E92 PolarHBondContact O-N 3.14Å; R89-I93 HydrophobicContact CG-CD1 4.31Å; R89-I93 WeakPolarHBondContact O-CG1 3.21Å; R89-I93 PolarHBondContact O-N 3.24Å
90	R	96	Very high	95	Very high	154 Å²	154	63.6 Å²	63.6	58%	0.581	32%	0.319	S	S	*	.	H	α-helix	trans	-61.4	-44.5	173.2	-78.4	-177	-77.5	177.7	-6.8	111.4	E86 R87 L88 E92 I93 E94	E86-R90 PolarHBondContact O-N 2.98Å; E86-R90 PolarHBondContact O-NE 2.99Å; R87-R90 PolarHBondContact O-N 3.31Å; L88-R90 VanDerWaalsContact C-N 3.33Å; L88-R90 PolarHBondContact O-N 3.06Å; R90-E92 VanDerWaalsContact C-N 3.31Å; R90-E92 PolarHBondContact O-N 3.43Å; R90-I93 PolarHBondContact O-N 3.27Å; R90-E94 PolarHBondContact O-N 3.24Å
91	L	95.7	Very high	95.4	Very high	14 Å²	14	62.4 Å²	62.4	7%	0.073	31%	0.308	C	S	.	.	H	α-helix	trans	-64.1	-36.8	175.6	-170.9	65.9	0	0	0	112.2	R87 L88 R89 E94 S95 L116 F123 S199 H202 V203	R87-L91 PolarHBondContact O-N 3.38Å; L88-L91 HydrophobicContact CD1-CD2 4.18Å; L88-L91 CarbonylContact O-C 3.56Å; L88-L91 WeakPolarHBondContact O-CB 3.45Å; L88-L91 PolarHBondContact O-N 2.79Å; L88-L91 VanDerWaalsContact O-N 3.15Å; R89-L91 VanDerWaalsContact C-N 3.34Å; L91-E94 PolarHBondContact O-N 3.31Å; L91-S95 VanDerWaalsContact O-CB 3.3Å; L91-S95 WeakPolarHBondContact O-CB 3.42Å; L91-S95 PolarHBondContact O-N 3.47Å; L91-S95 PolarHBondContact O-OG 2.85Å; L91-L116 HydrophobicContact CB-CD1 4.09Å; L91-L116 HydrophobicContact CD2-CD1 4.06Å; L91-L116 HydrophobicContact CG-CD1 3.93Å; L91-F123 HydrophobicContact CD2-CE1 4.11Å; L91-F123 HydrophobicContact CD2-CE2 4.02Å; L91-F123 HydrophobicContact CD2-CZ 3.67Å; L91-S199 WeakPolarHBondContact CD1-O 3.45Å; L91-H202 HydrophobicContact CD2-CB 4.33Å; L91-V203 HydrophobicContact CD1-CG2 3.42Å; L91-V203 VanDerWaalsContact CD1-CG2 3.42Å; L91-V203 HydrophobicContact CG-CG2 4.33Å
92	E	97.5	Very high	95.8	Very high	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-64.6	-41.8	176.8	-173.3	-179.4	-119.5	0	0	111.1	R67 L88 R89 R90 S95 N96 Y115 L116	R67-E92 IonicContact CZ-OE1 3.95Å; R67-E92 IonicContact CZ-OE2 3.58Å; R67-E92 IonicContact NH1-OE1 3.43Å; R67-E92 PolarHBondContact NH1-OE1 3.11Å; R67-E92 VanDerWaalsContact NH1-OE1 3.09Å; R67-E92 IonicContact NH1-OE2 2.58Å; R67-E92 PolarHBondContact NH1-OE2 3.34Å; R67-E92 IonicContact NH2-OE1 3.82Å; R67-E92 PolarHBondContact NH2-OE1 2.93Å; R67-E92 IonicContact NH2-OE2 3.79Å; L88-E92 WeakPolarHBondContact O-CB 3.18Å; L88-E92 PolarHBondContact O-N 2.89Å; R89-E92 WeakPolarHBondContact CD-OE2 3.49Å; R89-E92 IonicContact CZ-OE2 3.28Å; R89-E92 IonicContact NE-OE2 2.8Å; R89-E92 IonicContact NH1-OE2 2.99Å; R89-E92 PolarHBondContact NH1-OE2 3.04Å; R89-E92 WeakPolarHBondContact O-CB 3.28Å; R89-E92 PolarHBondContact O-N 3.14Å; R90-E92 VanDerWaalsContact C-N 3.31Å; R90-E92 PolarHBondContact O-N 3.43Å; E92-S95 PolarHBondContact O-N 2.95Å; E92-N96 PolarHBondContact O-N 3.48Å; E92-N96 PolarHBondContact O-ND2 2.81Å; E92-Y115 VanDerWaalsContact OE1-CA 3.24Å; E92-Y115 WeakPolarHBondContact OE1-CA 3.48Å; E92-L116 HydrophobicContact CB-CB 4.21Å; E92-L116 HydrophobicContact CB-CD1 3.9Å; E92-L116 HydrophobicContact CB-CG 3.91Å; E92-L116 HydrophobicContact CG-CB 4.36Å; E92-L116 HydrophobicContact CG-CG 4.1Å; E92-L116 PolarHBondContact OE1-N 2.91Å
93	I	97	Very high	96.1	Very high	75 Å²	75	58.7 Å²	58.7	39%	0.385	28%	0.279	S	S	.	.	H	α-helix	trans	-64.1	-46.8	175.4	-67.8	165.2	0	0	0	110.7	R89 R90 S95 N96 N97	R89-I93 HydrophobicContact CG-CD1 4.31Å; R89-I93 WeakPolarHBondContact O-CG1 3.21Å; R89-I93 PolarHBondContact O-N 3.24Å; R90-I93 PolarHBondContact O-N 3.27Å; I93-S95 VanDerWaalsContact C-N 3.31Å; I93-S95 PolarHBondContact O-N 3.39Å; I93-N96 PolarHBondContact O-N 3.49Å; I93-N97 PolarHBondContact O-N 3.01Å; I93-N97 VanDerWaalsContact O-N 3.09Å; I93-N97 PolarHBondContact O-ND2 3.49Å
94	E	96.5	Very high	96.2	Very high	96 Å²	96	58.1 Å²	58.1	45%	0.449	28%	0.276	S	S	.	.	H	α-helix	trans	-60	-42.6	175.6	-73.2	178.6	-171.2	0	0	111.8	R90 L91 N97 A98 V203	R90-E94 PolarHBondContact O-N 3.24Å; L91-E94 PolarHBondContact O-N 3.31Å; E94-N97 PolarHBondContact O-N 3.27Å; E94-A98 PolarHBondContact O-N 2.89Å; E94-V203 HydrophobicContact CB-CG2 4.49Å
95	S	97.3	Very high	96.3	Very high	4 Å²	4	63.9 Å²	63.9	3%	0.028	30%	0.304	C	S	.	.	H	α-helix	trans	-64.4	-43.2	178.1	-58.4	0	0	0	0	111.7	L91 E92 I93 N97 A98 F99	L91-S95 VanDerWaalsContact O-CB 3.3Å; L91-S95 WeakPolarHBondContact O-CB 3.42Å; L91-S95 PolarHBondContact O-N 3.47Å; L91-S95 PolarHBondContact O-OG 2.85Å; E92-S95 PolarHBondContact O-N 2.95Å; I93-S95 VanDerWaalsContact C-N 3.31Å; I93-S95 PolarHBondContact O-N 3.39Å; S95-N97 VanDerWaalsContact C-N 3.32Å; S95-N97 PolarHBondContact O-N 3.03Å; S95-A98 PolarHBondContact O-N 3.1Å; S95-F99 WeakPolarHBondContact O-CB 3.47Å; S95-F99 WeakPolarHBondContact O-CD2 3.23Å; S95-F99 PolarHBondContact O-N 3.33Å
96	N	97.8	Very high	96.2	Very high	3 Å²	3	64.9 Å²	64.9	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-59.4	-43.4	174.9	-85	-79.8	0	0	0	111.4	W70 E92 I93 A98 F99 D100 V114	W70-N96 HydrophobicContact CH2-CB 4.47Å; W70-N96 HydrophobicContact CZ3-CB 4.07Å; E92-N96 PolarHBondContact O-N 3.48Å; E92-N96 PolarHBondContact O-ND2 2.81Å; I93-N96 PolarHBondContact O-N 3.49Å; N96-A98 PolarHBondContact O-N 3.1Å; N96-F99 PolarHBondContact O-N 3.23Å; N96-D100 VanDerWaalsContact O-CB 3.29Å; N96-D100 WeakPolarHBondContact O-CB 3.39Å; N96-D100 PolarHBondContact O-N 2.83Å; N96-V114 PolarHBondContact ND2-O 3.2Å; N96-V114 PolarHBondContact OD1-N 3.41Å
97	N	96.9	Very high	96.2	Very high	87 Å²	87	58.6 Å²	58.6	47%	0.465	27%	0.27	S	S	.	.	H	α-helix	trans	-65.8	-36.8	177.9	-68.9	-27.6	0	0	0	112.8	I93 E94 S95 Q101	I93-N97 PolarHBondContact O-N 3.01Å; I93-N97 VanDerWaalsContact O-N 3.09Å; I93-N97 PolarHBondContact O-ND2 3.49Å; E94-N97 PolarHBondContact O-N 3.27Å; S95-N97 VanDerWaalsContact C-N 3.32Å; S95-N97 PolarHBondContact O-N 3.03Å; N97-Q101 PolarHBondContact O-N 3.46Å; N97-Q101 PolarHBondContact O-NE2 3.47Å
98	A	96.8	Very high	96.1	Very high	38 Å²	38	59.9 Å²	59.9	31%	0.314	28%	0.282	S	S	.	.	H	α-helix	trans	-70.1	-45.4	177.1	0	0	0	0	0	111.6	E94 S95 N96 Q101 Y102 V203	E94-A98 PolarHBondContact O-N 2.89Å; S95-A98 PolarHBondContact O-N 3.1Å; N96-A98 PolarHBondContact O-N 3.1Å; A98-Q101 WeakPolarHBondContact O-CB 3.37Å; A98-Q101 PolarHBondContact O-N 3.44Å; A98-Y102 PolarHBondContact O-N 2.88Å; A98-V203 HydrophobicContact CB-CG1 3.73Å
99	F	97.4	Very high	95.9	Very high	6 Å²	6	60.3 Å²	60.3	3%	0.026	29%	0.289	C	S	.	.	H	α-helix	trans	-74.9	-24.7	-178.9	-81.2	-72.1	0	0	0	113.7	S95 N96 Q101 Y102 R103 V114 V127 I206 V210	S95-F99 WeakPolarHBondContact O-CB 3.47Å; S95-F99 WeakPolarHBondContact O-CD2 3.23Å; S95-F99 PolarHBondContact O-N 3.33Å; N96-F99 PolarHBondContact O-N 3.23Å; F99-Q101 VanDerWaalsContact C-N 3.35Å; F99-Y102 HydrophobicContact CD1-CD1 4.16Å; F99-Y102 HydrophobicContact CD1-CG 4.28Å; F99-Y102 WeakPolarHBondContact O-CB 3.35Å; F99-Y102 PolarHBondContact O-N 2.9Å; F99-R103 VanDerWaalsContact O-CB 3.31Å; F99-R103 WeakPolarHBondContact O-CB 3.38Å; F99-R103 PolarHBondContact O-N 2.92Å; F99-V114 HydrophobicContact CB-CG2 3.87Å; F99-V114 HydrophobicContact CD2-CG2 3.72Å; F99-V114 HydrophobicContact CG-CG2 4.06Å; F99-V127 HydrophobicContact CB-CG1 4.33Å; F99-V127 HydrophobicContact CD1-CG1 3.51Å; F99-V127 HydrophobicContact CD2-CG1 3.99Å; F99-V127 HydrophobicContact CD2-CG2 3.95Å; F99-V127 HydrophobicContact CE1-CG1 3.68Å; F99-V127 HydrophobicContact CE1-CG2 4.35Å; F99-V127 HydrophobicContact CE2-CB 4.49Å; F99-V127 HydrophobicContact CE2-CG1 4.13Å; F99-V127 HydrophobicContact CE2-CG2 3.55Å; F99-V127 HydrophobicContact CG-CG1 3.67Å; F99-V127 HydrophobicContact CG-CG2 4.49Å; F99-V127 HydrophobicContact CZ-CB 4.43Å; F99-V127 HydrophobicContact CZ-CG1 3.98Å; F99-V127 HydrophobicContact CZ-CG2 3.77Å; F99-I206 HydrophobicContact CE2-CG2 4.38Å; F99-I206 HydrophobicContact CZ-CG2 4.2Å; F99-V210 HydrophobicContact CE1-CB 4.07Å; F99-V210 HydrophobicContact CE1-CG1 3.86Å; F99-V210 HydrophobicContact CE1-CG2 4.31Å; F99-V210 HydrophobicContact CZ-CB 4.25Å; F99-V210 HydrophobicContact CZ-CG1 4.46Å; F99-V210 HydrophobicContact CZ-CG2 4.09Å
100	D	96.7	Very high	95.8	Very high	59 Å²	59	60.5 Å²	60.5	32%	0.316	30%	0.3	S	S	.	.	H	α-helix	trans	-67.4	-37.4	170.6	-168.3	43.5	0	0	0	111.5	N96 R103 E104 S112	N96-D100 VanDerWaalsContact O-CB 3.29Å; N96-D100 WeakPolarHBondContact O-CB 3.39Å; N96-D100 PolarHBondContact O-N 2.83Å; D100-R103 IonicContact OD1-CZ 3.84Å; D100-R103 VanDerWaalsContact OD1-CZ 3.28Å; D100-R103 IonicContact OD1-NE 3.84Å; D100-R103 PolarHBondContact OD1-NE 2.85Å; D100-R103 IonicContact OD1-NH2 3.26Å; D100-R103 PolarHBondContact OD1-NH2 3Å; D100-E104 WeakPolarHBondContact O-CB 3.43Å; D100-E104 PolarHBondContact O-N 2.86Å; D100-S112 WeakPolarHBondContact CA-OG 3.37Å
101	Q	96.7	Very high	95.8	Very high	127 Å²	127	54.4 Å²	54.4	59%	0.593	28%	0.278	S	S	*	.	H	α-helix	trans	-67	-43.2	170.5	-71.8	170.9	75.8	0	0	111.9	N97 A98 F99 R103 E104 M105	N97-Q101 PolarHBondContact O-N 3.46Å; N97-Q101 PolarHBondContact O-NE2 3.47Å; A98-Q101 WeakPolarHBondContact O-CB 3.37Å; A98-Q101 PolarHBondContact O-N 3.44Å; F99-Q101 VanDerWaalsContact C-N 3.35Å; Q101-R103 VanDerWaalsContact C-N 3.35Å; Q101-R103 PolarHBondContact O-N 2.95Å; Q101-E104 PolarHBondContact O-N 2.84Å; Q101-M105 WeakPolarHBondContact O-CG 3.4Å; Q101-M105 PolarHBondContact O-N 2.84Å
102	Y	97	Very high	95.9	Very high	16 Å²	16	53.8 Å²	53.8	6%	0.063	28%	0.276	C	S	.	.	H	α-helix	trans	-56.4	-49.4	174.2	175.5	-94.7	0	0	0	111.4	A98 F99 E104 M105 Y106 F107 I129 E211 E214	A98-Y102 PolarHBondContact O-N 2.88Å; F99-Y102 HydrophobicContact CD1-CD1 4.16Å; F99-Y102 HydrophobicContact CD1-CG 4.28Å; F99-Y102 WeakPolarHBondContact O-CB 3.35Å; F99-Y102 PolarHBondContact O-N 2.9Å; Y102-E104 VanDerWaalsContact C-N 3.33Å; Y102-E104 PolarHBondContact O-N 2.93Å; Y102-M105 PolarHBondContact O-N 2.64Å; Y102-Y106 AromaticContact CD2-CD2 3.64Å; Y102-Y106 HydrophobicContact CD2-CD2 3.64Å; Y102-Y106 AromaticContact CD2-CE2 3.66Å; Y102-Y106 HydrophobicContact CD2-CE2 3.66Å; Y102-Y106 HydrophobicContact CE1-CD2 4.36Å; Y102-Y106 AromaticContact CE2-CD2 3.4Å; Y102-Y106 HydrophobicContact CE2-CD2 3.4Å; Y102-Y106 AromaticContact CE2-CE2 3.33Å; Y102-Y106 HydrophobicContact CE2-CE2 3.33Å; Y102-Y106 HydrophobicContact CE2-CG 4.23Å; Y102-Y106 HydrophobicContact CG-CD2 4.21Å; Y102-Y106 AromaticContact CZ-CD2 3.79Å; Y102-Y106 WeakPolarHBondContact O-CD2 3.4Å; Y102-Y106 PolarHBondContact O-N 2.82Å; Y102-F107 HydrophobicContact CE1-CE2 4.3Å; Y102-I129 HydrophobicContact CD1-CD1 3.73Å; Y102-I129 HydrophobicContact CE1-CD1 3.65Å; Y102-E211 HydrophobicContact CE2-CB 3.97Å; Y102-E211 HydrophobicContact CE2-CG 4.07Å; Y102-E214 PolarHBondContact OH-OE2 3.15Å; Y102-E214 VanDerWaalsContact OH-OE2 3.07Å
103	R	96.1	Very high	95.9	Very high	23 Å²	23	53.8 Å²	53.8	9%	0.087	28%	0.276	C	S	.	.	H	α-helix	trans	-54.8	-50.3	176.1	175.6	-162.1	63	67.1	2.6	110.6	F99 D100 Q101 M105 Y106 F107 G109 G110 I111 I129	F99-R103 VanDerWaalsContact O-CB 3.31Å; F99-R103 WeakPolarHBondContact O-CB 3.38Å; F99-R103 PolarHBondContact O-N 2.92Å; D100-R103 IonicContact OD1-CZ 3.84Å; D100-R103 VanDerWaalsContact OD1-CZ 3.28Å; D100-R103 IonicContact OD1-NE 3.84Å; D100-R103 PolarHBondContact OD1-NE 2.85Å; D100-R103 IonicContact OD1-NH2 3.26Å; D100-R103 PolarHBondContact OD1-NH2 3Å; Q101-R103 VanDerWaalsContact C-N 3.35Å; Q101-R103 PolarHBondContact O-N 2.95Å; R103-M105 VanDerWaalsContact C-N 3.32Å; R103-M105 PolarHBondContact O-N 2.94Å; R103-Y106 PolarHBondContact O-N 2.84Å; R103-F107 HydrophobicContact CG-CB 4.48Å; R103-F107 WeakPolarHBondContact O-CA 3.39Å; R103-F107 VanDerWaalsContact O-CB 3.31Å; R103-F107 WeakPolarHBondContact O-CB 3.38Å; R103-F107 PolarHBondContact O-N 2.84Å; R103-G109 WeakPolarHBondContact CG-O 3.32Å; R103-G109 VanDerWaalsContact NH1-CA 3.28Å; R103-G109 PolarHBondContact NH1-O 3.48Å; R103-G110 WeakPolarHBondContact CD-O 3.1Å; R103-G110 PolarHBondContact NH1-O 2.92Å; R103-I111 VanDerWaalsContact CD-C 3.48Å; R103-I129 HydrophobicContact CG-CG2 4.25Å
104	E	95.9	Very high	96	Very high	98 Å²	98	50.3 Å²	50.3	46%	0.458	26%	0.258	S	S	.	.	H	α-helix	trans	-59.9	-42.9	-178.7	-165.8	61.7	-157.4	0	0	111.9	D100 Q101 Y102 E108	D100-E104 WeakPolarHBondContact O-CB 3.43Å; D100-E104 PolarHBondContact O-N 2.86Å; Q101-E104 PolarHBondContact O-N 2.84Å; Y102-E104 VanDerWaalsContact C-N 3.33Å; Y102-E104 PolarHBondContact O-N 2.93Å; E104-E108 WeakPolarHBondContact O-CA 3.21Å; E104-E108 PolarHBondContact O-N 3.4Å; E104-E108 VanDerWaalsContact O-N 3.14Å
105	M	95.4	Very high	96	Very high	136 Å²	136	45.7 Å²	45.7	67%	0.67	24%	0.236	S	C	*	.	H	α-helix	trans	-67.3	-37	179.9	-70.8	-174.2	-65.1	0	0	114.1	Q101 Y102 R103	Q101-M105 WeakPolarHBondContact O-CG 3.4Å; Q101-M105 PolarHBondContact O-N 2.84Å; Y102-M105 PolarHBondContact O-N 2.64Å; R103-M105 VanDerWaalsContact C-N 3.32Å; R103-M105 PolarHBondContact O-N 2.94Å
106	Y	94.8	Very high	96	Very high	92 Å²	92	45.7 Å²	45.7	36%	0.361	24%	0.236	S	C	.	.	H	α-helix	trans	-98.2	-27.7	-174.6	-78.6	-89	0	0	0	114.3	Y102 R103 E211	Y102-Y106 AromaticContact CD2-CD2 3.64Å; Y102-Y106 HydrophobicContact CD2-CD2 3.64Å; Y102-Y106 AromaticContact CD2-CE2 3.66Å; Y102-Y106 HydrophobicContact CD2-CE2 3.66Å; Y102-Y106 HydrophobicContact CE1-CD2 4.36Å; Y102-Y106 AromaticContact CE2-CD2 3.4Å; Y102-Y106 HydrophobicContact CE2-CD2 3.4Å; Y102-Y106 AromaticContact CE2-CE2 3.33Å; Y102-Y106 HydrophobicContact CE2-CE2 3.33Å; Y102-Y106 HydrophobicContact CE2-CG 4.23Å; Y102-Y106 HydrophobicContact CG-CD2 4.21Å; Y102-Y106 AromaticContact CZ-CD2 3.79Å; Y102-Y106 WeakPolarHBondContact O-CD2 3.4Å; Y102-Y106 PolarHBondContact O-N 2.82Å; R103-Y106 PolarHBondContact O-N 2.84Å; Y106-E211 PolarHBondContact OH-OE1 3.36Å
107	F	92.8	Very high	95.9	Very high	25 Å²	25	48.9 Å²	48.9	11%	0.11	25%	0.248	C	C	.	.	H	α-helix	trans	-116.6	-10.6	-172	-64.4	-94.8	0	0	0	113.9	Y102 R103 G109 I129 K131 W143	Y102-F107 HydrophobicContact CE1-CE2 4.3Å; R103-F107 HydrophobicContact CG-CB 4.48Å; R103-F107 WeakPolarHBondContact O-CA 3.39Å; R103-F107 VanDerWaalsContact O-CB 3.31Å; R103-F107 WeakPolarHBondContact O-CB 3.38Å; R103-F107 PolarHBondContact O-N 2.84Å; F107-G109 PolarHBondContact O-N 3.33Å; F107-I129 HydrophobicContact CD2-CG2 4.07Å; F107-I129 HydrophobicContact CE1-CG2 4.36Å; F107-I129 HydrophobicContact CE2-CD1 3.99Å; F107-I129 HydrophobicContact CE2-CG2 3.91Å; F107-I129 HydrophobicContact CG-CG2 4.36Å; F107-I129 HydrophobicContact CZ-CG2 4.04Å; F107-K131 HydrophobicContact CB-CD 4.32Å; F107-K131 HydrophobicContact CB-CG 4.49Å; F107-K131 HydrophobicContact CD1-CB 3.78Å; F107-K131 HydrophobicContact CD1-CG 4.23Å; F107-K131 HydrophobicContact CE1-CB 4.48Å; F107-K131 WeakPolarHBondContact O-CE 3.31Å; F107-W143 AromaticContact CE1-CD1 3.48Å; F107-W143 VanDerWaalsContact CE1-CD1 3.48Å; F107-W143 HydrophobicContact CE1-CD2 4.31Å; F107-W143 AromaticContact CE1-CG 3.97Å; F107-W143 HydrophobicContact CE1-CG 3.97Å; F107-W143 AromaticContact CE1-NE1 3.53Å; F107-W143 AromaticContact CZ-NE1 3.66Å
108	E	91.5	Very high	95.9	Very high	167 Å²	167	48 Å²	48	78%	0.78	24%	0.243	S	C	*	.	S	Bend	trans	47.8	44.9	-179.9	-60.6	177.8	-168.1	0	0	111.7	E104	E104-E108 WeakPolarHBondContact O-CA 3.21Å; E104-E108 PolarHBondContact O-N 3.4Å; E104-E108 VanDerWaalsContact O-N 3.14Å
109	G	91.8	Very high	95.8	Very high	18 Å²	18	49.3 Å²	49.3	19%	0.186	24%	0.244	C	C	.	.	S	Bend	trans	135.7	-160.6	-175.7	0	0	0	0	0	113.2	R103 F107	R103-G109 WeakPolarHBondContact CG-O 3.32Å; R103-G109 VanDerWaalsContact NH1-CA 3.28Å; R103-G109 PolarHBondContact NH1-O 3.48Å; F107-G109 PolarHBondContact O-N 3.33Å
110	G	93.6	Very high	95.4	Very high	33 Å²	33	56.6 Å²	56.6	34%	0.34	28%	0.284	S	S	.	.			trans	79.1	-168.2	-172.7	0	0	0	0	0	112.7	R103 K130	R103-G110 WeakPolarHBondContact CD-O 3.1Å; R103-G110 PolarHBondContact NH1-O 2.92Å; G110-K130 CarbonylContact C-O 3.54Å; G110-K130 VanDerWaalsContact CA-O 3.23Å; G110-K130 WeakPolarHBondContact CA-O 3.39Å
111	I	96.6	Very high	95.1	Very high	25 Å²	25	61.1 Å²	61.1	13%	0.128	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	143.7	-176.9	-56	161.5	0	0	0	108	V44 E53 L55 R103 I129 K130	V44-I111 HydrophobicContact CB-CD1 4.18Å; V44-I111 HydrophobicContact CG1-CD1 3.48Å; V44-I111 VanDerWaalsContact CG1-CD1 3.48Å; V44-I111 HydrophobicContact CG2-CD1 3.56Å; E53-I111 HydrophobicContact CB-CD1 3.96Å; E53-I111 HydrophobicContact CB-CG1 4.33Å; E53-I111 HydrophobicContact CB-CG2 4.36Å; E53-I111 WeakPolarHBondContact OE2-CD1 3.14Å; L55-I111 HydrophobicContact CD1-CG2 4.38Å; L55-I111 HydrophobicContact CD2-CB 4.1Å; L55-I111 HydrophobicContact CD2-CG2 3.99Å; L55-I111 HydrophobicContact CG-CB 4.33Å; L55-I111 HydrophobicContact CG-CG2 3.85Å; R103-I111 VanDerWaalsContact CD-C 3.48Å; I111-I129 WeakPolarHBondContact O-CA 3.43Å; I111-K130 PolarHBondContact N-O 2.88Å; I111-K130 PolarHBondContact O-N 2.87Å
112	S	97.6	Very high	95	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.014	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	150	171	52.4	0	0	0	0	110.6	D100 L128	D100-S112 WeakPolarHBondContact CA-OG 3.37Å; S112-L128 CarbonylContact C-O 3.58Å; S112-L128 WeakPolarHBondContact CA-O 3.41Å
113	S	98.2	Very high	94.9	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	140.4	173.2	-59.4	0	0	0	0	109.7	F54 L55 L128	F54-S113 WeakPolarHBondContact CA-OG 3.38Å; L55-S113 PolarHBondContact N-OG 3.25Å; S113-L128 PolarHBondContact N-O 3.42Å; S113-L128 WeakPolarHBondContact O-CB 3.32Å; S113-L128 PolarHBondContact O-N 3.39Å
114	V	98.3	Very high	95	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.006	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	129.8	176.2	-173.9	0	0	0	0	109.3	N96 F99 L116 A126 V127	N96-V114 PolarHBondContact ND2-O 3.2Å; N96-V114 PolarHBondContact OD1-N 3.41Å; F99-V114 HydrophobicContact CB-CG2 3.87Å; F99-V114 HydrophobicContact CD2-CG2 3.72Å; F99-V114 HydrophobicContact CG-CG2 4.06Å; V114-L116 HydrophobicContact CG1-CD2 4.09Å; V114-A126 WeakPolarHBondContact CA-O 3.14Å; V114-V127 HydrophobicContact CG1-CG2 4.01Å; V114-V127 HydrophobicContact CG2-CB 4.43Å; V114-V127 HydrophobicContact CG2-CG1 4.19Å; V114-V127 HydrophobicContact CG2-CG2 4.11Å
115	Y	97.8	Very high	95	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	128.7	176.2	-54.7	-69.9	0	0	0	109.7	F54 L55 N60 R67 P69 E92 G125 A126 L128	F54-Y115 VanDerWaalsContact CD2-OH 3.32Å; F54-Y115 WeakPolarHBondContact CD2-OH 3.49Å; L55-Y115 WeakPolarHBondContact O-CE2 3.39Å; L55-Y115 PolarHBondContact O-OH 3.11Å; N60-Y115 HydrophobicContact CB-CD1 3.55Å; N60-Y115 HydrophobicContact CB-CD2 3.68Å; N60-Y115 HydrophobicContact CB-CE1 3.6Å; N60-Y115 HydrophobicContact CB-CE2 3.7Å; N60-Y115 HydrophobicContact CB-CG 3.59Å; N60-Y115 PolarHBondContact ND2-OH 3.05Å; N60-Y115 VanDerWaalsContact ND2-OH 3.14Å; R67-Y115 VanDerWaalsContact O-CE1 3.28Å; R67-Y115 WeakPolarHBondContact O-CE1 2.92Å; P69-Y115 HydrophobicContact CB-CD1 4.31Å; P69-Y115 HydrophobicContact CB-CE1 3.76Å; P69-Y115 HydrophobicContact CG-CE1 3.94Å; E92-Y115 VanDerWaalsContact OE1-CA 3.24Å; E92-Y115 WeakPolarHBondContact OE1-CA 3.48Å; Y115-G125 CarbonylContact O-C 3.56Å; Y115-G125 WeakPolarHBondContact O-CA 3.25Å; Y115-A126 PolarHBondContact N-O 3.44Å; Y115-A126 PolarHBondContact O-N 3.06Å; Y115-L128 HydrophobicContact CD2-CD1 3.98Å; Y115-L128 HydrophobicContact CE2-CD1 3.64Å
116	L	97.4	Very high	95.1	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.021	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	146.7	175.3	-55.1	-174.3	0	0	0	109.9	L88 L91 E92 V114 F123 A124	L88-L116 HydrophobicContact CD1-CB 3.91Å; L88-L116 HydrophobicContact CD1-CD1 3.75Å; L88-L116 HydrophobicContact CD1-CG 4.47Å; L88-L116 HydrophobicContact CD2-CB 3.94Å; L88-L116 HydrophobicContact CG-CB 3.74Å; L88-L116 HydrophobicContact CG-CD1 4.26Å; L91-L116 HydrophobicContact CB-CD1 4.09Å; L91-L116 HydrophobicContact CD2-CD1 4.06Å; L91-L116 HydrophobicContact CG-CD1 3.93Å; E92-L116 HydrophobicContact CB-CB 4.21Å; E92-L116 HydrophobicContact CB-CD1 3.9Å; E92-L116 HydrophobicContact CB-CG 3.91Å; E92-L116 HydrophobicContact CG-CB 4.36Å; E92-L116 HydrophobicContact CG-CG 4.1Å; E92-L116 PolarHBondContact OE1-N 2.91Å; V114-L116 HydrophobicContact CG1-CD2 4.09Å; L116-F123 HydrophobicContact CD1-CE2 4.43Å; L116-F123 HydrophobicContact CD2-CD2 4.47Å; L116-F123 HydrophobicContact CD2-CE2 4.45Å; L116-A124 WeakPolarHBondContact CA-O 3.34Å
117	W	95.7	Very high	95.2	Very high	69 Å²	69	39.2 Å²	39.2	26%	0.261	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	148.1	173.4	62.5	93.3	0	0	0	111.3	Y59 F123 A124 A126 V148	Y59-W117 AromaticContact CD1-CH2 3.59Å; Y59-W117 HydrophobicContact CD1-CH2 3.59Å; Y59-W117 HydrophobicContact CD1-CZ2 4.13Å; Y59-W117 HydrophobicContact CD1-CZ3 4.12Å; Y59-W117 HydrophobicContact CE1-CH2 4.25Å; Y59-W117 AromaticContact CG-CH2 3.99Å; Y59-W117 HydrophobicContact CG-CH2 3.99Å; Y59-W117 HydrophobicContact CG-CZ3 4.14Å; W117-F123 WeakPolarHBondContact O-CA 3.32Å; W117-F123 WeakPolarHBondContact O-CB 3.37Å; W117-A124 HydrophobicContact CD2-CB 4.19Å; W117-A124 VanDerWaalsContact CE2-CB 3.42Å; W117-A124 HydrophobicContact CH2-CB 4.22Å; W117-A124 HydrophobicContact CZ2-CB 3.45Å; W117-A124 VanDerWaalsContact CZ2-CB 3.45Å; W117-A124 PolarHBondContact N-O 3.37Å; W117-A124 PolarHBondContact O-N 3.07Å; W117-A126 HydrophobicContact CH2-CB 4.3Å; W117-A126 HydrophobicContact CZ3-CB 3.99Å; W117-V148 HydrophobicContact CH2-CG1 4.35Å
118	D	95.1	Very high	95.5	Very high	68 Å²	68	38 Å²	38	36%	0.364	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	146.4	-176.7	-61.8	-91.3	0	0	0	111.2	P84 T85 L88	P84-D118 WeakPolarHBondContact CA-OD2 3.29Å; T85-D118 WeakPolarHBondContact CG2-OD1 3.4Å; T85-D118 WeakPolarHBondContact CG2-OD2 3.18Å; T85-D118 PolarHBondContact N-OD2 3.03Å; T85-D118 PolarHBondContact OG1-OD1 3.33Å; T85-D118 PolarHBondContact OG1-OD2 3.49Å; L88-D118 HydrophobicContact CD2-CB 4.33Å
119	L	94.7	Very high	95.7	Very high	67 Å²	67	30.1 Å²	30.1	35%	0.351	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	163.7	170.5	-62.1	177.8	0	0	0	109.3	H121 G122 A124 E150	L119-H121 PolarHBondContact O-N 2.94Å; L119-G122 PolarHBondContact N-O 2.64Å; L119-G122 VanDerWaalsContact O-O 3.09Å; L119-A124 HydrophobicContact CD1-CB 3.84Å; L119-A124 HydrophobicContact CG-CB 4.26Å; L119-E150 HydrophobicContact CD1-CG 3.88Å
120	D	90.4	Very high	95.9	Very high	159 Å²	159	30.4 Å²	30.4	85%	0.85	16%	0.163	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-33.7	178.3	-66.9	-28.3	0	0	0	113.2
121	H	90.6	Very high	96	Very high	153 Å²	153	31.8 Å²	31.8	71%	0.708	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-128.2	41.7	-175.5	-61.5	-32.8	0	0	0	112.7	L119 Q152 E153	L119-H121 PolarHBondContact O-N 2.94Å; H121-Q152 WeakPolarHBondContact O-CA 3.43Å; H121-E153 PolarHBondContact O-N 2.77Å; H121-E153 VanDerWaalsContact O-N 3.17Å
122	G	93.5	Very high	95.6	Very high	16 Å²	16	33.7 Å²	33.7	17%	0.165	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	143	-133.2	175.9	0	0	0	0	0	111.2	L119 V151	L119-G122 PolarHBondContact N-O 2.64Å; L119-G122 VanDerWaalsContact O-O 3.09Å; G122-V151 WeakPolarHBondContact CA-O 3.29Å
123	F	96.1	Very high	94.9	Very high	8 Å²	8	35.2 Å²	35.2	4%	0.035	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	164.6	177.5	66.6	-85.3	0	0	0	110.2	L88 L91 L116 W117 V151 H202 I206	L88-F123 HydrophobicContact CD1-CB 3.72Å; L88-F123 HydrophobicContact CD1-CD1 4.23Å; L88-F123 HydrophobicContact CD1-CD2 3.76Å; L88-F123 HydrophobicContact CD1-CE2 4.43Å; L88-F123 HydrophobicContact CD1-CG 3.64Å; L88-F123 HydrophobicContact CD2-CB 4Å; L91-F123 HydrophobicContact CD2-CE1 4.11Å; L91-F123 HydrophobicContact CD2-CE2 4.02Å; L91-F123 HydrophobicContact CD2-CZ 3.67Å; L116-F123 HydrophobicContact CD1-CE2 4.43Å; L116-F123 HydrophobicContact CD2-CD2 4.47Å; L116-F123 HydrophobicContact CD2-CE2 4.45Å; W117-F123 WeakPolarHBondContact O-CA 3.32Å; W117-F123 WeakPolarHBondContact O-CB 3.37Å; F123-V151 HydrophobicContact CD1-CB 4.13Å; F123-V151 HydrophobicContact CD1-CG1 4.37Å; F123-V151 HydrophobicContact CD2-CB 4.47Å; F123-V151 HydrophobicContact CD2-CG2 4.36Å; F123-V151 HydrophobicContact CE1-CB 3.86Å; F123-V151 HydrophobicContact CE1-CG1 3.79Å; F123-V151 HydrophobicContact CE1-CG2 4.2Å; F123-V151 HydrophobicContact CE2-CB 4.22Å; F123-V151 HydrophobicContact CE2-CG2 3.8Å; F123-V151 HydrophobicContact CG-CB 4.43Å; F123-V151 HydrophobicContact CZ-CB 3.9Å; F123-V151 HydrophobicContact CZ-CG1 4.05Å; F123-V151 HydrophobicContact CZ-CG2 3.7Å; F123-V151 PolarHBondContact N-O 3.04Å; F123-V151 VanDerWaalsContact N-O 3.08Å; F123-V151 WeakPolarHBondContact O-CA 3.39Å; F123-V151 WeakPolarHBondContact O-CB 3.3Å; F123-V151 PolarHBondContact O-N 3.14Å; F123-V151 VanDerWaalsContact O-O 3.12Å; F123-H202 HydrophobicContact CZ-CB 4.01Å; F123-H202 AromaticContact CZ-CG 3.97Å; F123-I206 HydrophobicContact CE2-CD1 4.2Å; F123-I206 HydrophobicContact CZ-CD1 4.3Å
124	A	97	Very high	93.8	Very high	5 Å²	5	39.7 Å²	39.7	4%	0.041	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	166.7	168.3	0	0	0	0	0	110.4	L116 W117 L119 V149	L116-A124 WeakPolarHBondContact CA-O 3.34Å; W117-A124 HydrophobicContact CD2-CB 4.19Å; W117-A124 VanDerWaalsContact CE2-CB 3.42Å; W117-A124 HydrophobicContact CH2-CB 4.22Å; W117-A124 HydrophobicContact CZ2-CB 3.45Å; W117-A124 VanDerWaalsContact CZ2-CB 3.45Å; W117-A124 PolarHBondContact N-O 3.37Å; W117-A124 PolarHBondContact O-N 3.07Å; L119-A124 HydrophobicContact CD1-CB 3.84Å; L119-A124 HydrophobicContact CG-CB 4.26Å; A124-V149 CarbonylContact C-O 3.54Å; A124-V149 WeakPolarHBondContact CA-O 3.43Å; A124-V149 VanDerWaalsContact CB-O 3.28Å; A124-V149 WeakPolarHBondContact CB-O 3.46Å
125	G	96.6	Very high	92.2	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	154.1	-178.9	0	0	0	0	0	113.4	Y115 V148 V149	Y115-G125 CarbonylContact O-C 3.56Å; Y115-G125 WeakPolarHBondContact O-CA 3.25Å; G125-V148 CarbonylContact O-C 3.59Å; G125-V148 WeakPolarHBondContact O-CA 3Å; G125-V149 PolarHBondContact N-O 2.95Å; G125-V149 PolarHBondContact O-N 3.38Å
126	A	96.9	Very high	90.4	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	119.7	171.4	0	0	0	0	0	108.6	Y59 V114 Y115 W117 L128 H147	Y59-A126 HydrophobicContact CD2-CB 3.65Å; Y59-A126 HydrophobicContact CE2-CB 4.43Å; Y59-A126 HydrophobicContact CG-CB 3.91Å; V114-A126 WeakPolarHBondContact CA-O 3.14Å; Y115-A126 PolarHBondContact N-O 3.44Å; Y115-A126 PolarHBondContact O-N 3.06Å; W117-A126 HydrophobicContact CH2-CB 4.3Å; W117-A126 HydrophobicContact CZ3-CB 3.99Å; A126-L128 HydrophobicContact CB-CD2 4.22Å; A126-H147 CarbonylContact C-O 3.58Å; A126-H147 WeakPolarHBondContact CA-O 3.49Å
127	V	97.8	Very high	88.9	Confident	4 Å²	4	56.9 Å²	56.9	2%	0.024	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	121	169.5	178.3	0	0	0	0	107.7	F99 V114 H147	F99-V127 HydrophobicContact CB-CG1 4.33Å; F99-V127 HydrophobicContact CD1-CG1 3.51Å; F99-V127 HydrophobicContact CD2-CG1 3.99Å; F99-V127 HydrophobicContact CD2-CG2 3.95Å; F99-V127 HydrophobicContact CE1-CG1 3.68Å; F99-V127 HydrophobicContact CE1-CG2 4.35Å; F99-V127 HydrophobicContact CE2-CB 4.49Å; F99-V127 HydrophobicContact CE2-CG1 4.13Å; F99-V127 HydrophobicContact CE2-CG2 3.55Å; F99-V127 HydrophobicContact CG-CG1 3.67Å; F99-V127 HydrophobicContact CG-CG2 4.49Å; F99-V127 HydrophobicContact CZ-CB 4.43Å; F99-V127 HydrophobicContact CZ-CG1 3.98Å; F99-V127 HydrophobicContact CZ-CG2 3.77Å; V114-V127 HydrophobicContact CG1-CG2 4.01Å; V114-V127 HydrophobicContact CG2-CB 4.43Å; V114-V127 HydrophobicContact CG2-CG1 4.19Å; V114-V127 HydrophobicContact CG2-CG2 4.11Å; V127-H147 HydrophobicContact CB-CB 4.09Å; V127-H147 PolarHBondContact N-O 3.11Å; V127-H147 PolarHBondContact O-N 3.33Å
128	L	97.6	Very high	87.4	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	135.3	-174.5	-49.7	179.5	0	0	0	109.5	L42 L55 C57 S112 S113 Y115 A126 S145 I146	L42-L128 HydrophobicContact CD1-CB 4.07Å; L42-L128 HydrophobicContact CD2-CD1 4.14Å; L42-L128 HydrophobicContact CD2-CD2 4.2Å; L55-L128 HydrophobicContact CB-CB 4.19Å; L55-L128 HydrophobicContact CB-CD1 3.96Å; L55-L128 HydrophobicContact CD1-CB 3.68Å; C57-L128 HydrophobicContact CB-CD1 3.97Å; C57-L128 WeakPolarHBondContact SG-CD1 3.42Å; S112-L128 CarbonylContact C-O 3.58Å; S112-L128 WeakPolarHBondContact CA-O 3.41Å; S113-L128 PolarHBondContact N-O 3.42Å; S113-L128 WeakPolarHBondContact O-CB 3.32Å; S113-L128 PolarHBondContact O-N 3.39Å; Y115-L128 HydrophobicContact CD2-CD1 3.98Å; Y115-L128 HydrophobicContact CE2-CD1 3.64Å; A126-L128 HydrophobicContact CB-CD2 4.22Å; L128-S145 WeakPolarHBondContact CA-O 3.45Å; L128-I146 HydrophobicContact CD2-CB 4.32Å; L128-I146 HydrophobicContact CD2-CG1 4.21Å; L128-I146 HydrophobicContact CD2-CG2 3.9Å
129	I	97.3	Very high	86.4	Confident	1 Å²	1	60 Å²	60	1%	0.005	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	129.7	173.4	-55.3	174.8	0	0	0	108.2	Y102 R103 F107 I111 D144 S145	Y102-I129 HydrophobicContact CD1-CD1 3.73Å; Y102-I129 HydrophobicContact CE1-CD1 3.65Å; R103-I129 HydrophobicContact CG-CG2 4.25Å; F107-I129 HydrophobicContact CD2-CG2 4.07Å; F107-I129 HydrophobicContact CE1-CG2 4.36Å; F107-I129 HydrophobicContact CE2-CD1 3.99Å; F107-I129 HydrophobicContact CE2-CG2 3.91Å; F107-I129 HydrophobicContact CG-CG2 4.36Å; F107-I129 HydrophobicContact CZ-CG2 4.04Å; I111-I129 WeakPolarHBondContact O-CA 3.43Å; I129-D144 CarbonylContact O-C 3.54Å; I129-D144 WeakPolarHBondContact O-CA 3.44Å; I129-S145 PolarHBondContact N-O 3.43Å; I129-S145 PolarHBondContact O-N 2.86Å
130	K	95.7	Very high	86	Confident	24 Å²	24	60.3 Å²	60.3	10%	0.104	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	122.7	173.3	-179.5	171	-164.8	77.7	0	109.6	L42 V44 L55 G110 I111 S142 W143 D144	L42-K130 HydrophobicContact CB-CD 4.24Å; L42-K130 HydrophobicContact CD1-CB 4.49Å; L42-K130 WeakPolarHBondContact O-CD 3.24Å; L42-K130 VanDerWaalsContact O-CE 3.23Å; L42-K130 WeakPolarHBondContact O-CE 3.18Å; L42-K130 PolarHBondContact O-NZ 3.36Å; V44-K130 HydrophobicContact CG2-CD 3.87Å; L55-K130 HydrophobicContact CD1-CB 3.99Å; L55-K130 HydrophobicContact CD2-CB 3.59Å; L55-K130 HydrophobicContact CD2-CD 4.04Å; L55-K130 HydrophobicContact CD2-CG 4.43Å; L55-K130 HydrophobicContact CG-CB 4.46Å; G110-K130 CarbonylContact C-O 3.54Å; G110-K130 VanDerWaalsContact CA-O 3.23Å; G110-K130 WeakPolarHBondContact CA-O 3.39Å; I111-K130 PolarHBondContact N-O 2.88Å; I111-K130 PolarHBondContact O-N 2.87Å; K130-S142 PolarHBondContact NZ-OG 3.45Å; K130-W143 CarbonylContact C-O 3.43Å; K130-W143 WeakPolarHBondContact CA-O 3.45Å; K130-D144 WeakPolarHBondContact CG-OD1 3.24Å; K130-D144 IonicContact NZ-OD1 3.77Å; K130-D144 PolarHBondContact NZ-OD1 2.85Å; K130-D144 IonicContact NZ-OD2 2.73Å; K130-D144 PolarHBondContact NZ-OD2 3.23Å
131	K	94.4	Very high	85.8	Confident	62 Å²	62	53.5 Å²	53.5	27%	0.27	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	111.4	170.5	-178.8	70.1	175.8	89.5	0	109.6	F107 W143	F107-K131 HydrophobicContact CB-CD 4.32Å; F107-K131 HydrophobicContact CB-CG 4.49Å; F107-K131 HydrophobicContact CD1-CB 3.78Å; F107-K131 HydrophobicContact CD1-CG 4.23Å; F107-K131 HydrophobicContact CE1-CB 4.48Å; F107-K131 WeakPolarHBondContact O-CE 3.31Å; K131-W143 HydrophobicContact CB-CB 4.32Å; K131-W143 PolarHBondContact N-O 2.9Å; K131-W143 PolarHBondContact O-N 2.55Å
132	S	89.7	Confident	85.8	Confident	64 Å²	64	47.2 Å²	47.2	45%	0.448	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	138.9	167.8	-59.5	0	0	0	0	110.2
133	G	82	Confident	85.8	Confident	34 Å²	34	47.9 Å²	47.9	35%	0.351	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-72	156.8	171.6	0	0	0	0	0	110.9	T135 G141	G133-T135 PolarHBondContact O-N 2.85Å; G133-G141 WeakPolarHBondContact CA-O 3.5Å; G133-G141 PolarHBondContact N-O 2.98Å
134	D	74.4	Confident	85.7	Confident	95 Å²	95	47.9 Å²	47.9	51%	0.508	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-78.5	118.2	-178.9	-158.7	-7.4	0	0	0	109.7	T136 K137	D134-T136 VanDerWaalsContact CG-OG1 3.25Å; D134-T136 PolarHBondContact O-N 3.29Å; D134-T136 VanDerWaalsContact O-N 3.11Å; D134-T136 PolarHBondContact OD1-OG1 3.39Å; D134-T136 PolarHBondContact OD2-OG1 2.78Å; D134-K137 PolarHBondContact O-N 3.4Å
135	T	65.7	Low	85.6	Confident	105 Å²	105	47.6 Å²	47.6	64%	0.644	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-10.8	-176.4	47.1	0	0	0	0	113.2	G133 K137	G133-T135 PolarHBondContact O-N 2.85Å; T135-K137 PolarHBondContact O-N 3.49Å
136	T	60.9	Low	85.6	Confident	112 Å²	112	47.9 Å²	47.9	69%	0.687	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-16.8	177	59.1	0	0	0	0	113.5	D134	D134-T136 VanDerWaalsContact CG-OG1 3.25Å; D134-T136 PolarHBondContact O-N 3.29Å; D134-T136 VanDerWaalsContact O-N 3.11Å; D134-T136 PolarHBondContact OD1-OG1 3.39Å; D134-T136 PolarHBondContact OD2-OG1 2.78Å
137	K	64.8	Low	85.6	Confident	149 Å²	149	47.9 Å²	47.9	65%	0.648	27%	0.27	S	S	*	.	S	Bend	trans	-95.5	151.4	177.9	-63.1	-177.4	-177.6	176	0	109.9	D134 T135 A139	D134-K137 PolarHBondContact O-N 3.4Å; T135-K137 PolarHBondContact O-N 3.49Å; K137-A139 PolarHBondContact O-N 3.37Å
138	M	65.2	Low	85.5	Confident	157 Å²	157	49 Å²	49	77%	0.773	28%	0.277	S	S	*	.	S	Bend	trans	-64	9.5	177.1	-61.9	-161.5	118.8	0	0	114.9	E175	M138-E175 PolarHBondContact O-N 2.9Å
139	A	73.5	Confident	85.5	Confident	46 Å²	46	49.2 Å²	49.2	38%	0.38	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	115.5	176	0	0	0	0	0	108.6	K137 K173 K174	K137-A139 PolarHBondContact O-N 3.37Å; A139-K173 CarbonylContact C-O 3.57Å; A139-K173 VanDerWaalsContact CA-O 3.28Å; A139-K173 WeakPolarHBondContact CA-O 3.23Å; A139-K174 HydrophobicContact CB-CB 4.45Å; A139-K174 HydrophobicContact CB-CG 4.48Å
140	E	85.3	Confident	85.5	Confident	73 Å²	73	52.2 Å²	52.2	34%	0.341	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	143.4	169.1	-62.8	179.9	152.5	0	0	108.6	W171 L172 K173	E140-W171 HydrophobicContact CB-CH2 3.71Å; E140-W171 HydrophobicContact CB-CZ3 3.74Å; E140-W171 WeakPolarHBondContact OE2-CH2 3.24Å; E140-L172 WeakPolarHBondContact O-CA 3.33Å; E140-K173 HydrophobicContact CB-CB 4.43Å; E140-K173 PolarHBondContact N-O 3.5Å; E140-K173 PolarHBondContact O-N 2.87Å; E140-K173 VanDerWaalsContact O-O 3.11Å
141	G	87.3	Confident	85.6	Confident	16 Å²	16	51.1 Å²	51.1	17%	0.165	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	153.9	175.8	0	0	0	0	0	112	G133 W171	G133-G141 WeakPolarHBondContact CA-O 3.5Å; G133-G141 PolarHBondContact N-O 2.98Å; G141-W171 CarbonylContact C-O 3.59Å; G141-W171 WeakPolarHBondContact CA-O 3.41Å
142	S	90.2	Very high	85.6	Confident	20 Å²	20	52.4 Å²	52.4	14%	0.14	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	137.2	171	-167.9	0	0	0	0	108.7	K130 D144 W171	K130-S142 PolarHBondContact NZ-OG 3.45Å; S142-D144 PolarHBondContact OG-OD1 3.25Å; S142-W171 PolarHBondContact N-O 2.57Å; S142-W171 PolarHBondContact O-N 3.37Å
143	W	92.6	Very high	85.7	Confident	31 Å²	31	52.6 Å²	52.6	12%	0.117	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	124	172.3	177.9	-73.1	0	0	0	108.4	F107 K130 K131 S145 L168 L170 R218 L221	F107-W143 AromaticContact CE1-CD1 3.48Å; F107-W143 VanDerWaalsContact CE1-CD1 3.48Å; F107-W143 HydrophobicContact CE1-CD2 4.31Å; F107-W143 AromaticContact CE1-CG 3.97Å; F107-W143 HydrophobicContact CE1-CG 3.97Å; F107-W143 AromaticContact CE1-NE1 3.53Å; F107-W143 AromaticContact CZ-NE1 3.66Å; K130-W143 CarbonylContact C-O 3.43Å; K130-W143 WeakPolarHBondContact CA-O 3.45Å; K131-W143 HydrophobicContact CB-CB 4.32Å; K131-W143 PolarHBondContact N-O 2.9Å; K131-W143 PolarHBondContact O-N 2.55Å; W143-S145 PolarHBondContact NE1-OG 2.89Å; W143-L168 HydrophobicContact CH2-CD1 3.65Å; W143-L168 HydrophobicContact CZ2-CB 4.49Å; W143-L168 HydrophobicContact CZ2-CD1 3.45Å; W143-L168 VanDerWaalsContact CZ2-CD1 3.45Å; W143-L168 HydrophobicContact CZ2-CD2 3.88Å; W143-L168 HydrophobicContact CZ2-CG 4.14Å; W143-L170 HydrophobicContact CE3-CD1 4.08Å; W143-R218 HydrophobicContact CH2-CB 4.1Å; W143-R218 HydrophobicContact CH2-CG 4.11Å; W143-L221 HydrophobicContact CH2-CD1 3.71Å; W143-L221 HydrophobicContact CZ3-CD1 3.8Å
144	D	94.1	Very high	86	Confident	7 Å²	7	55 Å²	55	4%	0.037	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	121.9	173.6	-56.8	-28	0	0	0	108.8	L42 I129 K130 S142 L168 M169	L42-D144 HydrophobicContact CD1-CB 4.08Å; L42-D144 HydrophobicContact CG-CB 4.21Å; L42-D144 PolarHBondContact N-OD2 3.09Å; I129-D144 CarbonylContact O-C 3.54Å; I129-D144 WeakPolarHBondContact O-CA 3.44Å; K130-D144 WeakPolarHBondContact CG-OD1 3.24Å; K130-D144 IonicContact NZ-OD1 3.77Å; K130-D144 PolarHBondContact NZ-OD1 2.85Å; K130-D144 IonicContact NZ-OD2 2.73Å; K130-D144 PolarHBondContact NZ-OD2 3.23Å; S142-D144 PolarHBondContact OG-OD1 3.25Å; D144-L168 CarbonylContact O-C 3.52Å; D144-L168 WeakPolarHBondContact O-CA 3.42Å; D144-M169 HydrophobicContact CB-CB 4.22Å; D144-M169 PolarHBondContact N-O 2.85Å; D144-M169 PolarHBondContact O-N 2.84Å
145	S	95.7	Very high	86.3	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	130.3	170.5	-59.3	0	0	0	0	110.1	L128 I129 W143 H147 L168 E214	L128-S145 WeakPolarHBondContact CA-O 3.45Å; I129-S145 PolarHBondContact N-O 3.43Å; I129-S145 PolarHBondContact O-N 2.86Å; W143-S145 PolarHBondContact NE1-OG 2.89Å; S145-H147 WeakPolarHBondContact CB-NE2 3.32Å; S145-L168 VanDerWaalsContact OG-CD2 3.23Å; S145-L168 WeakPolarHBondContact OG-CD2 3.46Å; S145-E214 WeakPolarHBondContact CB-OE1 3.19Å; S145-E214 PolarHBondContact OG-OE1 3.18Å
146	I	96.3	Very high	86.9	Confident	5 Å²	5	56.7 Å²	56.7	3%	0.026	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	111.6	174.1	-56.1	173	0	0	0	107.5	D39 L42 Y59 L128 V148 S166 T167 M169	D39-I146 HydrophobicContact CB-CD1 3.89Å; L42-I146 HydrophobicContact CD1-CG1 4.15Å; L42-I146 HydrophobicContact CD2-CD1 4.09Å; L42-I146 HydrophobicContact CD2-CG1 4.05Å; L42-I146 HydrophobicContact CG-CD1 4.37Å; L42-I146 HydrophobicContact CG-CG1 4.21Å; Y59-I146 HydrophobicContact CE2-CG2 4.42Å; L128-I146 HydrophobicContact CD2-CB 4.32Å; L128-I146 HydrophobicContact CD2-CG1 4.21Å; L128-I146 HydrophobicContact CD2-CG2 3.9Å; I146-V148 HydrophobicContact CG2-CG2 4.18Å; I146-S166 CarbonylContact O-C 3.37Å; I146-S166 WeakPolarHBondContact O-CA 3.28Å; I146-T167 PolarHBondContact N-O 3.43Å; I146-T167 PolarHBondContact O-N 2.92Å; I146-M169 HydrophobicContact CD1-CE 3.9Å
147	H	97.2	Very high	87.7	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	105	179.4	-61.7	-77.5	0	0	0	109.1	A126 V127 S145 L164 S166 V210 E214	A126-H147 CarbonylContact C-O 3.58Å; A126-H147 WeakPolarHBondContact CA-O 3.49Å; V127-H147 HydrophobicContact CB-CB 4.09Å; V127-H147 PolarHBondContact N-O 3.11Å; V127-H147 PolarHBondContact O-N 3.33Å; S145-H147 WeakPolarHBondContact CB-NE2 3.32Å; H147-L164 HydrophobicContact CB-CD1 3.97Å; H147-S166 VanDerWaalsContact ND1-CB 3.27Å; H147-S166 WeakPolarHBondContact ND1-CB 3.46Å; H147-S166 PolarHBondContact ND1-OG 2.93Å; H147-V210 HydrophobicContact CB-CG2 4.09Å; H147-E214 VanDerWaalsContact CE1-CG 3.43Å; H147-E214 WeakPolarHBondContact CE1-CG 3.45Å; H147-E214 WeakPolarHBondContact NE2-CG 3.41Å; H147-E214 IonicContact NE2-OE1 3.27Å; H147-E214 PolarHBondContact NE2-OE1 3.27Å
148	V	96.7	Very high	88.7	Confident	29 Å²	29	55.9 Å²	55.9	18%	0.176	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	117.8	175.8	-175.6	0	0	0	0	108.4	Y59 W117 G125 I146 L164 T165	Y59-V148 HydrophobicContact CD2-CG2 4.47Å; Y59-V148 HydrophobicContact CE1-CG2 4.39Å; Y59-V148 HydrophobicContact CE2-CG2 3.61Å; Y59-V148 WeakPolarHBondContact OH-CG2 3.49Å; W117-V148 HydrophobicContact CH2-CG1 4.35Å; G125-V148 CarbonylContact O-C 3.59Å; G125-V148 WeakPolarHBondContact O-CA 3Å; I146-V148 HydrophobicContact CG2-CG2 4.18Å; V148-L164 WeakPolarHBondContact O-CA 3.36Å; V148-T165 PolarHBondContact N-O 2.97Å; V148-T165 PolarHBondContact O-N 2.84Å
149	V	97.4	Very high	90	Very high	3 Å²	3	50.8 Å²	50.8	2%	0.018	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	131.2	177.4	66.9	0	0	0	0	110.4	A124 G125 V151 K163 L164 I206	A124-V149 CarbonylContact C-O 3.54Å; A124-V149 WeakPolarHBondContact CA-O 3.43Å; A124-V149 VanDerWaalsContact CB-O 3.28Å; A124-V149 WeakPolarHBondContact CB-O 3.46Å; G125-V149 PolarHBondContact N-O 2.95Å; G125-V149 PolarHBondContact O-N 3.38Å; V149-V151 HydrophobicContact CG2-CG2 4.05Å; V149-K163 CarbonylContact C-O 3.57Å; V149-K163 WeakPolarHBondContact CA-O 3.35Å; V149-L164 HydrophobicContact CB-CD1 4.29Å; V149-I206 HydrophobicContact CG1-CD1 4.13Å; V149-I206 HydrophobicContact CG1-CG1 4.38Å; V149-I206 HydrophobicContact CG1-CG2 4.08Å; V149-I206 HydrophobicContact CG2-CG1 4.23Å
150	E	97.3	Very high	91.1	Very high	65 Å²	65	48.6 Å²	48.6	30%	0.304	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.5	168.1	-172.6	-170.6	155.5	0	0	108.1	L119 Q152 Y162 K163	L119-E150 HydrophobicContact CD1-CG 3.88Å; E150-Q152 PolarHBondContact OE1-NE2 2.85Å; E150-Y162 WeakPolarHBondContact O-CA 3.23Å; E150-K163 HydrophobicContact CB-CB 4.31Å; E150-K163 PolarHBondContact N-O 2.89Å; E150-K163 PolarHBondContact O-N 2.92Å
151	V	96.8	Very high	91.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	111.8	-179.5	-174	0	0	0	0	108.6	G122 F123 V149 A160 H161 Y162 I206	G122-V151 WeakPolarHBondContact CA-O 3.29Å; F123-V151 HydrophobicContact CD1-CB 4.13Å; F123-V151 HydrophobicContact CD1-CG1 4.37Å; F123-V151 HydrophobicContact CD2-CB 4.47Å; F123-V151 HydrophobicContact CD2-CG2 4.36Å; F123-V151 HydrophobicContact CE1-CB 3.86Å; F123-V151 HydrophobicContact CE1-CG1 3.79Å; F123-V151 HydrophobicContact CE1-CG2 4.2Å; F123-V151 HydrophobicContact CE2-CB 4.22Å; F123-V151 HydrophobicContact CE2-CG2 3.8Å; F123-V151 HydrophobicContact CG-CB 4.43Å; F123-V151 HydrophobicContact CZ-CB 3.9Å; F123-V151 HydrophobicContact CZ-CG1 4.05Å; F123-V151 HydrophobicContact CZ-CG2 3.7Å; F123-V151 PolarHBondContact N-O 3.04Å; F123-V151 VanDerWaalsContact N-O 3.08Å; F123-V151 WeakPolarHBondContact O-CA 3.39Å; F123-V151 WeakPolarHBondContact O-CB 3.3Å; F123-V151 PolarHBondContact O-N 3.14Å; F123-V151 VanDerWaalsContact O-O 3.12Å; V149-V151 HydrophobicContact CG2-CG2 4.05Å; V151-A160 HydrophobicContact CG1-CB 3.9Å; V151-H161 WeakPolarHBondContact CA-O 3.17Å; V151-Y162 HydrophobicContact CB-CD1 4.49Å; V151-Y162 HydrophobicContact CG1-CD1 4.17Å; V151-Y162 HydrophobicContact CG1-CE1 3.86Å; V151-Y162 HydrophobicContact CG2-CD1 3.72Å; V151-Y162 HydrophobicContact CG2-CE1 3.92Å; V151-I206 HydrophobicContact CG2-CD1 4.17Å
152	Q	95.3	Very high	92.1	Very high	90 Å²	90	46.5 Å²	46.5	42%	0.421	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	109.2	173.1	-62	-175.3	-1.6	0	0	109.4	H121 E150 K154 A160 H161	H121-Q152 WeakPolarHBondContact O-CA 3.43Å; E150-Q152 PolarHBondContact OE1-NE2 2.85Å; Q152-K154 PolarHBondContact O-N 2.99Å; Q152-A160 VanDerWaalsContact O-CA 3.31Å; Q152-A160 WeakPolarHBondContact O-CA 3.35Å; Q152-H161 HydrophobicContact CB-CB 4.29Å; Q152-H161 PolarHBondContact N-O 2.85Å; Q152-H161 PolarHBondContact O-N 2.78Å
153	E	91.2	Very high	92.4	Very high	68 Å²	68	49 Å²	49	32%	0.318	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	121.6	177	-66.8	-172.5	155.7	0	0	109.2	R87 H121 H202	R87-E153 IonicContact NH2-OE1 2.84Å; R87-E153 PolarHBondContact NH2-OE1 3.41Å; R87-E153 IonicContact NH2-OE2 3.93Å; H121-E153 PolarHBondContact O-N 2.77Å; H121-E153 VanDerWaalsContact O-N 3.17Å; E153-H202 IonicContact OE1-CE1 2.78Å; E153-H202 IonicContact OE1-NE2 3.41Å; E153-H202 PolarHBondContact OE1-NE2 3.37Å
154	K	87.5	Confident	92.7	Very high	85 Å²	85	47.6 Å²	47.6	37%	0.37	25%	0.25	S	S	.	.			trans	-70.5	150.7	175.3	-62.9	-174.8	-177.5	172.9	0	109.4	Q152 T156 G157 N159 D193	Q152-K154 PolarHBondContact O-N 2.99Å; K154-T156 PolarHBondContact O-N 3.16Å; K154-G157 PolarHBondContact O-N 3.09Å; K154-N159 WeakPolarHBondContact CB-O 3.4Å; K154-N159 HydrophobicContact CD-CB 4.33Å; K154-N159 PolarHBondContact N-O 2.58Å; K154-N159 VanDerWaalsContact N-O 3.11Å; K154-D193 IonicContact NZ-OD1 2.74Å; K154-D193 IonicContact NZ-OD2 3.09Å; K154-D193 PolarHBondContact NZ-OD2 2.82Å
155	S	80.7	Confident	92.8	Very high	133 Å²	133	49 Å²	49	93%	0.93	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-22	-177.5	55.1	0	0	0	0	115.3	G157	S155-G157 VanDerWaalsContact C-N 3.29Å
156	T	78.9	Confident	92.8	Very high	101 Å²	101	49 Å²	49	62%	0.62	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-10.8	175.8	60.5	0	0	0	0	113.7	K154 R158	K154-T156 PolarHBondContact O-N 3.16Å; T156-R158 PolarHBondContact O-N 3.43Å
157	G	77.3	Confident	92.6	Very high	49 Å²	49	49 Å²	49	51%	0.505	26%	0.259	S	S	.	.	S	Bend	trans	67.5	-4.3	-179	0	0	0	0	0	115.4	K154 S155	K154-G157 PolarHBondContact O-N 3.09Å; S155-G157 VanDerWaalsContact C-N 3.29Å
158	R	86.7	Confident	92.4	Very high	195 Å²	195	49 Å²	49	74%	0.736	26%	0.259	S	S	*	.	S	Bend	trans	-96.1	-8.3	-174.5	-67.4	-173.8	-175.6	-175.8	0.7	114.3	T156 P195 V196	T156-R158 PolarHBondContact O-N 3.43Å; R158-P195 CarbonylContact O-C 3.59Å; R158-P195 VanDerWaalsContact O-CA 3.3Å; R158-P195 WeakPolarHBondContact O-CA 3.36Å; R158-V196 PolarHBondContact O-N 3.38Å
159	N	92.5	Very high	92.1	Very high	51 Å²	51	48.8 Å²	48.8	27%	0.273	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	142	-175.8	-161.6	-6	0	0	0	108.4	K154 A194	K154-N159 WeakPolarHBondContact CB-O 3.4Å; K154-N159 HydrophobicContact CD-CB 4.33Å; K154-N159 PolarHBondContact N-O 2.58Å; K154-N159 VanDerWaalsContact N-O 3.11Å; N159-A194 PolarHBondContact OD1-N 3.4Å; N159-A194 PolarHBondContact OD1-O 3Å
160	A	95.3	Very high	91.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	146.3	176.7	0	0	0	0	0	109.6	V151 Q152 Y162 D193 A194 V196	V151-A160 HydrophobicContact CG1-CB 3.9Å; Q152-A160 VanDerWaalsContact O-CA 3.31Å; Q152-A160 WeakPolarHBondContact O-CA 3.35Å; A160-Y162 HydrophobicContact CB-CD2 4.43Å; A160-Y162 HydrophobicContact CB-CE2 3.68Å; A160-Y162 VanDerWaalsContact O-CD2 3.31Å; A160-Y162 WeakPolarHBondContact O-CD2 3.33Å; A160-Y162 VanDerWaalsContact O-CE2 3.27Å; A160-Y162 WeakPolarHBondContact O-CE2 3.39Å; A160-D193 WeakPolarHBondContact O-CA 3.45Å; A160-A194 PolarHBondContact N-O 2.82Å; A160-A194 VanDerWaalsContact N-O 3.08Å; A160-A194 PolarHBondContact O-N 3.25Å; A160-V196 HydrophobicContact CB-CG2 3.73Å
161	H	96.4	Very high	91.1	Very high	45 Å²	45	50 Å²	50	21%	0.208	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	125.9	171.5	-177	71.3	0	0	0	108.5	V151 Q152 E191 D193	V151-H161 WeakPolarHBondContact CA-O 3.17Å; Q152-H161 HydrophobicContact CB-CB 4.29Å; Q152-H161 PolarHBondContact N-O 2.85Å; Q152-H161 PolarHBondContact O-N 2.78Å; H161-E191 IonicContact CE1-OE2 3.77Å; H161-E191 IonicContact NE2-OE2 3.95Å; H161-D193 WeakPolarHBondContact CA-OD1 3.49Å; H161-D193 WeakPolarHBondContact CB-OD1 3.26Å; H161-D193 IonicContact CE1-OD1 3.74Å; H161-D193 IonicContact CG-OD1 2.65Å; H161-D193 IonicContact ND1-OD1 3.85Å; H161-D193 PolarHBondContact ND1-OD1 2.85Å
162	Y	97.2	Very high	90.6	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	126.7	-178.1	-60	-99	0	0	0	108.7	E150 V151 A160 E191 A192 A194 V196 H202 N205 I206 M209	E150-Y162 WeakPolarHBondContact O-CA 3.23Å; V151-Y162 HydrophobicContact CB-CD1 4.49Å; V151-Y162 HydrophobicContact CG1-CD1 4.17Å; V151-Y162 HydrophobicContact CG1-CE1 3.86Å; V151-Y162 HydrophobicContact CG2-CD1 3.72Å; V151-Y162 HydrophobicContact CG2-CE1 3.92Å; A160-Y162 HydrophobicContact CB-CD2 4.43Å; A160-Y162 HydrophobicContact CB-CE2 3.68Å; A160-Y162 VanDerWaalsContact O-CD2 3.31Å; A160-Y162 WeakPolarHBondContact O-CD2 3.33Å; A160-Y162 VanDerWaalsContact O-CE2 3.27Å; A160-Y162 WeakPolarHBondContact O-CE2 3.39Å; Y162-E191 CarbonylContact O-C 3.5Å; Y162-E191 VanDerWaalsContact O-CA 3.25Å; Y162-E191 WeakPolarHBondContact O-CA 3.32Å; Y162-A192 WeakPolarHBondContact CD2-O 3.48Å; Y162-A192 PolarHBondContact N-O 2.87Å; Y162-A192 PolarHBondContact O-N 2.8Å; Y162-A194 HydrophobicContact CD2-CB 4.15Å; Y162-A194 HydrophobicContact CE2-CB 3.71Å; Y162-V196 WeakPolarHBondContact OH-CG2 3.37Å; Y162-H202 AromaticContact CE1-ND1 3.96Å; Y162-H202 AromaticContact CZ-ND1 3.8Å; Y162-H202 PolarHBondContact OH-ND1 2.82Å; Y162-N205 HydrophobicContact CE1-CB 3.99Å; Y162-N205 HydrophobicContact CE2-CB 4.27Å; Y162-N205 PolarHBondContact OH-ND2 3.07Å; Y162-N205 VanDerWaalsContact OH-ND2 3.07Å; Y162-I206 HydrophobicContact CD1-CG1 4Å; Y162-I206 HydrophobicContact CE1-CG1 3.95Å; Y162-M209 WeakPolarHBondContact CB-SD 3.36Å; Y162-M209 HydrophobicContact CD1-SD 4.47Å; Y162-M209 HydrophobicContact CG-SD 3.98Å
163	K	97.8	Very high	90.1	Very high	72 Å²	72	50.3 Å²	50.3	31%	0.313	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	110.9	172.8	178.9	175.5	-173.7	177.9	0	109	V149 E150 E191	V149-K163 CarbonylContact C-O 3.57Å; V149-K163 WeakPolarHBondContact CA-O 3.35Å; E150-K163 HydrophobicContact CB-CB 4.31Å; E150-K163 PolarHBondContact N-O 2.89Å; E150-K163 PolarHBondContact O-N 2.92Å; K163-E191 HydrophobicContact CB-CG 4Å; K163-E191 HydrophobicContact CD-CG 4.4Å; K163-E191 WeakPolarHBondContact CD-OE1 3.14Å; K163-E191 VanDerWaalsContact CE-OE1 3.32Å; K163-E191 WeakPolarHBondContact CE-OE1 3.29Å; K163-E191 HydrophobicContact CG-CG 3.81Å; K163-E191 IonicContact NZ-OE1 3.72Å
164	L	97.7	Very high	89.7	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	119.6	-179.2	176.7	64.5	0	0	0	109.7	H147 V148 V149 S166 Q189 M190 M209 V210 M213	H147-L164 HydrophobicContact CB-CD1 3.97Å; V148-L164 WeakPolarHBondContact O-CA 3.36Å; V149-L164 HydrophobicContact CB-CD1 4.29Å; L164-S166 WeakPolarHBondContact CG-OG 3.47Å; L164-Q189 CarbonylContact O-C 3.59Å; L164-Q189 VanDerWaalsContact O-CA 3.27Å; L164-Q189 WeakPolarHBondContact O-CA 3.5Å; L164-M190 PolarHBondContact N-O 2.77Å; L164-M190 PolarHBondContact O-N 2.81Å; L164-M209 HydrophobicContact CB-CE 3.86Å; L164-M209 HydrophobicContact CD2-CB 3.9Å; L164-M209 WeakPolarHBondContact CD2-O 3.42Å; L164-V210 HydrophobicContact CD1-CG2 4.22Å; L164-V210 HydrophobicContact CD2-CG2 4.31Å; L164-M213 HydrophobicContact CD2-CB 3.94Å; L164-M213 HydrophobicContact CD2-CG 4.42Å
165	T	96.5	Very high	89	Confident	37 Å²	37	52.6 Å²	52.6	23%	0.227	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	120.7	165.4	-57.7	0	0	0	0	108.1	V148 T187 Q189	V148-T165 PolarHBondContact N-O 2.97Å; V148-T165 PolarHBondContact O-N 2.84Å; T165-T187 HydrophobicContact CG2-CG2 4.04Å; T165-Q189 HydrophobicContact CG2-CG 3.93Å; T165-Q189 PolarHBondContact OG1-NE2 3.14Å; T165-Q189 VanDerWaalsContact OG1-NE2 3.11Å
166	S	96	Very high	88.2	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	127.9	-177.7	-56.9	0	0	0	0	110.6	I146 H147 L164 T187 R188	I146-S166 CarbonylContact O-C 3.37Å; I146-S166 WeakPolarHBondContact O-CA 3.28Å; H147-S166 VanDerWaalsContact ND1-CB 3.27Å; H147-S166 WeakPolarHBondContact ND1-CB 3.46Å; H147-S166 PolarHBondContact ND1-OG 2.93Å; L164-S166 WeakPolarHBondContact CG-OG 3.47Å; S166-T187 CarbonylContact O-C 3.47Å; S166-T187 VanDerWaalsContact O-CA 3.26Å; S166-T187 WeakPolarHBondContact O-CA 3.09Å; S166-R188 PolarHBondContact N-O 3.14Å; S166-R188 PolarHBondContact O-N 3.41Å
167	T	93.1	Very high	87.8	Confident	4 Å²	4	49.9 Å²	49.9	3%	0.025	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126.6	172.8	-63.4	0	0	0	0	108.5	D39 I146 M169 I186 T187	D39-T167 HydrophobicContact CB-CG2 4.19Å; D39-T167 WeakPolarHBondContact OD2-CB 3.31Å; D39-T167 WeakPolarHBondContact OD2-CG2 3.28Å; D39-T167 PolarHBondContact OD2-OG1 3.38Å; I146-T167 PolarHBondContact N-O 3.43Å; I146-T167 PolarHBondContact O-N 2.92Å; T167-M169 HydrophobicContact CG2-CE 4.14Å; T167-M169 HydrophobicContact CG2-CG 4.32Å; T167-I186 CarbonylContact C-O 3.56Å; T167-I186 WeakPolarHBondContact CA-O 3.47Å; T167-T187 WeakPolarHBondContact OG1-CG2 3.31Å; T167-T187 PolarHBondContact OG1-OG1 3.08Å
168	L	92.8	Very high	87.4	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	133.6	167.6	-56.6	-179.9	0	0	0	109.1	W143 D144 S145 S185 I186 M217 L221	W143-L168 HydrophobicContact CH2-CD1 3.65Å; W143-L168 HydrophobicContact CZ2-CB 4.49Å; W143-L168 HydrophobicContact CZ2-CD1 3.45Å; W143-L168 VanDerWaalsContact CZ2-CD1 3.45Å; W143-L168 HydrophobicContact CZ2-CD2 3.88Å; W143-L168 HydrophobicContact CZ2-CG 4.14Å; D144-L168 CarbonylContact O-C 3.52Å; D144-L168 WeakPolarHBondContact O-CA 3.42Å; S145-L168 VanDerWaalsContact OG-CD2 3.23Å; S145-L168 WeakPolarHBondContact OG-CD2 3.46Å; L168-S185 CarbonylContact O-C 3.11Å; L168-S185 WeakPolarHBondContact O-CA 3.48Å; L168-S185 WeakPolarHBondContact O-CB 3.41Å; L168-I186 HydrophobicContact CB-CG2 4Å; L168-I186 HydrophobicContact CD1-CG2 4.42Å; L168-I186 HydrophobicContact CG-CG2 4.44Å; L168-I186 PolarHBondContact N-O 3.47Å; L168-I186 PolarHBondContact O-N 3.18Å; L168-M217 HydrophobicContact CD1-CB 3.42Å; L168-M217 VanDerWaalsContact CD1-CB 3.42Å; L168-M217 HydrophobicContact CD1-CE 3.65Å; L168-M217 HydrophobicContact CD1-CG 4.42Å; L168-M217 HydrophobicContact CD1-SD 4.25Å; L168-M217 HydrophobicContact CD2-CE 3.71Å; L168-M217 HydrophobicContact CG-CB 4.25Å; L168-M217 HydrophobicContact CG-CE 3.37Å; L168-M217 HydrophobicContact CG-SD 4.05Å; L168-L221 HydrophobicContact CB-CD1 3.96Å; L168-L221 HydrophobicContact CD1-CD1 3.67Å
169	M	89.7	Confident	87	Confident	25 Å²	25	51.9 Å²	51.9	12%	0.123	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	128.9	169	-49.5	-176.4	-166.6	0	0	109.1	D39 P41 D144 I146 T167	D39-M169 VanDerWaalsContact C-CE 3.41Å; D39-M169 HydrophobicContact CB-CE 3.2Å; D39-M169 WeakPolarHBondContact O-CE 3.21Å; P41-M169 HydrophobicContact CG-SD 4.39Å; D144-M169 HydrophobicContact CB-CB 4.22Å; D144-M169 PolarHBondContact N-O 2.85Å; D144-M169 PolarHBondContact O-N 2.84Å; I146-M169 HydrophobicContact CD1-CE 3.9Å; T167-M169 HydrophobicContact CG2-CE 4.14Å; T167-M169 HydrophobicContact CG2-CG 4.32Å
170	L	88.5	Confident	86.5	Confident	22 Å²	22	54 Å²	54	12%	0.115	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	130.4	175.3	178.1	62.3	0	0	0	108.3	W143 L172 S183 G184 Y225	W143-L170 HydrophobicContact CE3-CD1 4.08Å; L170-L172 HydrophobicContact CD1-CD1 4.09Å; L170-L172 HydrophobicContact CD1-CG 4Å; L170-L172 HydrophobicContact CD2-CD1 3.73Å; L170-L172 HydrophobicContact CD2-CG 4.49Å; L170-L172 HydrophobicContact CG-CD1 3.93Å; L170-L172 HydrophobicContact CG-CG 4.16Å; L170-S183 VanDerWaalsContact O-CA 3.31Å; L170-S183 WeakPolarHBondContact O-CA 3.37Å; L170-G184 PolarHBondContact N-O 3.01Å; L170-G184 PolarHBondContact O-N 3.11Å; L170-Y225 HydrophobicContact CB-CE1 4.41Å; L170-Y225 HydrophobicContact CD2-CD1 4.11Å; L170-Y225 HydrophobicContact CD2-CE1 4.05Å; L170-Y225 HydrophobicContact CD2-CG 4.37Å; L170-Y225 HydrophobicContact CG-CE1 4.3Å; L170-Y225 PolarHBondContact O-OH 2.99Å
171	W	85.7	Confident	86	Confident	72 Å²	72	57.8 Å²	57.8	27%	0.273	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	130.7	169.5	175.6	72.6	0	0	0	108.9	E140 G141 S142 K173 N181	E140-W171 HydrophobicContact CB-CH2 3.71Å; E140-W171 HydrophobicContact CB-CZ3 3.74Å; E140-W171 WeakPolarHBondContact OE2-CH2 3.24Å; G141-W171 CarbonylContact C-O 3.59Å; G141-W171 WeakPolarHBondContact CA-O 3.41Å; S142-W171 PolarHBondContact N-O 2.57Å; S142-W171 PolarHBondContact O-N 3.37Å; W171-K173 HydrophobicContact CH2-CB 3.77Å; W171-K173 HydrophobicContact CH2-CD 4.28Å; W171-K173 HydrophobicContact CZ2-CB 3.36Å; W171-K173 HydrophobicContact CZ2-CD 3.86Å; W171-K173 HydrophobicContact CZ2-CG 4.19Å; W171-N181 PolarHBondContact NE1-OD1 3.41Å; W171-N181 VanDerWaalsContact NE1-OD1 3.11Å
172	L	86.4	Confident	85.4	Confident	50 Å²	50	57 Å²	57	26%	0.262	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	120.6	-180	-75.3	159	0	0	0	107.6	E140 L170 L182 F226	E140-L172 WeakPolarHBondContact O-CA 3.33Å; L170-L172 HydrophobicContact CD1-CD1 4.09Å; L170-L172 HydrophobicContact CD1-CG 4Å; L170-L172 HydrophobicContact CD2-CD1 3.73Å; L170-L172 HydrophobicContact CD2-CG 4.49Å; L170-L172 HydrophobicContact CG-CD1 3.93Å; L170-L172 HydrophobicContact CG-CG 4.16Å; L172-L182 HydrophobicContact CB-CB 4.09Å; L172-L182 PolarHBondContact N-O 2.93Å; L172-L182 PolarHBondContact O-N 2.8Å; L172-F226 HydrophobicContact CD1-CE1 4.41Å; L172-F226 HydrophobicContact CD1-CZ 3.76Å
173	K	84.7	Confident	84.8	Confident	46 Å²	46	58.7 Å²	58.7	20%	0.2	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	127.7	172.7	-177.7	-171.8	169.8	-151.3	0	108.6	A139 E140 W171 E175 L180	A139-K173 CarbonylContact C-O 3.57Å; A139-K173 VanDerWaalsContact CA-O 3.28Å; A139-K173 WeakPolarHBondContact CA-O 3.23Å; E140-K173 HydrophobicContact CB-CB 4.43Å; E140-K173 PolarHBondContact N-O 3.5Å; E140-K173 PolarHBondContact O-N 2.87Å; E140-K173 VanDerWaalsContact O-O 3.11Å; W171-K173 HydrophobicContact CH2-CB 3.77Å; W171-K173 HydrophobicContact CH2-CD 4.28Å; W171-K173 HydrophobicContact CZ2-CB 3.36Å; W171-K173 HydrophobicContact CZ2-CD 3.86Å; W171-K173 HydrophobicContact CZ2-CG 4.19Å; K173-E175 WeakPolarHBondContact CE-OE1 3.43Å; K173-E175 IonicContact NZ-OE1 3.73Å; K173-E175 PolarHBondContact NZ-OE1 3.4Å; K173-L180 CarbonylContact C-O 3.54Å; K173-L180 WeakPolarHBondContact CA-O 3.33Å
174	K	83	Confident	84	Confident	99 Å²	99	56.1 Å²	56.1	43%	0.43	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	125.2	175.2	-177.2	178.7	179.7	-178.9	0	109.4	A139 C176 L180	A139-K174 HydrophobicContact CB-CB 4.45Å; A139-K174 HydrophobicContact CB-CG 4.48Å; K174-C176 HydrophobicContact CD-CB 4.17Å; K174-C176 HydrophobicContact CG-CB 4Å; K174-L180 HydrophobicContact CB-CB 4.46Å; K174-L180 PolarHBondContact N-O 3.47Å; K174-L180 PolarHBondContact O-N 3.1Å
175	E	72.9	Confident	83.5	Confident	103 Å²	103	59.6 Å²	59.6	48%	0.481	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	96.1	172.3	-64.6	-170.6	177	0	0	107.9	M138 K173	M138-E175 PolarHBondContact O-N 2.9Å; K173-E175 WeakPolarHBondContact CE-OE1 3.43Å; K173-E175 IonicContact NZ-OE1 3.73Å; K173-E175 PolarHBondContact NZ-OE1 3.4Å
176	C	64.3	Low	83.1	Confident	86 Å²	86	59.2 Å²	59.2	58%	0.581	33%	0.334	S	S	*	.	S	Bend	trans	-139.1	76.9	179.5	-173.8	0	0	0	0	109.9	K174 Q178	K174-C176 HydrophobicContact CD-CB 4.17Å; K174-C176 HydrophobicContact CG-CB 4Å; C176-Q178 PolarHBondContact O-N 2.93Å
177	G	69	Low	82.8	Confident	91 Å²	91	62.8 Å²	62.8	94%	0.938	36%	0.356	S	S	*	.	S	Bend	trans	78.8	-47.5	-176.5	0	0	0	0	0	113.5
178	Q	70.2	Confident	82.9	Confident	170 Å²	170	69 Å²	69	79%	0.794	38%	0.379	S	S	*	.	S	Bend	trans	-129.4	147.2	167.1	-71.8	-170.2	-28.7	0	0	109.9	C176 L180	C176-Q178 PolarHBondContact O-N 2.93Å; Q178-L180 PolarHBondContact O-N 3.48Å; Q178-L180 VanDerWaalsContact O-N 3.11Å
179	D	78.5	Confident	83	Confident	116 Å²	116	75.3 Å²	75.3	62%	0.62	41%	0.408	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.7	108.4	-179.8	-71.7	-2.9	0	0	0	110.1
180	L	81.4	Confident	83.3	Confident	95 Å²	95	75.8 Å²	75.8	50%	0.497	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	119.8	168.6	-174.6	81.5	0	0	0	108	K173 K174 Q178 L182	K173-L180 CarbonylContact C-O 3.54Å; K173-L180 WeakPolarHBondContact CA-O 3.33Å; K174-L180 HydrophobicContact CB-CB 4.46Å; K174-L180 PolarHBondContact N-O 3.47Å; K174-L180 PolarHBondContact O-N 3.1Å; Q178-L180 PolarHBondContact O-N 3.48Å; Q178-L180 VanDerWaalsContact O-N 3.11Å; L180-L182 HydrophobicContact CD2-CD1 3.73Å; L180-L182 HydrophobicContact CG-CD1 4.21Å
181	N	84.3	Confident	83.7	Confident	79 Å²	79	80 Å²	80	42%	0.422	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	112.2	175.9	-169.1	-14	0	0	0	109.2	Q14 W171	Q14-N181 PolarHBondContact NE2-ND2 3.05Å; Q14-N181 VanDerWaalsContact NE2-ND2 3.16Å; Q14-N181 PolarHBondContact NE2-OD1 3.17Å; W171-N181 PolarHBondContact NE1-OD1 3.41Å; W171-N181 VanDerWaalsContact NE1-OD1 3.11Å
182	L	83.4	Confident	84.2	Confident	30 Å²	30	78 Å²	78	16%	0.157	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	118.5	177.3	-88.3	151.3	0	0	0	107.8	L172 L180 Y225 T229	L172-L182 HydrophobicContact CB-CB 4.09Å; L172-L182 PolarHBondContact N-O 2.93Å; L172-L182 PolarHBondContact O-N 2.8Å; L180-L182 HydrophobicContact CD2-CD1 3.73Å; L180-L182 HydrophobicContact CG-CD1 4.21Å; L182-Y225 HydrophobicContact CB-CD1 4.12Å; L182-Y225 HydrophobicContact CB-CE1 4.41Å; L182-Y225 HydrophobicContact CD2-CD1 3.95Å; L182-T229 HydrophobicContact CD2-CG2 4.07Å
183	S	84.5	Confident	84.6	Confident	35 Å²	35	79.7 Å²	79.7	25%	0.245	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	151.4	-174.6	67.7	0	0	0	0	111.6	P13 Q14 L170 Y225	P13-S183 WeakPolarHBondContact CG-OG 3.37Å; Q14-S183 PolarHBondContact NE2-OG 3.46Å; Q14-S183 PolarHBondContact OE1-OG 3.1Å; L170-S183 VanDerWaalsContact O-CA 3.31Å; L170-S183 WeakPolarHBondContact O-CA 3.37Å; S183-Y225 VanDerWaalsContact C-OH 3.32Å
184	G	81.8	Confident	85	Confident	18 Å²	18	77.7 Å²	77.7	19%	0.186	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.7	179	178.7	0	0	0	0	0	111.5	L170 Y225	L170-G184 PolarHBondContact N-O 3.01Å; L170-G184 PolarHBondContact O-N 3.11Å; G184-Y225 WeakPolarHBondContact CA-OH 3.49Å; G184-Y225 PolarHBondContact N-OH 2.97Å; G184-Y225 PolarHBondContact O-OH 3.28Å
185	S	86.3	Confident	85.5	Confident	74 Å²	74	77 Å²	77	52%	0.517	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	154.6	176.4	57.6	0	0	0	0	110.4	L168	L168-S185 CarbonylContact O-C 3.11Å; L168-S185 WeakPolarHBondContact O-CA 3.48Å; L168-S185 WeakPolarHBondContact O-CB 3.41Å
186	I	88.9	Confident	86.4	Confident	29 Å²	29	72.8 Å²	72.8	15%	0.149	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	132.5	168.8	-170.2	170.5	0	0	0	108	T167 L168 R188 M217 L221	T167-I186 CarbonylContact C-O 3.56Å; T167-I186 WeakPolarHBondContact CA-O 3.47Å; L168-I186 HydrophobicContact CB-CG2 4Å; L168-I186 HydrophobicContact CD1-CG2 4.42Å; L168-I186 HydrophobicContact CG-CG2 4.44Å; L168-I186 PolarHBondContact N-O 3.47Å; L168-I186 PolarHBondContact O-N 3.18Å; I186-R188 HydrophobicContact CG1-CG 4.45Å; I186-M217 HydrophobicContact CG2-CB 4.29Å; I186-M217 HydrophobicContact CG2-SD 4.42Å; I186-L221 HydrophobicContact CB-CD2 4.18Å; I186-L221 HydrophobicContact CG2-CD1 4.07Å; I186-L221 HydrophobicContact CG2-CD2 3.73Å; I186-L221 HydrophobicContact CG2-CG 3.77Å
187	T	90.7	Very high	87.3	Confident	75 Å²	75	75.6 Å²	75.6	46%	0.46	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	132.7	174.3	-55	0	0	0	0	109.3	T165 S166 T167	T165-T187 HydrophobicContact CG2-CG2 4.04Å; S166-T187 CarbonylContact O-C 3.47Å; S166-T187 VanDerWaalsContact O-CA 3.26Å; S166-T187 WeakPolarHBondContact O-CA 3.09Å; T167-T187 WeakPolarHBondContact OG1-CG2 3.31Å; T167-T187 PolarHBondContact OG1-OG1 3.08Å
188	R	94	Very high	88.1	Confident	135 Å²	135	77.9 Å²	77.9	51%	0.509	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	153.4	176.8	-68.9	-65.8	-174.1	172.8	-0.5	110.4	S166 I186 M213 M217	S166-R188 PolarHBondContact N-O 3.14Å; S166-R188 PolarHBondContact O-N 3.41Å; I186-R188 HydrophobicContact CG1-CG 4.45Å; R188-M213 HydrophobicContact CB-CE 3.81Å; R188-M213 HydrophobicContact CB-SD 3.64Å; R188-M213 HydrophobicContact CG-SD 4.45Å; R188-M217 HydrophobicContact CB-CG 4.16Å; R188-M217 HydrophobicContact CB-SD 3.87Å; R188-M217 HydrophobicContact CG-CG 3.85Å; R188-M217 HydrophobicContact CG-SD 4Å
189	Q	95.4	Very high	88.4	Confident	131 Å²	131	72.9 Å²	72.9	61%	0.612	40%	0.396	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.7	146.2	176.5	-70.3	-177.6	-30.4	0	0	110.6	L164 T165 M213	L164-Q189 CarbonylContact O-C 3.59Å; L164-Q189 VanDerWaalsContact O-CA 3.27Å; L164-Q189 WeakPolarHBondContact O-CA 3.5Å; T165-Q189 HydrophobicContact CG2-CG 3.93Å; T165-Q189 PolarHBondContact OG1-NE2 3.14Å; T165-Q189 VanDerWaalsContact OG1-NE2 3.11Å; Q189-M213 VanDerWaalsContact C-CE 3.47Å
190	M	95.9	Very high	88.6	Confident	36 Å²	36	69.5 Å²	69.5	18%	0.177	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	138.7	174.8	-179.8	-175.4	-44.4	0	0	109.3	L164 M209 M213	L164-M190 PolarHBondContact N-O 2.77Å; L164-M190 PolarHBondContact O-N 2.81Å; M190-M209 HydrophobicContact CG-CE 4.29Å; M190-M209 HydrophobicContact SD-CE 4.41Å; M190-M213 HydrophobicContact CB-CE 3.39Å; M190-M213 HydrophobicContact CE-CB 4.09Å; M190-M213 HydrophobicContact CE-CE 3.76Å; M190-M213 HydrophobicContact CE-SD 3.98Å
191	E	96.8	Very high	89.1	Confident	109 Å²	109	65.7 Å²	65.7	51%	0.509	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	141.8	174.5	-70.2	177.3	-172.5	0	0	109.3	H161 Y162 K163	H161-E191 IonicContact CE1-OE2 3.77Å; H161-E191 IonicContact NE2-OE2 3.95Å; Y162-E191 CarbonylContact O-C 3.5Å; Y162-E191 VanDerWaalsContact O-CA 3.25Å; Y162-E191 WeakPolarHBondContact O-CA 3.32Å; K163-E191 HydrophobicContact CB-CG 4Å; K163-E191 HydrophobicContact CD-CG 4.4Å; K163-E191 WeakPolarHBondContact CD-OE1 3.14Å; K163-E191 VanDerWaalsContact CE-OE1 3.32Å; K163-E191 WeakPolarHBondContact CE-OE1 3.29Å; K163-E191 HydrophobicContact CG-CG 3.81Å; K163-E191 IonicContact NZ-OE1 3.72Å
192	A	95.4	Very high	89.6	Confident	30 Å²	30	62 Å²	62	25%	0.248	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	142.8	177.8	0	0	0	0	0	111.3	Y162 M209	Y162-A192 WeakPolarHBondContact CD2-O 3.48Å; Y162-A192 PolarHBondContact N-O 2.87Å; Y162-A192 PolarHBondContact O-N 2.8Å; A192-M209 HydrophobicContact CB-CE 3.94Å; A192-M209 HydrophobicContact CB-SD 4.11Å
193	D	94.9	Very high	90.2	Very high	86 Å²	86	61.4 Å²	61.4	46%	0.46	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	131.9	166	-81.4	-6.8	0	0	0	109	K154 A160 H161	K154-D193 IonicContact NZ-OD1 2.74Å; K154-D193 IonicContact NZ-OD2 3.09Å; K154-D193 PolarHBondContact NZ-OD2 2.82Å; A160-D193 WeakPolarHBondContact O-CA 3.45Å; H161-D193 WeakPolarHBondContact CA-OD1 3.49Å; H161-D193 WeakPolarHBondContact CB-OD1 3.26Å; H161-D193 IonicContact CE1-OD1 3.74Å; H161-D193 IonicContact CG-OD1 2.65Å; H161-D193 IonicContact ND1-OD1 3.85Å; H161-D193 PolarHBondContact ND1-OD1 2.85Å
194	A	94.5	Very high	90.7	Very high	4 Å²	4	65.3 Å²	65.3	3%	0.033	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	141.6	177.2	0	0	0	0	0	112.8	N159 A160 Y162 N205	N159-A194 PolarHBondContact OD1-N 3.4Å; N159-A194 PolarHBondContact OD1-O 3Å; A160-A194 PolarHBondContact N-O 2.82Å; A160-A194 VanDerWaalsContact N-O 3.08Å; A160-A194 PolarHBondContact O-N 3.25Å; Y162-A194 HydrophobicContact CD2-CB 4.15Å; Y162-A194 HydrophobicContact CE2-CB 3.71Å; A194-N205 HydrophobicContact CB-CB 4.37Å
195	P	93.5	Very high	91.4	Very high	86 Å²	86	65.3 Å²	65.3	56%	0.558	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.8	146.2	179	28.6	-34.6	0	0	0	111.4	R158 N205	R158-P195 CarbonylContact O-C 3.59Å; R158-P195 VanDerWaalsContact O-CA 3.3Å; R158-P195 WeakPolarHBondContact O-CA 3.36Å; P195-N205 PolarHBondContact O-ND2 2.79Å; P195-N205 VanDerWaalsContact O-ND2 3.12Å
196	V	91.4	Very high	91.9	Very high	14 Å²	14	62.1 Å²	62.1	9%	0.085	33%	0.332	C	S	.	.			trans	-125.4	106	179.5	-178	0	0	0	0	107.2	R158 A160 Y162 A201 H202	R158-V196 PolarHBondContact O-N 3.38Å; A160-V196 HydrophobicContact CB-CG2 3.73Å; Y162-V196 WeakPolarHBondContact OH-CG2 3.37Å; V196-A201 HydrophobicContact CG1-CB 4.47Å; V196-H202 WeakPolarHBondContact CG1-NE2 3.27Å; V196-H202 VanDerWaalsContact CG2-CE1 3.49Å; V196-H202 WeakPolarHBondContact CG2-CE1 3.46Å
197	N	83.4	Confident	92.2	Very high	145 Å²	145	61.6 Å²	61.6	78%	0.775	33%	0.334	S	S	*	.	S	Bend	trans	-94	-36.2	177.9	-64	-14.5	0	0	0	111.3
198	E	84.7	Confident	92.5	Very high	138 Å²	138	64.7 Å²	64.7	65%	0.645	34%	0.337	S	S	*	.	S	Bend	trans	-142.2	162.6	-178.7	-68.2	-178.1	-178.6	0	0	109.3	S200 A201	E198-S200 PolarHBondContact O-N 3.09Å; E198-A201 WeakPolarHBondContact O-CB 3.27Å; E198-A201 PolarHBondContact O-N 2.82Å
199	S	76	Confident	92.6	Very high	65 Å²	65	58.7 Å²	58.7	46%	0.455	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-35.2	-179.7	-46	0	0	0	0	112.7	L91 A201 H202	L91-S199 WeakPolarHBondContact CD1-O 3.45Å; S199-A201 PolarHBondContact O-N 2.65Å; S199-H202 WeakPolarHBondContact O-CB 3.28Å; S199-H202 PolarHBondContact O-CD2 2.86Å; S199-H202 PolarHBondContact O-N 3.43Å
200	S	84.2	Confident	92.7	Very high	45 Å²	45	52.5 Å²	52.5	32%	0.315	29%	0.286	S	S	.	.	H	α-helix	trans	-61.8	-23.8	174.7	57.8	0	0	0	0	113.1	E198 H202 V203 I204	E198-S200 PolarHBondContact O-N 3.09Å; S200-H202 PolarHBondContact O-N 2.79Å; S200-V203 PolarHBondContact O-N 3.06Å; S200-V203 VanDerWaalsContact O-N 3.17Å; S200-I204 PolarHBondContact O-N 2.84Å
201	A	91.8	Very high	92.7	Very high	16 Å²	16	54.3 Å²	54.3	13%	0.132	29%	0.294	C	S	.	.	H	α-helix	trans	-63.8	-29.6	177.4	0	0	0	0	0	111.8	V196 E198 S199 I204 N205	V196-A201 HydrophobicContact CG1-CB 4.47Å; E198-A201 WeakPolarHBondContact O-CB 3.27Å; E198-A201 PolarHBondContact O-N 2.82Å; S199-A201 PolarHBondContact O-N 2.65Å; A201-I204 PolarHBondContact O-N 2.78Å; A201-N205 WeakPolarHBondContact O-CB 3.35Å; A201-N205 PolarHBondContact O-N 2.78Å; A201-N205 PolarHBondContact O-ND2 3.31Å; A201-N205 VanDerWaalsContact O-ND2 3.15Å
202	H	94.5	Very high	92.7	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.009	29%	0.288	C	S	.	.	H	α-helix	trans	-62.5	-45.5	174.2	-67.8	-65.3	0	0	0	111.5	L91 F123 E153 Y162 V196 S199 S200 I204 N205 I206	L91-H202 HydrophobicContact CD2-CB 4.33Å; F123-H202 HydrophobicContact CZ-CB 4.01Å; F123-H202 AromaticContact CZ-CG 3.97Å; E153-H202 IonicContact OE1-CE1 2.78Å; E153-H202 IonicContact OE1-NE2 3.41Å; E153-H202 PolarHBondContact OE1-NE2 3.37Å; Y162-H202 AromaticContact CE1-ND1 3.96Å; Y162-H202 AromaticContact CZ-ND1 3.8Å; Y162-H202 PolarHBondContact OH-ND1 2.82Å; V196-H202 WeakPolarHBondContact CG1-NE2 3.27Å; V196-H202 VanDerWaalsContact CG2-CE1 3.49Å; V196-H202 WeakPolarHBondContact CG2-CE1 3.46Å; S199-H202 WeakPolarHBondContact O-CB 3.28Å; S199-H202 PolarHBondContact O-CD2 2.86Å; S199-H202 PolarHBondContact O-N 3.43Å; S200-H202 PolarHBondContact O-N 2.79Å; H202-I204 VanDerWaalsContact C-N 3.28Å; H202-I204 PolarHBondContact O-N 3.09Å; H202-N205 PolarHBondContact O-N 2.84Å; H202-I206 HydrophobicContact CB-CD1 4.43Å; H202-I206 WeakPolarHBondContact O-CB 3.38Å; H202-I206 WeakPolarHBondContact O-CD1 3.43Å; H202-I206 WeakPolarHBondContact O-CG1 3.27Å; H202-I206 PolarHBondContact O-N 2.83Å
203	V	95.6	Very high	92.7	Very high	16 Å²	16	52 Å²	52	10%	0.097	28%	0.278	C	S	.	.	H	α-helix	trans	-59.7	-43.1	178.9	-171.8	0	0	0	0	110.6	L91 E94 A98 S200 G207	L91-V203 HydrophobicContact CD1-CG2 3.42Å; L91-V203 VanDerWaalsContact CD1-CG2 3.42Å; L91-V203 HydrophobicContact CG-CG2 4.33Å; E94-V203 HydrophobicContact CB-CG2 4.49Å; A98-V203 HydrophobicContact CB-CG1 3.73Å; S200-V203 PolarHBondContact O-N 3.06Å; S200-V203 VanDerWaalsContact O-N 3.17Å; V203-G207 PolarHBondContact O-N 3.02Å
204	I	95.3	Very high	92.7	Very high	117 Å²	117	48 Å²	48	60%	0.6	26%	0.256	S	S	*	.	H	α-helix	trans	-65.5	-47.1	178.8	-61.8	169.3	0	0	0	111.1	S200 A201 H202 G207 R208	S200-I204 PolarHBondContact O-N 2.84Å; A201-I204 PolarHBondContact O-N 2.78Å; H202-I204 VanDerWaalsContact C-N 3.28Å; H202-I204 PolarHBondContact O-N 3.09Å; I204-G207 PolarHBondContact O-N 2.8Å; I204-R208 WeakPolarHBondContact O-CB 3.28Å; I204-R208 PolarHBondContact O-N 2.83Å
205	N	95.9	Very high	92.6	Very high	19 Å²	19	50.6 Å²	50.6	10%	0.102	27%	0.27	C	S	.	.	H	α-helix	trans	-62.9	-45.8	-179.7	-73.4	-29.8	0	0	0	111.3	Y162 A194 P195 A201 H202 M209	Y162-N205 HydrophobicContact CE1-CB 3.99Å; Y162-N205 HydrophobicContact CE2-CB 4.27Å; Y162-N205 PolarHBondContact OH-ND2 3.07Å; Y162-N205 VanDerWaalsContact OH-ND2 3.07Å; A194-N205 HydrophobicContact CB-CB 4.37Å; P195-N205 PolarHBondContact O-ND2 2.79Å; P195-N205 VanDerWaalsContact O-ND2 3.12Å; A201-N205 WeakPolarHBondContact O-CB 3.35Å; A201-N205 PolarHBondContact O-N 2.78Å; A201-N205 PolarHBondContact O-ND2 3.31Å; A201-N205 VanDerWaalsContact O-ND2 3.15Å; H202-N205 PolarHBondContact O-N 2.84Å; N205-M209 WeakPolarHBondContact O-CG 3.49Å; N205-M209 PolarHBondContact O-N 2.96Å; N205-M209 VanDerWaalsContact O-N 3.15Å
206	I	96.6	Very high	92.7	Very high	7 Å²	7	51.5 Å²	51.5	4%	0.036	27%	0.265	C	S	.	.	H	α-helix	trans	-63.9	-48	177.1	-64.5	165.5	0	0	0	110	F99 F123 V149 V151 Y162 H202 R208 M209 V210	F99-I206 HydrophobicContact CE2-CG2 4.38Å; F99-I206 HydrophobicContact CZ-CG2 4.2Å; F123-I206 HydrophobicContact CE2-CD1 4.2Å; F123-I206 HydrophobicContact CZ-CD1 4.3Å; V149-I206 HydrophobicContact CG1-CD1 4.13Å; V149-I206 HydrophobicContact CG1-CG1 4.38Å; V149-I206 HydrophobicContact CG1-CG2 4.08Å; V149-I206 HydrophobicContact CG2-CG1 4.23Å; V151-I206 HydrophobicContact CG2-CD1 4.17Å; Y162-I206 HydrophobicContact CD1-CG1 4Å; Y162-I206 HydrophobicContact CE1-CG1 3.95Å; H202-I206 HydrophobicContact CB-CD1 4.43Å; H202-I206 WeakPolarHBondContact O-CB 3.38Å; H202-I206 WeakPolarHBondContact O-CD1 3.43Å; H202-I206 WeakPolarHBondContact O-CG1 3.27Å; H202-I206 PolarHBondContact O-N 2.83Å; I206-R208 VanDerWaalsContact C-N 3.33Å; I206-R208 PolarHBondContact O-N 3.26Å; I206-M209 PolarHBondContact O-N 3.21Å; I206-M209 VanDerWaalsContact O-N 3.13Å; I206-V210 HydrophobicContact CG2-CG2 4.18Å; I206-V210 WeakPolarHBondContact O-CG2 3.49Å; I206-V210 PolarHBondContact O-N 2.93Å
207	G	96.4	Very high	92.8	Very high	18 Å²	18	50.9 Å²	50.9	19%	0.186	26%	0.261	C	S	.	.	H	α-helix	trans	-55.2	-46.4	178.5	0	0	0	0	0	112.5	V203 I204 M209 V210 E211	V203-G207 PolarHBondContact O-N 3.02Å; I204-G207 PolarHBondContact O-N 2.8Å; G207-M209 PolarHBondContact O-N 2.82Å; G207-V210 PolarHBondContact O-N 2.82Å; G207-E211 WeakPolarHBondContact O-CB 3.34Å; G207-E211 PolarHBondContact O-N 2.79Å
208	R	96	Very high	93.2	Very high	140 Å²	140	47.3 Å²	47.3	53%	0.528	24%	0.237	S	C	.	.	H	α-helix	trans	-62.1	-42.7	176.7	-175	179.4	62.6	145.9	1.1	112.5	I204 I206 E212	I204-R208 WeakPolarHBondContact O-CB 3.28Å; I204-R208 PolarHBondContact O-N 2.83Å; I206-R208 VanDerWaalsContact C-N 3.33Å; I206-R208 PolarHBondContact O-N 3.26Å; R208-E212 WeakPolarHBondContact O-CB 3.32Å; R208-E212 PolarHBondContact O-N 3.31Å
209	M	96.7	Very high	93.5	Very high	9 Å²	9	44.6 Å²	44.6	4%	0.044	23%	0.233	C	C	.	.	H	α-helix	trans	-65.7	-42.2	178.2	-71	179.1	71.6	0	0	111.8	Y162 L164 M190 A192 N205 I206 G207 M213	Y162-M209 WeakPolarHBondContact CB-SD 3.36Å; Y162-M209 HydrophobicContact CD1-SD 4.47Å; Y162-M209 HydrophobicContact CG-SD 3.98Å; L164-M209 HydrophobicContact CB-CE 3.86Å; L164-M209 HydrophobicContact CD2-CB 3.9Å; L164-M209 WeakPolarHBondContact CD2-O 3.42Å; M190-M209 HydrophobicContact CG-CE 4.29Å; M190-M209 HydrophobicContact SD-CE 4.41Å; A192-M209 HydrophobicContact CB-CE 3.94Å; A192-M209 HydrophobicContact CB-SD 4.11Å; N205-M209 WeakPolarHBondContact O-CG 3.49Å; N205-M209 PolarHBondContact O-N 2.96Å; N205-M209 VanDerWaalsContact O-N 3.15Å; I206-M209 PolarHBondContact O-N 3.21Å; I206-M209 VanDerWaalsContact O-N 3.13Å; G207-M209 PolarHBondContact O-N 2.82Å; M209-M213 VanDerWaalsContact O-CB 3.28Å; M209-M213 WeakPolarHBondContact O-CB 3.32Å; M209-M213 PolarHBondContact O-N 3.48Å
210	V	97.2	Very high	94.2	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-62.8	-48.1	177	170.2	0	0	0	0	110.4	F99 H147 L164 I206 G207 E212 M213 E214	F99-V210 HydrophobicContact CE1-CB 4.07Å; F99-V210 HydrophobicContact CE1-CG1 3.86Å; F99-V210 HydrophobicContact CE1-CG2 4.31Å; F99-V210 HydrophobicContact CZ-CB 4.25Å; F99-V210 HydrophobicContact CZ-CG1 4.46Å; F99-V210 HydrophobicContact CZ-CG2 4.09Å; H147-V210 HydrophobicContact CB-CG2 4.09Å; L164-V210 HydrophobicContact CD1-CG2 4.22Å; L164-V210 HydrophobicContact CD2-CG2 4.31Å; I206-V210 HydrophobicContact CG2-CG2 4.18Å; I206-V210 WeakPolarHBondContact O-CG2 3.49Å; I206-V210 PolarHBondContact O-N 2.93Å; G207-V210 PolarHBondContact O-N 2.82Å; V210-E212 PolarHBondContact O-N 2.84Å; V210-M213 PolarHBondContact O-N 3.47Å; V210-E214 WeakPolarHBondContact O-CB 3.48Å; V210-E214 PolarHBondContact O-N 2.87Å
211	E	96.6	Very high	94.3	Very high	73 Å²	73	41.3 Å²	41.3	34%	0.341	21%	0.209	S	C	.	.	H	α-helix	trans	-58.8	-49.4	178.4	-178	-171.2	172	0	0	112	Y102 Y106 G207 M213 E214 N215	Y102-E211 HydrophobicContact CE2-CB 3.97Å; Y102-E211 HydrophobicContact CE2-CG 4.07Å; Y106-E211 PolarHBondContact OH-OE1 3.36Å; G207-E211 WeakPolarHBondContact O-CB 3.34Å; G207-E211 PolarHBondContact O-N 2.79Å; E211-M213 VanDerWaalsContact C-N 3.33Å; E211-M213 PolarHBondContact O-N 3.28Å; E211-E214 PolarHBondContact O-N 3.43Å; E211-N215 WeakPolarHBondContact O-CB 3.3Å; E211-N215 PolarHBondContact O-N 3.05Å; E211-N215 PolarHBondContact O-ND2 2.93Å
212	E	96.4	Very high	94	Very high	84 Å²	84	45.2 Å²	45.2	39%	0.393	23%	0.228	S	C	.	.	H	α-helix	trans	-61.9	-42.8	179.4	-173.1	-177.7	157.7	0	0	111.5	R208 V210 K216	R208-E212 WeakPolarHBondContact O-CB 3.32Å; R208-E212 PolarHBondContact O-N 3.31Å; V210-E212 PolarHBondContact O-N 2.84Å; E212-K216 HydrophobicContact CG-CD 4.32Å; E212-K216 WeakPolarHBondContact O-CG 3.48Å; E212-K216 PolarHBondContact O-N 2.79Å; E212-K216 VanDerWaalsContact O-N 3.15Å; E212-K216 WeakPolarHBondContact OE1-CE 3.37Å; E212-K216 IonicContact OE1-NZ 2.93Å; E212-K216 PolarHBondContact OE1-NZ 3.07Å
213	M	95.5	Very high	93.6	Very high	8 Å²	8	51.3 Å²	51.3	4%	0.039	26%	0.256	C	S	.	.	H	α-helix	trans	-67.1	-47.3	179.4	-172.2	64.8	95.3	0	0	111.7	L164 R188 Q189 M190 M209 V210 E211 N215 K216 M217	L164-M213 HydrophobicContact CD2-CB 3.94Å; L164-M213 HydrophobicContact CD2-CG 4.42Å; R188-M213 HydrophobicContact CB-CE 3.81Å; R188-M213 HydrophobicContact CB-SD 3.64Å; R188-M213 HydrophobicContact CG-SD 4.45Å; Q189-M213 VanDerWaalsContact C-CE 3.47Å; M190-M213 HydrophobicContact CB-CE 3.39Å; M190-M213 HydrophobicContact CE-CB 4.09Å; M190-M213 HydrophobicContact CE-CE 3.76Å; M190-M213 HydrophobicContact CE-SD 3.98Å; M209-M213 VanDerWaalsContact O-CB 3.28Å; M209-M213 WeakPolarHBondContact O-CB 3.32Å; M209-M213 PolarHBondContact O-N 3.48Å; V210-M213 PolarHBondContact O-N 3.47Å; E211-M213 VanDerWaalsContact C-N 3.33Å; E211-M213 PolarHBondContact O-N 3.28Å; M213-N215 VanDerWaalsContact C-N 3.31Å; M213-N215 PolarHBondContact O-N 2.85Å; M213-K216 PolarHBondContact O-N 2.79Å; M213-M217 HydrophobicContact CG-CE 3.72Å; M213-M217 HydrophobicContact CG-CG 4.11Å; M213-M217 HydrophobicContact CG-SD 3.98Å; M213-M217 WeakPolarHBondContact O-CB 3.45Å; M213-M217 VanDerWaalsContact O-CG 3.27Å; M213-M217 WeakPolarHBondContact O-CG 3.48Å; M213-M217 PolarHBondContact O-N 3.08Å; M213-M217 HydrophobicContact SD-CG 4.08Å; M213-M217 HydrophobicContact SD-SD 4.33Å
214	E	94	Very high	93	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-56.7	-45.9	176.8	-90	-145.9	168.3	0	0	111.6	Y102 S145 H147 V210 E211 K216 M217 R218	Y102-E214 PolarHBondContact OH-OE2 3.15Å; Y102-E214 VanDerWaalsContact OH-OE2 3.07Å; S145-E214 WeakPolarHBondContact CB-OE1 3.19Å; S145-E214 PolarHBondContact OG-OE1 3.18Å; H147-E214 VanDerWaalsContact CE1-CG 3.43Å; H147-E214 WeakPolarHBondContact CE1-CG 3.45Å; H147-E214 WeakPolarHBondContact NE2-CG 3.41Å; H147-E214 IonicContact NE2-OE1 3.27Å; H147-E214 PolarHBondContact NE2-OE1 3.27Å; V210-E214 WeakPolarHBondContact O-CB 3.48Å; V210-E214 PolarHBondContact O-N 2.87Å; E211-E214 PolarHBondContact O-N 3.43Å; E214-K216 PolarHBondContact O-N 2.83Å; E214-M217 PolarHBondContact O-N 3.15Å; E214-R218 WeakPolarHBondContact O-CB 3.37Å; E214-R218 PolarHBondContact O-N 3.02Å; E214-R218 IonicContact OE2-CZ 2.77Å; E214-R218 IonicContact OE2-NH1 3.06Å; E214-R218 IonicContact OE2-NH2 3.77Å; E214-R218 PolarHBondContact OE2-NH2 3.38Å
215	N	94	Very high	92.3	Very high	59 Å²	59	48.9 Å²	48.9	32%	0.316	25%	0.245	S	C	.	.	H	α-helix	trans	-62.4	-41.8	-179.6	-74.4	-30.2	0	0	0	112.3	E211 M213 R218 S219	E211-N215 WeakPolarHBondContact O-CB 3.3Å; E211-N215 PolarHBondContact O-N 3.05Å; E211-N215 PolarHBondContact O-ND2 2.93Å; M213-N215 VanDerWaalsContact C-N 3.31Å; M213-N215 PolarHBondContact O-N 2.85Å; N215-R218 PolarHBondContact OD1-NH1 3.46Å; N215-S219 PolarHBondContact O-N 3.48Å; N215-S219 PolarHBondContact O-OG 3.35Å
216	K	94.7	Very high	91.5	Very high	106 Å²	106	53 Å²	53	46%	0.461	26%	0.262	S	S	.	.	H	α-helix	trans	-64.2	-45.6	174.4	-75	172.6	175.3	173.4	0	112.2	E212 M213 E214 S219 S220	E212-K216 HydrophobicContact CG-CD 4.32Å; E212-K216 WeakPolarHBondContact O-CG 3.48Å; E212-K216 PolarHBondContact O-N 2.79Å; E212-K216 VanDerWaalsContact O-N 3.15Å; E212-K216 WeakPolarHBondContact OE1-CE 3.37Å; E212-K216 IonicContact OE1-NZ 2.93Å; E212-K216 PolarHBondContact OE1-NZ 3.07Å; M213-K216 PolarHBondContact O-N 2.79Å; E214-K216 PolarHBondContact O-N 2.83Å; K216-S219 PolarHBondContact O-N 3.32Å; K216-S220 PolarHBondContact O-N 2.9Å; K216-S220 VanDerWaalsContact O-N 3.08Å; K216-S220 PolarHBondContact O-OG 2.88Å
217	M	93.9	Very high	90.9	Very high	1 Å²	1	53.9 Å²	53.9	1%	0.005	27%	0.273	C	S	.	.	H	α-helix	trans	-70.8	-39	-178.4	-66.3	-168.7	-61.8	0	0	112	L168 I186 R188 M213 E214 S219 S220 L221	L168-M217 HydrophobicContact CD1-CB 3.42Å; L168-M217 VanDerWaalsContact CD1-CB 3.42Å; L168-M217 HydrophobicContact CD1-CE 3.65Å; L168-M217 HydrophobicContact CD1-CG 4.42Å; L168-M217 HydrophobicContact CD1-SD 4.25Å; L168-M217 HydrophobicContact CD2-CE 3.71Å; L168-M217 HydrophobicContact CG-CB 4.25Å; L168-M217 HydrophobicContact CG-CE 3.37Å; L168-M217 HydrophobicContact CG-SD 4.05Å; I186-M217 HydrophobicContact CG2-CB 4.29Å; I186-M217 HydrophobicContact CG2-SD 4.42Å; R188-M217 HydrophobicContact CB-CG 4.16Å; R188-M217 HydrophobicContact CB-SD 3.87Å; R188-M217 HydrophobicContact CG-CG 3.85Å; R188-M217 HydrophobicContact CG-SD 4Å; M213-M217 HydrophobicContact CG-CE 3.72Å; M213-M217 HydrophobicContact CG-CG 4.11Å; M213-M217 HydrophobicContact CG-SD 3.98Å; M213-M217 WeakPolarHBondContact O-CB 3.45Å; M213-M217 VanDerWaalsContact O-CG 3.27Å; M213-M217 WeakPolarHBondContact O-CG 3.48Å; M213-M217 PolarHBondContact O-N 3.08Å; M213-M217 HydrophobicContact SD-CG 4.08Å; M213-M217 HydrophobicContact SD-SD 4.33Å; E214-M217 PolarHBondContact O-N 3.15Å; M217-S219 VanDerWaalsContact C-N 3.31Å; M217-S219 PolarHBondContact O-N 3.29Å; M217-S220 CarbonylContact O-C 3.55Å; M217-S220 WeakPolarHBondContact O-CB 3.49Å; M217-S220 PolarHBondContact O-N 2.99Å; M217-S220 VanDerWaalsContact O-N 3.14Å; M217-L221 WeakPolarHBondContact O-CG 3.41Å; M217-L221 PolarHBondContact O-N 3.03Å
218	R	91	Very high	90.2	Very high	70 Å²	70	58.7 Å²	58.7	26%	0.264	29%	0.289	S	S	.	.	H	α-helix	trans	-58.6	-43.3	174.2	-175.9	178.2	-69.6	116.2	3.7	111.4	W143 E214 N215 L221 N222	W143-R218 HydrophobicContact CH2-CB 4.1Å; W143-R218 HydrophobicContact CH2-CG 4.11Å; E214-R218 WeakPolarHBondContact O-CB 3.37Å; E214-R218 PolarHBondContact O-N 3.02Å; E214-R218 IonicContact OE2-CZ 2.77Å; E214-R218 IonicContact OE2-NH1 3.06Å; E214-R218 IonicContact OE2-NH2 3.77Å; E214-R218 PolarHBondContact OE2-NH2 3.38Å; N215-R218 PolarHBondContact OD1-NH1 3.46Å; R218-L221 PolarHBondContact O-N 3.45Å; R218-N222 PolarHBondContact O-N 2.84Å
219	S	91.2	Very high	89.5	Confident	80 Å²	80	54.6 Å²	54.6	56%	0.559	28%	0.28	S	S	*	.	H	α-helix	trans	-62.5	-43.6	174.9	-55.9	0	0	0	0	111.6	N215 K216 M217 N222 E223	N215-S219 PolarHBondContact O-N 3.48Å; N215-S219 PolarHBondContact O-OG 3.35Å; K216-S219 PolarHBondContact O-N 3.32Å; M217-S219 VanDerWaalsContact C-N 3.31Å; M217-S219 PolarHBondContact O-N 3.29Å; S219-N222 PolarHBondContact O-N 3.09Å; S219-E223 PolarHBondContact O-N 3.33Å
220	S	90	Very high	88.9	Confident	34 Å²	34	58.1 Å²	58.1	24%	0.238	30%	0.299	C	S	.	.	H	α-helix	trans	-63.8	-41.1	176.8	-56.2	0	0	0	0	112.6	K216 M217 E223 V224	K216-S220 PolarHBondContact O-N 2.9Å; K216-S220 VanDerWaalsContact O-N 3.08Å; K216-S220 PolarHBondContact O-OG 2.88Å; M217-S220 CarbonylContact O-C 3.55Å; M217-S220 WeakPolarHBondContact O-CB 3.49Å; M217-S220 PolarHBondContact O-N 2.99Å; M217-S220 VanDerWaalsContact O-N 3.14Å; S220-E223 PolarHBondContact O-N 2.99Å; S220-V224 VanDerWaalsContact O-CG2 3.32Å; S220-V224 WeakPolarHBondContact O-CG2 3.41Å; S220-V224 PolarHBondContact O-N 3.47Å
221	L	87.4	Confident	88.3	Confident	7 Å²	7	62.5 Å²	62.5	4%	0.037	32%	0.322	C	S	.	.	H	α-helix	trans	-62.1	-44.5	176.9	-78.6	171.6	0	0	0	111.1	W143 L168 I186 M217 R218 E223 V224 Y225	W143-L221 HydrophobicContact CH2-CD1 3.71Å; W143-L221 HydrophobicContact CZ3-CD1 3.8Å; L168-L221 HydrophobicContact CB-CD1 3.96Å; L168-L221 HydrophobicContact CD1-CD1 3.67Å; I186-L221 HydrophobicContact CB-CD2 4.18Å; I186-L221 HydrophobicContact CG2-CD1 4.07Å; I186-L221 HydrophobicContact CG2-CD2 3.73Å; I186-L221 HydrophobicContact CG2-CG 3.77Å; M217-L221 WeakPolarHBondContact O-CG 3.41Å; M217-L221 PolarHBondContact O-N 3.03Å; R218-L221 PolarHBondContact O-N 3.45Å; L221-E223 VanDerWaalsContact C-N 3.34Å; L221-E223 PolarHBondContact O-N 2.91Å; L221-V224 PolarHBondContact O-N 3.38Å; L221-Y225 HydrophobicContact CD2-CD2 3.96Å; L221-Y225 HydrophobicContact CD2-CE2 3.4Å; L221-Y225 VanDerWaalsContact CD2-CE2 3.4Å; L221-Y225 WeakPolarHBondContact O-CB 3.34Å; L221-Y225 VanDerWaalsContact O-CD2 3.27Å; L221-Y225 WeakPolarHBondContact O-CD2 3.37Å; L221-Y225 PolarHBondContact O-N 3.25Å
222	N	85.6	Confident	87.7	Confident	98 Å²	98	63.8 Å²	63.8	52%	0.524	33%	0.33	S	S	.	.	H	α-helix	trans	-58.7	-46.2	179	-167.8	22.1	0	0	0	111.6	R218 S219 F226	R218-N222 PolarHBondContact O-N 2.84Å; S219-N222 PolarHBondContact O-N 3.09Å; N222-F226 PolarHBondContact O-N 3.42Å; N222-F226 VanDerWaalsContact O-N 3.1Å; N222-F226 WeakPolarHBondContact OD1-CD2 3.37Å
223	E	86.1	Confident	87.2	Confident	130 Å²	130	63.9 Å²	63.9	61%	0.607	34%	0.336	S	S	*	.	I	π-helix	trans	-64.6	-42.9	178.6	-170	-174.5	165.8	0	0	112.7	S219 S220 L221 G227 K228	S219-E223 PolarHBondContact O-N 3.33Å; S220-E223 PolarHBondContact O-N 2.99Å; L221-E223 VanDerWaalsContact C-N 3.34Å; L221-E223 PolarHBondContact O-N 2.91Å; E223-G227 WeakPolarHBondContact O-CA 3.42Å; E223-G227 PolarHBondContact O-N 3.29Å; E223-K228 PolarHBondContact O-N 2.79Å; E223-K228 VanDerWaalsContact O-N 3.11Å
224	V	82.9	Confident	86.5	Confident	64 Å²	64	67.4 Å²	67.4	39%	0.388	36%	0.355	S	S	.	.	I	π-helix	trans	-72	-47.3	-178.4	174.5	0	0	0	0	111.4	S220 L221 K228 T229	S220-V224 VanDerWaalsContact O-CG2 3.32Å; S220-V224 WeakPolarHBondContact O-CG2 3.41Å; S220-V224 PolarHBondContact O-N 3.47Å; L221-V224 PolarHBondContact O-N 3.38Å; V224-K228 PolarHBondContact O-N 2.88Å; V224-T229 PolarHBondContact O-N 3.47Å; V224-T229 PolarHBondContact O-OG1 3.28Å
225	Y	79.6	Confident	85.9	Confident	19 Å²	19	74.1 Å²	74.1	8%	0.075	39%	0.39	C	S	.	.	I	π-helix	trans	-71.6	-47.7	-173.9	-83.9	-112.5	0	0	0	112.2	L170 L182 S183 G184 L221 T229	L170-Y225 HydrophobicContact CB-CE1 4.41Å; L170-Y225 HydrophobicContact CD2-CD1 4.11Å; L170-Y225 HydrophobicContact CD2-CE1 4.05Å; L170-Y225 HydrophobicContact CD2-CG 4.37Å; L170-Y225 HydrophobicContact CG-CE1 4.3Å; L170-Y225 PolarHBondContact O-OH 2.99Å; L182-Y225 HydrophobicContact CB-CD1 4.12Å; L182-Y225 HydrophobicContact CB-CE1 4.41Å; L182-Y225 HydrophobicContact CD2-CD1 3.95Å; S183-Y225 VanDerWaalsContact C-OH 3.32Å; G184-Y225 WeakPolarHBondContact CA-OH 3.49Å; G184-Y225 PolarHBondContact N-OH 2.97Å; G184-Y225 PolarHBondContact O-OH 3.28Å; L221-Y225 HydrophobicContact CD2-CD2 3.96Å; L221-Y225 HydrophobicContact CD2-CE2 3.4Å; L221-Y225 VanDerWaalsContact CD2-CE2 3.4Å; L221-Y225 WeakPolarHBondContact O-CB 3.34Å; L221-Y225 VanDerWaalsContact O-CD2 3.27Å; L221-Y225 WeakPolarHBondContact O-CD2 3.37Å; L221-Y225 PolarHBondContact O-N 3.25Å; Y225-T229 WeakPolarHBondContact O-CB 3.42Å; Y225-T229 PolarHBondContact O-OG1 3.15Å
226	F	79.4	Confident	85.4	Confident	105 Å²	105	78.2 Å²	78.2	46%	0.461	41%	0.411	S	S	.	.	I	π-helix	trans	-101	-20.2	-172.3	-55.6	-72	0	0	0	113.5	L172 N222 N230	L172-F226 HydrophobicContact CD1-CE1 4.41Å; L172-F226 HydrophobicContact CD1-CZ 3.76Å; N222-F226 PolarHBondContact O-N 3.42Å; N222-F226 VanDerWaalsContact O-N 3.1Å; N222-F226 WeakPolarHBondContact OD1-CD2 3.37Å; F226-N230 WeakPolarHBondContact O-CB 3.41Å
227	G	83.7	Confident	84.6	Confident	26 Å²	26	82.7 Å²	82.7	27%	0.268	43%	0.425	S	S	.	.	I	π-helix	trans	-84.9	-78.4	170.9	0	0	0	0	0	110.6	E223 T229 N230 D231	E223-G227 WeakPolarHBondContact O-CA 3.42Å; E223-G227 PolarHBondContact O-N 3.29Å; G227-T229 PolarHBondContact O-N 2.96Å; G227-N230 WeakPolarHBondContact O-CB 3.16Å; G227-N230 PolarHBondContact O-N 3.42Å; G227-D231 PolarHBondContact O-N 2.98Å
228	K	82.7	Confident	83.4	Confident	119 Å²	119	85.6 Å²	85.6	52%	0.517	45%	0.445	S	S	.	.	I	π-helix	trans	-58.2	-42.4	-170.6	-65.8	-171	178.1	-172	0	114	E223 V224 N230 D231 I232	E223-K228 PolarHBondContact O-N 2.79Å; E223-K228 VanDerWaalsContact O-N 3.11Å; V224-K228 PolarHBondContact O-N 2.88Å; K228-N230 VanDerWaalsContact C-N 3.3Å; K228-N230 PolarHBondContact O-N 2.8Å; K228-D231 PolarHBondContact O-N 3.15Å; K228-I232 WeakPolarHBondContact O-CD1 3.25Å; K228-I232 VanDerWaalsContact O-CG1 3.23Å; K228-I232 WeakPolarHBondContact O-CG1 3.38Å; K228-I232 PolarHBondContact O-N 3.35Å
229	T	81.1	Confident	82.4	Confident	54 Å²	54	89.8 Å²	89.8	33%	0.331	47%	0.472	S	S	.	.	H	α-helix	trans	-65.1	-38.4	179.8	-38	0	0	0	0	111.4	L182 V224 Y225 G227 I232 V233	L182-T229 HydrophobicContact CD2-CG2 4.07Å; V224-T229 PolarHBondContact O-N 3.47Å; V224-T229 PolarHBondContact O-OG1 3.28Å; Y225-T229 WeakPolarHBondContact O-CB 3.42Å; Y225-T229 PolarHBondContact O-OG1 3.15Å; G227-T229 PolarHBondContact O-N 2.96Å; T229-I232 PolarHBondContact O-N 2.78Å; T229-V233 VanDerWaalsContact O-CG2 3.28Å; T229-V233 WeakPolarHBondContact O-CG2 3.41Å; T229-V233 PolarHBondContact O-N 3.18Å
230	N	83.1	Confident	81.3	Confident	83 Å²	83	90.3 Å²	90.3	44%	0.444	47%	0.465	S	S	.	.	H	α-helix	trans	-66.9	-45.5	176.5	-171.9	8.9	0	0	0	110.9	F226 G227 K228 I232 V233 N234	F226-N230 WeakPolarHBondContact O-CB 3.41Å; G227-N230 WeakPolarHBondContact O-CB 3.16Å; G227-N230 PolarHBondContact O-N 3.42Å; K228-N230 VanDerWaalsContact C-N 3.3Å; K228-N230 PolarHBondContact O-N 2.8Å; N230-I232 VanDerWaalsContact C-N 3.32Å; N230-I232 PolarHBondContact O-N 2.72Å; N230-V233 PolarHBondContact O-N 3.47Å; N230-N234 WeakPolarHBondContact O-CB 3.43Å; N230-N234 VanDerWaalsContact O-CG 3.26Å; N230-N234 PolarHBondContact O-N 2.9Å; N230-N234 PolarHBondContact O-ND2 3.36Å; N230-N234 VanDerWaalsContact O-ND2 3.15Å; N230-N234 PolarHBondContact OD1-ND2 3.13Å
231	D	84.4	Confident	80.3	Confident	93 Å²	93	92.4 Å²	92.4	50%	0.497	48%	0.477	S	S	.	.	H	α-helix	trans	-57.6	-45.4	176.1	-64.5	-22	0	0	0	111.4	G227 K228 V233 N234 I235	G227-D231 PolarHBondContact O-N 2.98Å; K228-D231 PolarHBondContact O-N 3.15Å; D231-V233 PolarHBondContact O-N 2.89Å; D231-N234 PolarHBondContact O-N 2.8Å; D231-I235 WeakPolarHBondContact O-CD1 3.42Å; D231-I235 WeakPolarHBondContact O-CG1 3.43Å; D231-I235 PolarHBondContact O-N 2.88Å
232	I	85	Confident	79.5	Confident	100 Å²	100	100.2 Å²	100.2	51%	0.513	51%	0.513	S	S	.	.	H	α-helix	trans	-61.9	-43.9	177.7	-68.5	164.6	0	0	0	111.1	K228 T229 N230 I235 L236	K228-I232 WeakPolarHBondContact O-CD1 3.25Å; K228-I232 VanDerWaalsContact O-CG1 3.23Å; K228-I232 WeakPolarHBondContact O-CG1 3.38Å; K228-I232 PolarHBondContact O-N 3.35Å; T229-I232 PolarHBondContact O-N 2.78Å; N230-I232 VanDerWaalsContact C-N 3.32Å; N230-I232 PolarHBondContact O-N 2.72Å; I232-I235 PolarHBondContact O-N 2.99Å; I232-L236 HydrophobicContact CG2-CD1 4.25Å; I232-L236 WeakPolarHBondContact O-CG 3.41Å; I232-L236 PolarHBondContact O-N 3.44Å
233	V	84.8	Confident	78.9	Confident	85 Å²	85	100.8 Å²	100.8	52%	0.515	52%	0.517	S	S	.	.	H	α-helix	trans	-63.7	-42.7	178.1	170.7	0	0	0	0	111.1	T229 N230 D231 I235 L236 R237	T229-V233 VanDerWaalsContact O-CG2 3.28Å; T229-V233 WeakPolarHBondContact O-CG2 3.41Å; T229-V233 PolarHBondContact O-N 3.18Å; N230-V233 PolarHBondContact O-N 3.47Å; D231-V233 PolarHBondContact O-N 2.89Å; V233-I235 VanDerWaalsContact C-N 3.31Å; V233-I235 PolarHBondContact O-N 3.5Å; V233-L236 PolarHBondContact O-N 3.02Å; V233-R237 PolarHBondContact O-N 3.06Å; V233-R237 VanDerWaalsContact O-N 3.1Å
234	N	82.3	Confident	78.5	Confident	83 Å²	83	99.1 Å²	99.1	44%	0.444	51%	0.509	S	S	.	.	H	α-helix	trans	-66.9	-31.6	178	-67.1	-30.1	0	0	0	112.3	N230 D231 R237 S238	N230-N234 WeakPolarHBondContact O-CB 3.43Å; N230-N234 VanDerWaalsContact O-CG 3.26Å; N230-N234 PolarHBondContact O-N 2.9Å; N230-N234 PolarHBondContact O-ND2 3.36Å; N230-N234 VanDerWaalsContact O-ND2 3.15Å; N230-N234 PolarHBondContact OD1-ND2 3.13Å; D231-N234 PolarHBondContact O-N 2.8Å; N234-R237 CarbonylContact O-C 3.52Å; N234-R237 VanDerWaalsContact O-C 3.28Å; N234-S238 VanDerWaalsContact O-CA 3.28Å; N234-S238 WeakPolarHBondContact O-CA 3.14Å; N234-S238 PolarHBondContact O-N 2.81Å
235	I	81.1	Confident	78.2	Confident	140 Å²	140	99.9 Å²	99.9	72%	0.718	51%	0.51	S	S	*	.	H	α-helix	trans	-68.5	-42.5	173.1	-69.4	162.4	0	0	0	111.1	D231 I232 V233 R237	D231-I235 WeakPolarHBondContact O-CD1 3.42Å; D231-I235 WeakPolarHBondContact O-CG1 3.43Å; D231-I235 PolarHBondContact O-N 2.88Å; I232-I235 PolarHBondContact O-N 2.99Å; V233-I235 VanDerWaalsContact C-N 3.31Å; V233-I235 PolarHBondContact O-N 3.5Å; I235-R237 VanDerWaalsContact C-N 3.32Å; I235-R237 PolarHBondContact O-N 2.93Å
236	L	83.8	Confident	78.1	Confident	145 Å²	145	104.2 Å²	104.2	76%	0.759	53%	0.531	S	S	*	.	H	α-helix	trans	-66.7	-35	-178.9	-71.8	172.7	0	0	0	112.5	I232 V233	I232-L236 HydrophobicContact CG2-CD1 4.25Å; I232-L236 WeakPolarHBondContact O-CG 3.41Å; I232-L236 PolarHBondContact O-N 3.44Å; V233-L236 PolarHBondContact O-N 3.02Å
237	R	77.8	Confident	78.3	Confident	201 Å²	201	106.3 Å²	106.3	76%	0.758	54%	0.54	S	S	*	.	S	Bend	trans	-144.8	87.1	176.7	-169.7	-179.5	-176.5	-160.4	0.2	109.8	V233 N234 I235 L239	V233-R237 PolarHBondContact O-N 3.06Å; V233-R237 VanDerWaalsContact O-N 3.1Å; N234-R237 CarbonylContact O-C 3.52Å; N234-R237 VanDerWaalsContact O-C 3.28Å; I235-R237 VanDerWaalsContact C-N 3.32Å; I235-R237 PolarHBondContact O-N 2.93Å; R237-L239 PolarHBondContact O-N 3.08Å
238	S	68.9	Low	78.2	Confident	62 Å²	62	110.1 Å²	110.1	43%	0.434	55%	0.551	S	S	.	*			trans	-70	131.1	170.6	-176.7	0	0	0	0	109.7	N234 E240	N234-S238 VanDerWaalsContact O-CA 3.28Å; N234-S238 WeakPolarHBondContact O-CA 3.14Å; N234-S238 PolarHBondContact O-N 2.81Å; S238-E240 VanDerWaalsContact C-N 3.27Å; S238-E240 WeakPolarHBondContact OG-CB 3.38Å; S238-E240 PolarHBondContact OG-N 2.84Å
239	L	69.4	Low	78.2	Confident	157 Å²	157	108.2 Å²	108.2	82%	0.822	55%	0.546	S	S	*	.			trans	-81.6	-13.2	166.8	-69.5	170.4	0	0	0	111.5	R237 T241	R237-L239 PolarHBondContact O-N 3.08Å; L239-T241 PolarHBondContact O-N 2.87Å
240	E	68.9	Low	78.5	Confident	91 Å²	91	111.9 Å²	111.9	43%	0.425	56%	0.558	S	S	.	*	S	Bend	trans	-66.1	128.7	177.2	-64.8	-176.6	145.7	0	0	109.2	S238 E244	S238-E240 VanDerWaalsContact C-N 3.27Å; S238-E240 WeakPolarHBondContact OG-CB 3.38Å; S238-E240 PolarHBondContact OG-N 2.84Å; E240-E244 WeakPolarHBondContact CA-OE2 3.5Å; E240-E244 HydrophobicContact CB-CB 4.4Å
241	T	67.8	Low	78.7	Confident	79 Å²	79	112.5 Å²	112.5	49%	0.485	56%	0.561	S	S	.	*			trans	-70.6	152.7	177	49.4	0	0	0	0	109.9	L239 D243 E244 L245	L239-T241 PolarHBondContact O-N 2.87Å; T241-D243 PolarHBondContact O-N 2.9Å; T241-E244 PolarHBondContact N-OE2 2.8Å; T241-E244 PolarHBondContact O-N 3.31Å; T241-E244 PolarHBondContact OG1-OE2 3.2Å; T241-E244 VanDerWaalsContact OG1-OE2 3.05Å; T241-L245 PolarHBondContact O-N 2.58Å
242	Q	70.4	Confident	78.7	Confident	170 Å²	170	114.5 Å²	114.5	79%	0.794	57%	0.567	S	S	*	*	H	α-helix	trans	-51.3	-34.6	177.3	-120.3	-179.9	-19.7	0	0	112.3	L245 E246	Q242-L245 WeakPolarHBondContact O-CB 3.33Å; Q242-L245 PolarHBondContact O-N 3.17Å; Q242-E246 PolarHBondContact O-N 2.83Å
243	D	74.4	Confident	78.7	Confident	111 Å²	111	114.7 Å²	114.7	59%	0.594	57%	0.569	S	S	*	*	H	α-helix	trans	-63.6	-37.5	175.9	-83.7	-3.1	0	0	0	113.7	T241 E246 K247	T241-D243 PolarHBondContact O-N 2.9Å; D243-E246 PolarHBondContact O-N 3.22Å; D243-K247 WeakPolarHBondContact O-CG 3.47Å; D243-K247 PolarHBondContact O-N 2.93Å
244	E	77.9	Confident	78.9	Confident	95 Å²	95	116.7 Å²	116.7	44%	0.444	57%	0.573	S	S	.	*	H	α-helix	trans	-70.8	-39.3	176.7	-73.5	169.2	143.6	0	0	110.8	E240 T241 E246 K247 Q248	E240-E244 WeakPolarHBondContact CA-OE2 3.5Å; E240-E244 HydrophobicContact CB-CB 4.4Å; T241-E244 PolarHBondContact N-OE2 2.8Å; T241-E244 PolarHBondContact O-N 3.31Å; T241-E244 PolarHBondContact OG1-OE2 3.2Å; T241-E244 VanDerWaalsContact OG1-OE2 3.05Å; E244-E246 VanDerWaalsContact C-N 3.34Å; E244-E246 PolarHBondContact O-N 3.15Å; E244-K247 PolarHBondContact O-N 3.36Å; E244-Q248 PolarHBondContact O-N 3.43Å
245	L	75.3	Confident	79.1	Confident	79 Å²	79	116.9 Å²	116.9	41%	0.414	57%	0.573	S	S	.	*	H	α-helix	trans	-62.8	-41	173.8	-141.9	89.8	0	0	0	111.4	T241 Q242 Q248 N249	T241-L245 PolarHBondContact O-N 2.58Å; Q242-L245 WeakPolarHBondContact O-CB 3.33Å; Q242-L245 PolarHBondContact O-N 3.17Å; L245-Q248 PolarHBondContact O-N 3.41Å; L245-N249 WeakPolarHBondContact O-CB 3.39Å; L245-N249 PolarHBondContact O-N 3.26Å; L245-N249 PolarHBondContact O-ND2 3.4Å
246	E	78	Confident	79.3	Confident	110 Å²	110	113 Å²	113	51%	0.514	56%	0.561	S	S	.	*	H	α-helix	trans	-64.7	-40.3	174.2	-81	-164.3	176	0	0	112.6	Q242 D243 E244 N249 K250	Q242-E246 PolarHBondContact O-N 2.83Å; D243-E246 PolarHBondContact O-N 3.22Å; E244-E246 VanDerWaalsContact C-N 3.34Å; E244-E246 PolarHBondContact O-N 3.15Å; E246-N249 PolarHBondContact O-N 3.07Å; E246-K250 WeakPolarHBondContact O-CG 3.31Å; E246-K250 PolarHBondContact O-N 3.35Å
247	K	83.2	Confident	79.4	Confident	150 Å²	150	114.7 Å²	114.7	65%	0.652	56%	0.558	S	S	*	*	H	α-helix	trans	-64.4	-42.6	174.9	-78.4	177.5	-175.6	171.5	0	111.6	D243 E244 K250 L251	D243-K247 WeakPolarHBondContact O-CG 3.47Å; D243-K247 PolarHBondContact O-N 2.93Å; E244-K247 PolarHBondContact O-N 3.36Å; K247-K250 PolarHBondContact O-N 3.46Å; K247-L251 WeakPolarHBondContact O-CB 3.48Å; K247-L251 PolarHBondContact O-N 3.06Å
248	Q	81.1	Confident	79.8	Confident	105 Å²	105	107.8 Å²	107.8	49%	0.491	54%	0.543	S	S	.	.	H	α-helix	trans	-60.1	-46.6	173.5	-92.1	-170	-0.9	0	0	111.4	E244 L245 K250 L251 Q252	E244-Q248 PolarHBondContact O-N 3.43Å; L245-Q248 PolarHBondContact O-N 3.41Å; Q248-K250 VanDerWaalsContact C-N 3.34Å; Q248-K250 PolarHBondContact O-N 3.3Å; Q248-L251 PolarHBondContact O-N 3.33Å; Q248-Q252 WeakPolarHBondContact O-CB 3.44Å; Q248-Q252 PolarHBondContact O-N 3.36Å
249	N	83.1	Confident	80.5	Confident	79 Å²	79	109.2 Å²	109.2	42%	0.422	55%	0.545	S	S	.	.	H	α-helix	trans	-62.2	-38.9	177.5	-79.1	-33.7	0	0	0	112.6	L245 E246 Q252 N253	L245-N249 WeakPolarHBondContact O-CB 3.39Å; L245-N249 PolarHBondContact O-N 3.26Å; L245-N249 PolarHBondContact O-ND2 3.4Å; E246-N249 PolarHBondContact O-N 3.07Å; N249-Q252 PolarHBondContact O-N 3.17Å; N249-N253 WeakPolarHBondContact O-CB 3.46Å; N249-N253 PolarHBondContact O-N 2.96Å; N249-N253 PolarHBondContact O-ND2 3.29Å; N249-N253 VanDerWaalsContact O-ND2 3.1Å
250	K	87.5	Confident	81.1	Confident	131 Å²	131	108.5 Å²	108.5	57%	0.57	53%	0.532	S	S	*	.	H	α-helix	trans	-63.2	-46.4	173.2	-78.6	175.2	-177.8	164.1	0	111.3	E246 K247 Q248 Q252 N253 E254	E246-K250 WeakPolarHBondContact O-CG 3.31Å; E246-K250 PolarHBondContact O-N 3.35Å; K247-K250 PolarHBondContact O-N 3.46Å; Q248-K250 VanDerWaalsContact C-N 3.34Å; Q248-K250 PolarHBondContact O-N 3.3Å; K250-Q252 VanDerWaalsContact C-N 3.35Å; K250-Q252 PolarHBondContact O-N 2.83Å; K250-N253 PolarHBondContact O-N 2.87Å; K250-E254 WeakPolarHBondContact O-CG 3.27Å; K250-E254 PolarHBondContact O-N 3.36Å
251	L	87.6	Confident	81.6	Confident	97 Å²	97	109.2 Å²	109.2	51%	0.508	54%	0.539	S	S	.	.	H	α-helix	trans	-62.5	-41.8	177.7	-173.5	68.5	0	0	0	111.6	K247 Q248 N253 E254 I255	K247-L251 WeakPolarHBondContact O-CB 3.48Å; K247-L251 PolarHBondContact O-N 3.06Å; Q248-L251 PolarHBondContact O-N 3.33Å; L251-N253 VanDerWaalsContact C-N 3.34Å; L251-N253 PolarHBondContact O-N 3.28Å; L251-E254 PolarHBondContact O-N 2.98Å; L251-I255 HydrophobicContact CG-CD1 4.04Å; L251-I255 VanDerWaalsContact O-CG1 3.29Å; L251-I255 WeakPolarHBondContact O-CG1 3.46Å; L251-I255 PolarHBondContact O-N 2.9Å
252	Q	83.9	Confident	82	Confident	135 Å²	135	115.4 Å²	115.4	63%	0.631	55%	0.554	S	S	*	*	H	α-helix	trans	-61.1	-43.4	176.5	-127.7	-177.8	14.7	0	0	111.4	Q248 N249 K250 I255 A256	Q248-Q252 WeakPolarHBondContact O-CB 3.44Å; Q248-Q252 PolarHBondContact O-N 3.36Å; N249-Q252 PolarHBondContact O-N 3.17Å; K250-Q252 VanDerWaalsContact C-N 3.35Å; K250-Q252 PolarHBondContact O-N 2.83Å; Q252-I255 PolarHBondContact O-N 3.17Å; Q252-A256 WeakPolarHBondContact O-CB 3.31Å; Q252-A256 PolarHBondContact O-N 3.44Å
253	N	85.7	Confident	81.9	Confident	104 Å²	104	113.3 Å²	113.3	56%	0.556	54%	0.544	S	S	*	.	H	α-helix	trans	-65.9	-38	175.3	-77.5	-39.2	0	0	0	112.5	N249 K250 L251 R257	N249-N253 WeakPolarHBondContact O-CB 3.46Å; N249-N253 PolarHBondContact O-N 2.96Å; N249-N253 PolarHBondContact O-ND2 3.29Å; N249-N253 VanDerWaalsContact O-ND2 3.1Å; K250-N253 PolarHBondContact O-N 2.87Å; L251-N253 VanDerWaalsContact C-N 3.34Å; L251-N253 PolarHBondContact O-N 3.28Å; N253-R257 WeakPolarHBondContact O-CB 3.39Å; N253-R257 VanDerWaalsContact O-CG 3.3Å; N253-R257 WeakPolarHBondContact O-CG 3.35Å; N253-R257 PolarHBondContact O-N 2.91Å
254	E	88.3	Confident	81.2	Confident	126 Å²	126	111.6 Å²	111.6	59%	0.589	54%	0.535	S	S	*	.	H	α-helix	trans	-64.9	-43.3	174.2	-78	-177.1	174.6	0	0	111.9	K250 L251 R257 A258	K250-E254 WeakPolarHBondContact O-CG 3.27Å; K250-E254 PolarHBondContact O-N 3.36Å; L251-E254 PolarHBondContact O-N 2.98Å; E254-R257 PolarHBondContact O-N 3.42Å; E254-A258 WeakPolarHBondContact O-CB 3.39Å; E254-A258 PolarHBondContact O-N 3.15Å
255	I	86.9	Confident	80.3	Confident	88 Å²	88	108.6 Å²	108.6	45%	0.451	53%	0.53	S	S	.	.	H	α-helix	trans	-63.6	-46.3	175.9	-68.6	167.9	0	0	0	110.5	L251 Q252 R257 A258 I259	L251-I255 HydrophobicContact CG-CD1 4.04Å; L251-I255 VanDerWaalsContact O-CG1 3.29Å; L251-I255 WeakPolarHBondContact O-CG1 3.46Å; L251-I255 PolarHBondContact O-N 2.9Å; Q252-I255 PolarHBondContact O-N 3.17Å; I255-R257 VanDerWaalsContact C-N 3.31Å; I255-R257 PolarHBondContact O-N 2.86Å; I255-A258 PolarHBondContact O-N 3.46Å; I255-A258 VanDerWaalsContact O-N 3.1Å; I255-I259 HydrophobicContact CG2-CD1 3.78Å; I255-I259 HydrophobicContact CG2-CG1 4.34Å; I255-I259 WeakPolarHBondContact O-CG1 3.09Å; I255-I259 PolarHBondContact O-N 2.77Å
256	A	86.2	Confident	79.3	Confident	57 Å²	57	111.9 Å²	111.9	47%	0.471	54%	0.543	S	S	.	.	H	α-helix	trans	-58.4	-43.6	177.2	0	0	0	0	0	111.6	Q252 I259 Y260	Q252-A256 WeakPolarHBondContact O-CB 3.31Å; Q252-A256 PolarHBondContact O-N 3.44Å; A256-I259 PolarHBondContact O-N 3.35Å; A256-Y260 WeakPolarHBondContact O-CB 3.4Å; A256-Y260 PolarHBondContact O-N 3.43Å
257	R	86.1	Confident	78.2	Confident	182 Å²	182	112 Å²	112	69%	0.687	55%	0.547	S	S	*	.	H	α-helix	trans	-62.4	-42.5	173.1	-76.2	176.8	179.3	-176.5	0.6	112.2	N253 E254 I255 I259 Y260 N261	N253-R257 WeakPolarHBondContact O-CB 3.39Å; N253-R257 VanDerWaalsContact O-CG 3.3Å; N253-R257 WeakPolarHBondContact O-CG 3.35Å; N253-R257 PolarHBondContact O-N 2.91Å; E254-R257 PolarHBondContact O-N 3.42Å; I255-R257 VanDerWaalsContact C-N 3.31Å; I255-R257 PolarHBondContact O-N 2.86Å; R257-I259 VanDerWaalsContact C-N 3.33Å; R257-I259 PolarHBondContact O-N 3.33Å; R257-Y260 PolarHBondContact O-N 3.45Å; R257-N261 WeakPolarHBondContact O-CB 3.35Å; R257-N261 VanDerWaalsContact O-CG 3.24Å; R257-N261 PolarHBondContact O-N 3.2Å; R257-N261 PolarHBondContact O-ND2 3.26Å
258	A	85.9	Confident	76.8	Confident	55 Å²	55	107.8 Å²	107.8	46%	0.455	54%	0.536	S	S	.	.	H	α-helix	trans	-65.4	-36.9	179.4	0	0	0	0	0	112.2	E254 I255 R262	E254-A258 WeakPolarHBondContact O-CB 3.39Å; E254-A258 PolarHBondContact O-N 3.15Å; I255-A258 PolarHBondContact O-N 3.46Å; I255-A258 VanDerWaalsContact O-N 3.1Å; A258-R262 PolarHBondContact O-N 2.82Å
259	I	83.3	Confident	75.5	Confident	93 Å²	93	107.5 Å²	107.5	48%	0.477	54%	0.538	S	S	.	.	H	α-helix	trans	-67.3	-46.4	175	-68.1	169.7	0	0	0	110.5	I255 A256 R257 N261 R262 Q263	I255-I259 HydrophobicContact CG2-CD1 3.78Å; I255-I259 HydrophobicContact CG2-CG1 4.34Å; I255-I259 WeakPolarHBondContact O-CG1 3.09Å; I255-I259 PolarHBondContact O-N 2.77Å; A256-I259 PolarHBondContact O-N 3.35Å; R257-I259 VanDerWaalsContact C-N 3.33Å; R257-I259 PolarHBondContact O-N 3.33Å; I259-N261 PolarHBondContact O-N 3.43Å; I259-R262 WeakPolarHBondContact O-CB 3.33Å; I259-R262 PolarHBondContact O-N 3.24Å; I259-R262 VanDerWaalsContact O-N 3.15Å; I259-Q263 PolarHBondContact O-N 2.93Å; I259-Q263 VanDerWaalsContact O-N 3.07Å
260	Y	81.5	Confident	74.1	Confident	141 Å²	141	110.9 Å²	110.9	55%	0.553	55%	0.549	S	S	*	.	H	α-helix	trans	-59.6	-47.3	177.7	-170.3	-89.3	0	0	0	111.5	A256 R257 R262 Q263 D264	A256-Y260 WeakPolarHBondContact O-CB 3.4Å; A256-Y260 PolarHBondContact O-N 3.43Å; R257-Y260 PolarHBondContact O-N 3.45Å; Y260-R262 VanDerWaalsContact C-N 3.26Å; Y260-R262 PolarHBondContact O-N 3.26Å; Y260-Q263 PolarHBondContact O-N 3.3Å; Y260-Q263 VanDerWaalsContact O-N 3.08Å; Y260-D264 WeakPolarHBondContact CE1-OD2 3.49Å; Y260-D264 PolarHBondContact O-N 3.06Å
261	N	80.3	Confident	72.4	Confident	107 Å²	107	107.4 Å²	107.4	57%	0.572	54%	0.544	S	S	*	.	H	α-helix	trans	-63.2	-30.7	176.6	-71	-17.1	0	0	0	113	R257 I259 G265	R257-N261 WeakPolarHBondContact O-CB 3.35Å; R257-N261 VanDerWaalsContact O-CG 3.24Å; R257-N261 PolarHBondContact O-N 3.2Å; R257-N261 PolarHBondContact O-ND2 3.26Å; I259-N261 PolarHBondContact O-N 3.43Å; N261-G265 PolarHBondContact O-N 3.42Å
262	R	75.5	Confident	70.9	Confident	208 Å²	208	109.2 Å²	109.2	79%	0.785	55%	0.548	S	S	*	.	H	α-helix	trans	-68.3	-38.4	172.7	-99.7	-176	-175.5	172.3	3.3	112.5	A258 I259 Y260 H266	A258-R262 PolarHBondContact O-N 2.82Å; I259-R262 WeakPolarHBondContact O-CB 3.33Å; I259-R262 PolarHBondContact O-N 3.24Å; I259-R262 VanDerWaalsContact O-N 3.15Å; Y260-R262 VanDerWaalsContact C-N 3.26Å; Y260-R262 PolarHBondContact O-N 3.26Å; R262-H266 PolarHBondContact O-N 3.24Å
263	Q	67.4	Low	69.5	Low	126 Å²	126	109.2 Å²	109.2	59%	0.589	55%	0.548	S	S	*	.	H	α-helix	trans	-69.9	-43	177.5	-76.1	-178	-12.7	0	0	111.7	I259 Y260 H266 L267	I259-Q263 PolarHBondContact O-N 2.93Å; I259-Q263 VanDerWaalsContact O-N 3.07Å; Y260-Q263 PolarHBondContact O-N 3.3Å; Y260-Q263 VanDerWaalsContact O-N 3.08Å; Q263-H266 PolarHBondContact O-N 3.45Å; Q263-L267 PolarHBondContact O-N 3.15Å; Q263-L267 VanDerWaalsContact O-N 3.15Å
264	D	60.5	Low	68	Low	75 Å²	75	110.1 Å²	110.1	40%	0.401	55%	0.552	S	S	.	*	H	α-helix	trans	-66.6	-37.4	175.9	-90.9	-10.8	0	0	0	112.6	Y260 H266 L267 S268	Y260-D264 WeakPolarHBondContact CE1-OD2 3.49Å; Y260-D264 PolarHBondContact O-N 3.06Å; D264-H266 VanDerWaalsContact C-N 3.26Å; D264-H266 PolarHBondContact O-N 3.18Å; D264-L267 PolarHBondContact O-N 3.12Å; D264-S268 WeakPolarHBondContact O-CB 3.48Å; D264-S268 PolarHBondContact O-N 3.08Å
265	G	58.7	Low	66.4	Low	33 Å²	33	110.4 Å²	110.4	34%	0.34	56%	0.558	S	S	.	*	H	α-helix	trans	-62.2	-32.6	173.1	0	0	0	0	0	113.1	N261 N269	N261-G265 PolarHBondContact O-N 3.42Å; G265-N269 PolarHBondContact O-N 3.27Å; G265-N269 PolarHBondContact O-ND2 2.83Å
266	H	54.9	Low	64.9	Low	147 Å²	147	114 Å²	114	68%	0.681	57%	0.57	S	S	*	*	H	α-helix	trans	-76.1	-33.8	177.8	-128	-44.4	0	0	0	112.9	R262 Q263 D264 K270	R262-H266 PolarHBondContact O-N 3.24Å; Q263-H266 PolarHBondContact O-N 3.45Å; D264-H266 VanDerWaalsContact C-N 3.26Å; D264-H266 PolarHBondContact O-N 3.18Å; H266-K270 PolarHBondContact O-N 2.94Å
267	L	53.7	Low	63.5	Low	114 Å²	114	118.2 Å²	118.2	60%	0.597	58%	0.584	S	S	*	*	H	α-helix	trans	-73.5	-40.1	175	-72.9	163.1	0	0	0	112	Q263 D264 N269 K270 A271	Q263-L267 PolarHBondContact O-N 3.15Å; Q263-L267 VanDerWaalsContact O-N 3.15Å; D264-L267 PolarHBondContact O-N 3.12Å; L267-N269 VanDerWaalsContact C-N 3.34Å; L267-N269 PolarHBondContact O-N 3.05Å; L267-K270 PolarHBondContact O-N 3.11Å; L267-A271 PolarHBondContact O-N 3.07Å; L267-A271 VanDerWaalsContact O-N 3.07Å
268	S	55.2	Low	61.7	Low	61 Å²	61	117.8 Å²	117.8	43%	0.427	59%	0.59	S	S	.	*	H	α-helix	trans	-64.3	-37.3	176.9	-167.4	0	0	0	0	112.5	D264 K272	D264-S268 WeakPolarHBondContact O-CB 3.48Å; D264-S268 PolarHBondContact O-N 3.08Å; S268-K272 WeakPolarHBondContact O-CG 3.3Å; S268-K272 PolarHBondContact O-N 2.84Å
269	N	54.4	Low	59.6	Low	99 Å²	99	124.9 Å²	124.9	53%	0.529	63%	0.627	S	S	.	*	H	α-helix	trans	-72.5	-29.6	175.9	-77.4	-22.3	0	0	0	113.1	G265 L267 H273	G265-N269 PolarHBondContact O-N 3.27Å; G265-N269 PolarHBondContact O-ND2 2.83Å; L267-N269 VanDerWaalsContact C-N 3.34Å; L267-N269 PolarHBondContact O-N 3.05Å; N269-H273 PolarHBondContact O-N 3.29Å
270	K	52.7	Low	58.4	Low	150 Å²	150	126.5 Å²	126.5	65%	0.652	64%	0.635	S	S	*	*	H	α-helix	trans	-71.1	-42.1	174.5	-131	175.7	-178.4	-178.2	0	111.6	H266 L267 K272 H273 L274	H266-K270 PolarHBondContact O-N 2.94Å; L267-K270 PolarHBondContact O-N 3.11Å; K270-K272 VanDerWaalsContact C-N 3.33Å; K270-K272 PolarHBondContact O-N 3.43Å; K270-H273 PolarHBondContact O-N 3.41Å; K270-L274 PolarHBondContact O-N 2.74Å
271	A	52.7	Low	57.2	Low	58 Å²	58	125.7 Å²	125.7	48%	0.479	64%	0.639	S	S	.	*	H	α-helix	trans	-65.1	-33	176.6	0	0	0	0	0	113.2	L267 H273 N275	L267-A271 PolarHBondContact O-N 3.07Å; L267-A271 VanDerWaalsContact O-N 3.07Å; A271-H273 VanDerWaalsContact C-N 3.34Å; A271-N275 PolarHBondContact O-N 3.25Å
272	K	55	Low	55.9	Low	134 Å²	134	126.7 Å²	126.7	58%	0.583	64%	0.643	S	S	*	*	H	α-helix	trans	-72.7	-21.7	175.7	-76.8	-179.8	-179.1	176.3	0	114.4	S268 K270	S268-K272 WeakPolarHBondContact O-CG 3.3Å; S268-K272 PolarHBondContact O-N 2.84Å; K270-K272 VanDerWaalsContact C-N 3.33Å; K270-K272 PolarHBondContact O-N 3.43Å
273	H	55.2	Low	54.8	Low	136 Å²	136	121.9 Å²	121.9	63%	0.63	63%	0.634	S	S	*	*	H	α-helix	trans	-84	-34.7	173.8	-82.6	-41.7	0	0	0	112.6	N269 K270 A271 N275 K276	N269-H273 PolarHBondContact O-N 3.29Å; K270-H273 PolarHBondContact O-N 3.41Å; A271-H273 VanDerWaalsContact C-N 3.34Å; H273-N275 VanDerWaalsContact C-N 3.35Å; H273-N275 PolarHBondContact O-N 2.9Å; H273-K276 PolarHBondContact O-N 3.3Å
274	L	53.7	Low	54	Low	123 Å²	123	121.7 Å²	121.7	64%	0.644	64%	0.637	S	S	*	*	H	α-helix	trans	-65.2	-33.3	175.3	-85.6	136.8	0	0	0	113.6	K270 K276	K270-L274 PolarHBondContact O-N 2.74Å; L274-K276 VanDerWaalsContact C-N 3.31Å; L274-K276 PolarHBondContact O-N 3.03Å
275	N	54.6	Low	53.6	Low	132 Å²	132	124.8 Å²	124.8	71%	0.706	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.1	-0.9	178	-89.1	7.8	0	0	0	115	A271 H273	A271-N275 PolarHBondContact O-N 3.25Å; H273-N275 VanDerWaalsContact C-N 3.35Å; H273-N275 PolarHBondContact O-N 2.9Å
276	K	56.4	Low	53.2	Low	163 Å²	163	131.4 Å²	131.4	71%	0.709	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-9.5	177.6	-83.1	-168.5	178.2	-171.3	0	114.1	H273 L274	H273-K276 PolarHBondContact O-N 3.3Å; L274-K276 VanDerWaalsContact C-N 3.31Å; L274-K276 PolarHBondContact O-N 3.03Å
277	D	55.8	Low	53.1	Low	145 Å²	145	130.2 Å²	130.2	78%	0.775	68%	0.675	S	S	*	*	S	Bend	trans	-102.6	10.9	-177.1	-65.1	-26.7	0	0	0	113.4
278	E	48.5	Very low	53	Low	174 Å²	174	131.5 Å²	131.5	81%	0.813	68%	0.681	S	S	*	*			trans	-117.7	24.4	179	-77	-167.1	158.5	0	0	115
279	V	42.4	Very low	52.8	Low	203 Å²	203	137.9 Å²	137.9	100%	1.23	71%	0.705	S	S	*	*			trans	-129.4	0	173	-174.9	0	0	0	0	111.9

Retrieved 279 of 279 residues in 207.8 ms (Link to these results)

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