A0A060W270_ONCMY Loading...

Exosome complex component RRP41

AlphaFold DB (A0A4W5MTA9), UniProt , Accession A0A060W270, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene exosc4, Length 245 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	40.4	Very low	70.8	Confident	242 Å²	242	100.4 Å²	100.4	100%	1.192	59%	0.589	S	S	*	*				0	115	0	-73.5	173.7	-169.9	0	0	105.9	G3	M1-G3 PolarHBondContact O-N 2.92Å
2	A	39.3	Very low	72.2	Confident	115 Å²	115	101.3 Å²	101.3	95%	0.95	58%	0.576	S	S	*	*			trans	-72.3	83.7	170.2	0	0	0	0	0	106.7
3	G	58.5	Low	73.4	Confident	64 Å²	64	94.3 Å²	94.3	66%	0.66	54%	0.535	S	S	*	.			trans	-67.4	137.7	175.2	0	0	0	0	0	108.4	M1 E5	M1-G3 PolarHBondContact O-N 2.92Å; G3-E5 PolarHBondContact O-N 3.38Å
4	L	68.1	Low	74.2	Confident	125 Å²	125	92.7 Å²	92.7	65%	0.654	52%	0.524	S	S	*	.			trans	-55.7	122.3	169.7	-149.6	83	0	0	0	107.5	L6 L14	L4-L6 PolarHBondContact O-N 3.46Å; L4-L6 VanDerWaalsContact O-N 3.1Å; L4-L14 HydrophobicContact CD2-CD1 3.62Å; L4-L14 HydrophobicContact CD2-CD2 3.6Å; L4-L14 HydrophobicContact CD2-CG 4.27Å; L4-L14 HydrophobicContact CG-CD2 3.93Å
5	E	75.9	Confident	74.8	Confident	115 Å²	115	91.9 Å²	91.9	54%	0.537	52%	0.518	S	S	.	.			trans	-70.1	106.7	177.8	-168.8	178.4	171.4	0	0	107.9	G3 L7 S8 L14	G3-E5 PolarHBondContact O-N 3.38Å; E5-L7 VanDerWaalsContact C-N 3.34Å; E5-L7 WeakPolarHBondContact CG-O 3.49Å; E5-S8 WeakPolarHBondContact OE1-CA 3.49Å; E5-L14 WeakPolarHBondContact O-CD2 3.42Å
6	L	80.6	Confident	75.5	Confident	23 Å²	23	89.2 Å²	89.2	12%	0.12	52%	0.516	C	S	.	.	S	Bend	trans	-71.4	-34.3	-176	-65.2	178	0	0	0	111.4	L4 L14 V165 E177	L4-L6 PolarHBondContact O-N 3.46Å; L4-L6 VanDerWaalsContact O-N 3.1Å; L6-L14 HydrophobicContact CD2-CD1 3.9Å; L6-V165 HydrophobicContact CB-CG1 3.95Å; L6-V165 HydrophobicContact CD1-CG1 3.75Å; L6-V165 HydrophobicContact CD1-CG2 4.4Å; L6-V165 HydrophobicContact CG-CG1 4.5Å; L6-E177 HydrophobicContact CD2-CG 4.48Å
7	L	82.8	Confident	76.3	Confident	29 Å²	29	85.4 Å²	85.4	15%	0.152	49%	0.491	C	S	.	.	B	Isolated β-bridge	trans	-129.1	118.4	177.8	-166.3	81.5	0	0	0	108.9	E5 R13 T168 L170	E5-L7 VanDerWaalsContact C-N 3.34Å; E5-L7 WeakPolarHBondContact CG-O 3.49Å; L7-R13 HydrophobicContact CD1-CG 4.33Å; L7-T168 HydrophobicContact CD2-CG2 4.14Å; L7-L170 HydrophobicContact CD1-CD2 4.25Å
8	S	84.3	Confident	77.1	Confident	41 Å²	41	87.8 Å²	87.8	29%	0.287	50%	0.495	S	S	.	.			trans	-67.2	150.6	171.8	177	0	0	0	0	110.6	E5 Q10 G11 Y12	E5-S8 WeakPolarHBondContact OE1-CA 3.49Å; S8-Q10 PolarHBondContact O-N 3.04Å; S8-Q10 PolarHBondContact OG-N 2.78Å; S8-G11 WeakPolarHBondContact O-CA 3.49Å; S8-G11 PolarHBondContact O-N 3.48Å; S8-Y12 WeakPolarHBondContact CB-O 3.41Å; S8-Y12 PolarHBondContact N-O 2.88Å
9	D	82.5	Confident	77.6	Confident	162 Å²	162	84.7 Å²	84.7	87%	0.866	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.4	-27.1	167.6	-71.6	-20.3	0	0	0	113.9	G11	D9-G11 VanDerWaalsContact C-N 3.28Å; D9-G11 PolarHBondContact O-N 3.16Å
10	Q	82.8	Confident	78.1	Confident	156 Å²	156	84.9 Å²	84.9	73%	0.729	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-0.9	178.2	-62.6	177.9	7.4	0	0	113.9	S8 Y12	S8-Q10 PolarHBondContact O-N 3.04Å; S8-Q10 PolarHBondContact OG-N 2.78Å; Q10-Y12 HydrophobicContact CB-CD2 3.69Å; Q10-Y12 HydrophobicContact CB-CE2 4.05Å
11	G	83.3	Confident	78.7	Confident	32 Å²	32	85.5 Å²	85.5	33%	0.33	49%	0.492	S	S	.	.	S	Bend	trans	80.3	15.9	-179.6	0	0	0	0	0	114.9	S8 D9	S8-G11 WeakPolarHBondContact O-CA 3.49Å; S8-G11 PolarHBondContact O-N 3.48Å; D9-G11 VanDerWaalsContact C-N 3.28Å; D9-G11 PolarHBondContact O-N 3.16Å
12	Y	87.4	Confident	81.1	Confident	111 Å²	111	75.8 Å²	75.8	44%	0.435	45%	0.445	S	S	.	.	B	Isolated β-bridge	trans	-98.2	141	175.9	-65.5	-76.2	0	0	0	111.2	S8 Q10 G16	S8-Y12 WeakPolarHBondContact CB-O 3.41Å; S8-Y12 PolarHBondContact N-O 2.88Å; Q10-Y12 HydrophobicContact CB-CD2 3.69Å; Q10-Y12 HydrophobicContact CB-CE2 4.05Å; Y12-G16 WeakPolarHBondContact CD1-O 3.47Å
13	R	87.8	Confident	83.6	Confident	11 Å²	11	71.2 Å²	71.2	4%	0.042	40%	0.403	C	S	.	.	B	Isolated β-bridge	trans	-84	173.6	173.6	-59.7	172.2	-178.4	-148.1	16.3	111.6	L7 D15 G16 R17 K18 A19 A171 E177	L7-R13 HydrophobicContact CD1-CG 4.33Å; R13-D15 PolarHBondContact O-N 3.47Å; R13-D15 VanDerWaalsContact O-N 3.14Å; R13-G16 PolarHBondContact O-N 3.39Å; R13-R17 WeakPolarHBondContact CG-O 3.46Å; R13-R17 PolarHBondContact N-O 3.25Å; R13-K18 PolarHBondContact NE-O 2.8Å; R13-K18 VanDerWaalsContact NE-O 3.12Å; R13-A19 VanDerWaalsContact NH2-C 3.33Å; R13-A19 PolarHBondContact NH2-O 3.06Å; R13-A171 PolarHBondContact NH1-O 3.25Å; R13-A171 PolarHBondContact NH2-O 2.88Å; R13-E177 WeakPolarHBondContact CD-OE1 3.33Å; R13-E177 IonicContact CZ-OE1 3.39Å; R13-E177 IonicContact NE-OE1 3.18Å; R13-E177 IonicContact NH1-OE1 3.5Å; R13-E177 PolarHBondContact NH1-OE1 3.14Å; R13-E177 VanDerWaalsContact NH1-OE1 3.14Å; R13-E177 IonicContact NH1-OE2 3.66Å; R13-E177 PolarHBondContact NH1-OE2 3.45Å
14	L	85.2	Confident	85.2	Confident	72 Å²	72	75.4 Å²	75.4	38%	0.377	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	-37.6	171.1	-63.5	168.7	0	0	0	113.6	L4 E5 L6 G16 A176	L4-L14 HydrophobicContact CD2-CD1 3.62Å; L4-L14 HydrophobicContact CD2-CD2 3.6Å; L4-L14 HydrophobicContact CD2-CG 4.27Å; L4-L14 HydrophobicContact CG-CD2 3.93Å; E5-L14 WeakPolarHBondContact O-CD2 3.42Å; L6-L14 HydrophobicContact CD2-CD1 3.9Å; L14-G16 VanDerWaalsContact C-N 3.3Å; L14-G16 PolarHBondContact O-N 3.18Å; L14-A176 HydrophobicContact CD1-CB 3.89Å
15	D	83.3	Confident	86.4	Confident	81 Å²	81	70.3 Å²	70.3	43%	0.433	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-3	-179.2	-56.8	-22.2	0	0	0	113.5	R13 R17	R13-D15 PolarHBondContact O-N 3.47Å; R13-D15 VanDerWaalsContact O-N 3.14Å; D15-R17 VanDerWaalsContact C-N 3.3Å; D15-R17 HydrophobicContact CB-CG 4.44Å; D15-R17 PolarHBondContact O-N 3.13Å; D15-R17 IonicContact OD2-CZ 3.18Å; D15-R17 IonicContact OD2-NE 3.97Å; D15-R17 PolarHBondContact OD2-NE 2.95Å; D15-R17 IonicContact OD2-NH2 2.76Å; D15-R17 PolarHBondContact OD2-NH2 2.64Å
16	G	85.2	Confident	87.3	Confident	48 Å²	48	69 Å²	69	50%	0.495	37%	0.371	S	S	.	.	S	Bend	trans	80.1	2.7	-173.2	0	0	0	0	0	115.3	Y12 R13 L14	Y12-G16 WeakPolarHBondContact CD1-O 3.47Å; R13-G16 PolarHBondContact O-N 3.39Å; L14-G16 VanDerWaalsContact C-N 3.3Å; L14-G16 PolarHBondContact O-N 3.18Å
17	R	89.6	Confident	88	Confident	24 Å²	24	68.8 Å²	68.8	9%	0.091	37%	0.373	C	S	.	.			trans	-81.5	159.8	176.8	-67.9	-176.9	-67.7	137	-0.4	112.3	R13 D15 E21 R23 D172	R13-R17 WeakPolarHBondContact CG-O 3.46Å; R13-R17 PolarHBondContact N-O 3.25Å; D15-R17 VanDerWaalsContact C-N 3.3Å; D15-R17 HydrophobicContact CB-CG 4.44Å; D15-R17 PolarHBondContact O-N 3.13Å; D15-R17 IonicContact OD2-CZ 3.18Å; D15-R17 IonicContact OD2-NE 3.97Å; D15-R17 PolarHBondContact OD2-NE 2.95Å; D15-R17 IonicContact OD2-NH2 2.76Å; D15-R17 PolarHBondContact OD2-NH2 2.64Å; R17-E21 HydrophobicContact CB-CB 4.34Å; R17-E21 PolarHBondContact NH1-O 2.89Å; R17-R23 VanDerWaalsContact NH1-CG 3.29Å; R17-D172 IonicContact NH1-OD2 3.61Å
18	K	90.4	Very high	88.5	Confident	130 Å²	130	76.2 Å²	76.2	57%	0.565	40%	0.399	S	S	*	.	B	Isolated β-bridge	trans	-80.2	164.7	169.2	-68	-174	178.7	-177.8	0	112.7	R13 A20 E21	R13-K18 PolarHBondContact NE-O 2.8Å; R13-K18 VanDerWaalsContact NE-O 3.12Å; K18-A20 VanDerWaalsContact C-N 3.3Å; K18-A20 PolarHBondContact O-N 2.89Å; K18-E21 HydrophobicContact CB-CB 4.23Å; K18-E21 PolarHBondContact N-OE2 3.12Å; K18-E21 VanDerWaalsContact N-OE2 3.16Å; K18-E21 PolarHBondContact O-N 3.24Å; K18-E21 VanDerWaalsContact O-N 3.13Å
19	A	87.3	Confident	89	Confident	29 Å²	29	75.1 Å²	75.1	24%	0.24	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-33.7	177.9	0	0	0	0	0	115	R13 L170 A171	R13-A19 VanDerWaalsContact NH2-C 3.33Å; R13-A19 PolarHBondContact NH2-O 3.06Å; A19-L170 HydrophobicContact CB-CD2 3.71Å; A19-L170 WeakPolarHBondContact O-CA 3.38Å; A19-A171 PolarHBondContact O-N 3.16Å
20	A	87.8	Confident	89.5	Confident	87 Å²	87	69.3 Å²	69.3	72%	0.719	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94	-2.8	179.2	0	0	0	0	0	114.1	K18	K18-A20 VanDerWaalsContact C-N 3.3Å; K18-A20 PolarHBondContact O-N 2.89Å
21	E	89.9	Confident	90	Very high	99 Å²	99	64.9 Å²	64.9	46%	0.463	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-92.7	125.3	-167.3	-172.7	177.7	-173.3	0	0	112.3	R17 K18	R17-E21 HydrophobicContact CB-CB 4.34Å; R17-E21 PolarHBondContact NH1-O 2.89Å; K18-E21 HydrophobicContact CB-CB 4.23Å; K18-E21 PolarHBondContact N-OE2 3.12Å; K18-E21 VanDerWaalsContact N-OE2 3.16Å; K18-E21 PolarHBondContact O-N 3.24Å; K18-E21 VanDerWaalsContact O-N 3.13Å
22	L	90.4	Very high	90.6	Very high	38 Å²	38	67.9 Å²	67.9	20%	0.199	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-74.5	158.1	178	-60.1	171.7	0	0	0	111.6	A171 D172 A220 V224	L22-A171 HydrophobicContact CD2-CB 4.25Å; L22-D172 HydrophobicContact CD2-CB 3.67Å; L22-A220 HydrophobicContact CD2-CB 3.8Å; L22-V224 HydrophobicContact CD1-CG2 3.74Å
23	R	92.6	Very high	90.7	Very high	18 Å²	18	67.3 Å²	67.3	7%	0.068	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-68.1	160	166.8	-66.4	-175.5	-155.3	141.6	53.6	110.6	R17 V25 D131 D172 L173 C174	R17-R23 VanDerWaalsContact NH1-CG 3.29Å; R23-V25 PolarHBondContact O-N 3.1Å; R23-V25 VanDerWaalsContact O-N 3.15Å; R23-D131 PolarHBondContact NH1-O 2.73Å; R23-D131 IonicContact NH1-OD2 3.54Å; R23-D131 PolarHBondContact NH1-OD2 3.5Å; R23-D131 VanDerWaalsContact NH1-OD2 3.09Å; R23-D172 WeakPolarHBondContact CB-OD2 3.41Å; R23-D172 VanDerWaalsContact CG-OD2 3.29Å; R23-D172 WeakPolarHBondContact CG-OD2 3.47Å; R23-D172 PolarHBondContact N-OD2 3.3Å; R23-D172 PolarHBondContact NH2-O 3.18Å; R23-D172 IonicContact NH2-OD1 3.47Å; R23-L173 PolarHBondContact NH2-O 3.35Å; R23-C174 VanDerWaalsContact CZ-CB 3.49Å
24	K	92	Very high	91	Very high	153 Å²	153	75.3 Å²	75.3	67%	0.665	41%	0.411	S	S	*	.	P	Polyproline II helix	trans	-60.3	119.9	168.2	-170.6	178.9	-176.7	-170.6	0	108.9	Q26 G44	K24-Q26 HydrophobicContact CD-CG 4.48Å; K24-Q26 VanDerWaalsContact CE-NE2 3.33Å; K24-Q26 HydrophobicContact CG-CG 4.37Å; K24-G44 PolarHBondContact O-N 3Å
25	V	93.8	Very high	91.4	Very high	18 Å²	18	72.5 Å²	72.5	11%	0.109	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	126.3	172.6	-179.5	0	0	0	0	108.1	R23 I41 E42 Q43 V227	R23-V25 PolarHBondContact O-N 3.1Å; R23-V25 VanDerWaalsContact O-N 3.15Å; V25-I41 HydrophobicContact CG1-CD1 3.84Å; V25-I41 HydrophobicContact CG1-CG1 3.93Å; V25-E42 CarbonylContact C-O 3.48Å; V25-E42 VanDerWaalsContact CA-O 3.31Å; V25-E42 WeakPolarHBondContact CA-O 3.36Å; V25-Q43 HydrophobicContact CG2-CB 4.4Å; V25-Q43 HydrophobicContact CG2-CG 4.05Å; V25-V227 HydrophobicContact CB-CG1 4.16Å; V25-V227 HydrophobicContact CG1-CG1 4.42Å
26	Q	94.5	Very high	91.9	Very high	88 Å²	88	73.2 Å²	73.2	41%	0.411	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	136.1	169.4	-62.3	-177.8	35.4	0	0	107.9	K24 I41 E42	K24-Q26 HydrophobicContact CD-CG 4.48Å; K24-Q26 VanDerWaalsContact CE-NE2 3.33Å; K24-Q26 HydrophobicContact CG-CG 4.37Å; Q26-I41 CarbonylContact O-C 3.56Å; Q26-I41 WeakPolarHBondContact O-CA 3.39Å; Q26-E42 HydrophobicContact CB-CB 4.41Å; Q26-E42 PolarHBondContact N-O 3.2Å; Q26-E42 PolarHBondContact O-N 3.28Å
27	A	94.9	Very high	92.4	Very high	18 Å²	18	71 Å²	71	15%	0.149	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	152	179.1	0	0	0	0	0	110.6	Y40 I41 L144 V231	A27-Y40 CarbonylContact C-O 3.57Å; A27-Y40 VanDerWaalsContact CA-O 3.3Å; A27-Y40 WeakPolarHBondContact CA-O 3.4Å; A27-I41 HydrophobicContact CB-CG1 4.14Å; A27-L144 HydrophobicContact CB-CD1 3.49Å; A27-L144 VanDerWaalsContact CB-CD1 3.49Å; A27-V231 HydrophobicContact CB-CG1 3.99Å; A27-V231 HydrophobicContact CB-CG2 4.4Å
28	R	94.4	Very high	92.8	Very high	185 Å²	185	69.8 Å²	69.8	70%	0.698	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.7	131.4	173.7	-65.9	-174.5	178.8	-175.9	-1.3	108.5	V31 A39 Y40	R28-V31 HydrophobicContact CB-CG2 4.35Å; R28-A39 CarbonylContact O-C 3.52Å; R28-A39 WeakPolarHBondContact O-CA 3.42Å; R28-Y40 PolarHBondContact N-O 2.88Å; R28-Y40 PolarHBondContact O-N 2.85Å
29	M	94.6	Very high	93.1	Very high	18 Å²	18	63.6 Å²	63.6	9%	0.089	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	160.6	175.6	-61.9	176.8	66.4	0	0	109.5	V31 L144 V147 D148 V232 H235	M29-V31 PolarHBondContact O-N 2.82Å; M29-L144 WeakPolarHBondContact CE-O 3.41Å; M29-L144 HydrophobicContact CG-CB 4.31Å; M29-L144 HydrophobicContact CG-CD2 4.38Å; M29-L144 HydrophobicContact SD-CD2 3.97Å; M29-V147 HydrophobicContact CE-CB 4.22Å; M29-V147 HydrophobicContact CE-CG1 3.99Å; M29-D148 HydrophobicContact CE-CB 3.84Å; M29-V232 HydrophobicContact CE-CG2 4.31Å; M29-V232 HydrophobicContact SD-CB 4.32Å; M29-V232 HydrophobicContact SD-CG2 3.71Å; M29-H235 HydrophobicContact SD-CB 4.25Å
30	G	92.4	Very high	93.6	Very high	39 Å²	39	64.2 Å²	64.2	40%	0.402	34%	0.343	S	S	.	.			trans	65.9	32.7	177.2	0	0	0	0	0	114.7	F32 S38 D148	G30-F32 VanDerWaalsContact C-N 3.34Å; G30-F32 PolarHBondContact O-N 3.5Å; G30-S38 PolarHBondContact N-O 3.38Å; G30-D148 WeakPolarHBondContact CA-OD2 3.47Å; G30-D148 PolarHBondContact N-OD2 2.93Å
31	V	93.8	Very high	94	Very high	63 Å²	63	60 Å²	60	38%	0.382	31%	0.309	S	S	.	.			trans	-64.7	-37.9	-177.9	-179	0	0	0	0	112.4	R28 M29 S38	R28-V31 HydrophobicContact CB-CG2 4.35Å; M29-V31 PolarHBondContact O-N 2.82Å; V31-S38 PolarHBondContact N-OG 3.22Å
32	F	94.4	Very high	94.3	Very high	95 Å²	95	57.4 Å²	57.4	42%	0.417	30%	0.297	S	S	.	.			trans	-119.4	109.4	-179.6	-62.4	-48.7	0	0	0	110.4	G30 Q34 A35 S38 L49 V51	G30-F32 VanDerWaalsContact C-N 3.34Å; G30-F32 PolarHBondContact O-N 3.5Å; F32-Q34 PolarHBondContact O-N 2.92Å; F32-A35 PolarHBondContact O-N 3Å; F32-S38 PolarHBondContact N-OG 3.15Å; F32-S38 PolarHBondContact O-OG 3.36Å; F32-L49 HydrophobicContact CD2-CD2 4.2Å; F32-L49 HydrophobicContact CE2-CD1 3.58Å; F32-L49 HydrophobicContact CE2-CD2 3.47Å; F32-L49 VanDerWaalsContact CE2-CD2 3.47Å; F32-L49 HydrophobicContact CE2-CG 4.08Å; F32-L49 HydrophobicContact CZ-CD1 3.66Å; F32-L49 HydrophobicContact CZ-CD2 4.37Å; F32-V51 HydrophobicContact CD2-CG2 3.78Å; F32-V51 HydrophobicContact CE2-CG2 4.01Å
33	A	90.7	Very high	94.4	Very high	99 Å²	99	55.7 Å²	55.7	82%	0.818	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-10.1	177.9	0	0	0	0	0	114.7
34	Q	93.1	Very high	94.4	Very high	180 Å²	180	56.2 Å²	56.2	84%	0.841	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-12.9	-178.8	-61.8	-62.9	-37.8	0	0	113.1	F32	F32-Q34 PolarHBondContact O-N 2.92Å
35	A	93.6	Very high	94.4	Very high	13 Å²	13	53.3 Å²	53.3	11%	0.107	29%	0.29	C	S	.	.	S	Bend	trans	-98.8	159.3	174.2	0	0	0	0	0	109.5	F32 G37 V51 Y53	F32-A35 PolarHBondContact O-N 3Å; A35-G37 VanDerWaalsContact C-N 3.29Å; A35-V51 HydrophobicContact CB-CG1 3.33Å; A35-Y53 HydrophobicContact CB-CD1 4.49Å; A35-Y53 HydrophobicContact CB-CE1 3.9Å
36	D	95	Very high	94.5	Very high	96 Å²	96	52.5 Å²	52.5	51%	0.513	29%	0.286	S	S	.	.	S	Bend	trans	-68.6	-34.2	177.6	-58	-51.8	0	0	0	110.9	V52 Y53 G54 A149	D36-V52 PolarHBondContact N-O 3.22Å; D36-Y53 WeakPolarHBondContact OD2-CA 3.21Å; D36-G54 PolarHBondContact OD2-N 3.04Å; D36-A149 HydrophobicContact CB-CB 4.5Å; D36-A149 WeakPolarHBondContact O-CA 3.46Å
37	G	95.6	Very high	94.5	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	148.9	169.3	0	0	0	0	0	112.6	A35 V52 D148	A35-G37 VanDerWaalsContact C-N 3.29Å; G37-V52 PolarHBondContact N-O 3.38Å; G37-V52 PolarHBondContact O-N 3.42Å; G37-D148 WeakPolarHBondContact CA-OD2 3.03Å
38	S	97	Very high	94.6	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	146.6	-178.9	61.8	0	0	0	0	112.2	G30 V31 F32 A50 D148	G30-S38 PolarHBondContact N-O 3.38Å; V31-S38 PolarHBondContact N-OG 3.22Å; F32-S38 PolarHBondContact N-OG 3.15Å; F32-S38 PolarHBondContact O-OG 3.36Å; S38-A50 WeakPolarHBondContact CA-O 3.39Å; S38-D148 PolarHBondContact N-OD2 2.98Å; S38-D148 VanDerWaalsContact O-OD2 3.1Å
39	A	97.2	Very high	94.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	149.7	176	0	0	0	0	0	111.6	R28 L49 A50 A141 L144 A145	R28-A39 CarbonylContact O-C 3.52Å; R28-A39 WeakPolarHBondContact O-CA 3.42Å; A39-L49 WeakPolarHBondContact O-CA 3.17Å; A39-A50 PolarHBondContact N-O 2.76Å; A39-A50 PolarHBondContact O-N 2.98Å; A39-A141 WeakPolarHBondContact CB-O 3.33Å; A39-L144 HydrophobicContact CB-CB 3.51Å; A39-L144 HydrophobicContact CB-CD1 4.5Å; A39-A145 HydrophobicContact CB-CB 3.96Å
40	Y	97.2	Very high	94.9	Very high	41 Å²	41	41.7 Å²	41.7	16%	0.161	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	130.6	172.3	175.4	-106.3	0	0	0	108.9	A27 R28 E42 K47 A48 L49 L128	A27-Y40 CarbonylContact C-O 3.57Å; A27-Y40 VanDerWaalsContact CA-O 3.3Å; A27-Y40 WeakPolarHBondContact CA-O 3.4Å; R28-Y40 PolarHBondContact N-O 2.88Å; R28-Y40 PolarHBondContact O-N 2.85Å; Y40-E42 HydrophobicContact CD1-CG 4.2Å; Y40-E42 HydrophobicContact CE1-CG 3.32Å; Y40-E42 VanDerWaalsContact CE1-OE1 3.24Å; Y40-E42 WeakPolarHBondContact CE1-OE1 3.49Å; Y40-E42 VanDerWaalsContact CZ-OE1 3.28Å; Y40-E42 WeakPolarHBondContact OH-CG 3.31Å; Y40-E42 PolarHBondContact OH-OE1 3.34Å; Y40-K47 HydrophobicContact CE2-CB 4.15Å; Y40-K47 VanDerWaalsContact OH-CD 3.32Å; Y40-K47 WeakPolarHBondContact OH-CD 3.49Å; Y40-K47 VanDerWaalsContact OH-CG 3.31Å; Y40-K47 WeakPolarHBondContact OH-CG 3.45Å; Y40-A48 WeakPolarHBondContact CD2-O 3.41Å; Y40-L49 HydrophobicContact CD2-CB 4.38Å; Y40-L128 HydrophobicContact CE2-CD1 3.98Å
41	I	96.5	Very high	95.1	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	141	179	-162.7	167.4	0	0	0	110.4	V25 Q26 A27 K47 A48 N140 A141 L228	V25-I41 HydrophobicContact CG1-CD1 3.84Å; V25-I41 HydrophobicContact CG1-CG1 3.93Å; Q26-I41 CarbonylContact O-C 3.56Å; Q26-I41 WeakPolarHBondContact O-CA 3.39Å; A27-I41 HydrophobicContact CB-CG1 4.14Å; I41-K47 WeakPolarHBondContact O-CA 3.46Å; I41-A48 HydrophobicContact CG2-CB 3.86Å; I41-A48 PolarHBondContact N-O 3.41Å; I41-A48 PolarHBondContact O-N 3.27Å; I41-N140 HydrophobicContact CD1-CB 3.63Å; I41-A141 HydrophobicContact CB-CB 4.38Å; I41-A141 HydrophobicContact CG2-CB 3.64Å; I41-L228 HydrophobicContact CD1-CD2 4.19Å
42	E	95.7	Very high	95.3	Very high	43 Å²	43	37.6 Å²	37.6	20%	0.201	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	112.4	170.9	-51.1	-165.7	142.9	0	0	107.9	V25 Q26 Y40 T46 K47	V25-E42 CarbonylContact C-O 3.48Å; V25-E42 VanDerWaalsContact CA-O 3.31Å; V25-E42 WeakPolarHBondContact CA-O 3.36Å; Q26-E42 HydrophobicContact CB-CB 4.41Å; Q26-E42 PolarHBondContact N-O 3.2Å; Q26-E42 PolarHBondContact O-N 3.28Å; Y40-E42 HydrophobicContact CD1-CG 4.2Å; Y40-E42 HydrophobicContact CE1-CG 3.32Å; Y40-E42 VanDerWaalsContact CE1-OE1 3.24Å; Y40-E42 WeakPolarHBondContact CE1-OE1 3.49Å; Y40-E42 VanDerWaalsContact CZ-OE1 3.28Å; Y40-E42 WeakPolarHBondContact OH-CG 3.31Å; Y40-E42 PolarHBondContact OH-OE1 3.34Å; E42-T46 CarbonylContact C-O 3.51Å; E42-T46 WeakPolarHBondContact CA-O 3.34Å; E42-K47 HydrophobicContact CG-CG 4.2Å; E42-K47 IonicContact OE1-NZ 2.85Å; E42-K47 PolarHBondContact OE1-NZ 2.92Å
43	Q	93.3	Very high	95.4	Very high	3 Å²	3	37.7 Å²	37.7	1%	0.014	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	96.1	174	-179.1	166.4	-3.7	0	0	107.7	V25 N45 T46 D172	V25-Q43 HydrophobicContact CG2-CB 4.4Å; V25-Q43 HydrophobicContact CG2-CG 4.05Å; Q43-N45 PolarHBondContact O-N 3.49Å; Q43-T46 PolarHBondContact N-O 3.3Å; Q43-T46 WeakPolarHBondContact O-CB 3.41Å; Q43-T46 PolarHBondContact O-N 3.03Å; Q43-D172 VanDerWaalsContact NE2-CG 3.29Å; Q43-D172 PolarHBondContact NE2-OD1 2.82Å; Q43-D172 PolarHBondContact NE2-OD2 3.2Å
44	G	91.9	Very high	95.3	Very high	29 Å²	29	33.3 Å²	33.3	30%	0.299	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	-119.2	-164.1	0	0	0	0	0	110.8	K24	K24-G44 PolarHBondContact O-N 3Å
45	N	92.9	Very high	95.2	Very high	91 Å²	91	27.2 Å²	27.2	49%	0.487	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-8.2	176.7	-53.1	-52.7	0	0	0	113.4	Q43 K47 Q129 D131	Q43-N45 PolarHBondContact O-N 3.49Å; N45-K47 PolarHBondContact O-N 3.49Å; N45-Q129 VanDerWaalsContact O-CD 3.24Å; N45-Q129 VanDerWaalsContact O-CG 3.27Å; N45-Q129 WeakPolarHBondContact O-CG 3.31Å; N45-D131 HydrophobicContact CB-CB 3.7Å; N45-D131 WeakPolarHBondContact CB-OD2 3.43Å; N45-D131 PolarHBondContact ND2-OD2 3.35Å
46	T	94.9	Very high	95	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.012	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	119.5	177	-62.9	0	0	0	0	109.1	E42 Q43 Q129 D131 G132 A137	E42-T46 CarbonylContact C-O 3.51Å; E42-T46 WeakPolarHBondContact CA-O 3.34Å; Q43-T46 PolarHBondContact N-O 3.3Å; Q43-T46 WeakPolarHBondContact O-CB 3.41Å; Q43-T46 PolarHBondContact O-N 3.03Å; T46-Q129 CarbonylContact C-O 3.58Å; T46-Q129 WeakPolarHBondContact CA-O 3.37Å; T46-D131 WeakPolarHBondContact OG1-CA 3.39Å; T46-D131 PolarHBondContact OG1-N 3.06Å; T46-G132 PolarHBondContact OG1-O 2.89Å; T46-A137 HydrophobicContact CG2-CB 3.65Å
47	K	96.3	Very high	94.7	Very high	57 Å²	57	31.8 Å²	31.8	25%	0.248	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	117.5	-178.8	-64.2	169.4	-176.9	-97.1	0	109.2	Y40 I41 E42 N45 L128 Q129	Y40-K47 HydrophobicContact CE2-CB 4.15Å; Y40-K47 VanDerWaalsContact OH-CD 3.32Å; Y40-K47 WeakPolarHBondContact OH-CD 3.49Å; Y40-K47 VanDerWaalsContact OH-CG 3.31Å; Y40-K47 WeakPolarHBondContact OH-CG 3.45Å; I41-K47 WeakPolarHBondContact O-CA 3.46Å; E42-K47 HydrophobicContact CG-CG 4.2Å; E42-K47 IonicContact OE1-NZ 2.85Å; E42-K47 PolarHBondContact OE1-NZ 2.92Å; N45-K47 PolarHBondContact O-N 3.49Å; K47-L128 HydrophobicContact CB-CB 4.13Å; K47-L128 PolarHBondContact O-N 2.92Å; K47-Q129 HydrophobicContact CB-CB 4.06Å; K47-Q129 HydrophobicContact CD-CB 4.05Å; K47-Q129 VanDerWaalsContact CE-OE1 3.3Å; K47-Q129 HydrophobicContact CG-CB 4.2Å; K47-Q129 PolarHBondContact N-O 3.38Å; K47-Q129 PolarHBondContact O-N 2.73Å
48	A	96.7	Very high	94.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	142.1	178.6	0	0	0	0	0	110.9	Y40 I41 A137 A141	Y40-A48 WeakPolarHBondContact CD2-O 3.41Å; I41-A48 HydrophobicContact CG2-CB 3.86Å; I41-A48 PolarHBondContact N-O 3.41Å; I41-A48 PolarHBondContact O-N 3.27Å; A48-A137 HydrophobicContact CB-CB 4.22Å; A48-A141 HydrophobicContact CB-CB 4.31Å
49	L	97.1	Very high	93.1	Very high	25 Å²	25	42.8 Å²	42.8	13%	0.131	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.8	176.6	-166.8	155.1	0	0	0	108	F32 A39 Y40 V51 V125 K126	F32-L49 HydrophobicContact CD2-CD2 4.2Å; F32-L49 HydrophobicContact CE2-CD1 3.58Å; F32-L49 HydrophobicContact CE2-CD2 3.47Å; F32-L49 VanDerWaalsContact CE2-CD2 3.47Å; F32-L49 HydrophobicContact CE2-CG 4.08Å; F32-L49 HydrophobicContact CZ-CD1 3.66Å; F32-L49 HydrophobicContact CZ-CD2 4.37Å; A39-L49 WeakPolarHBondContact O-CA 3.17Å; Y40-L49 HydrophobicContact CD2-CB 4.38Å; L49-V51 HydrophobicContact CD2-CG2 3.44Å; L49-V51 VanDerWaalsContact CD2-CG2 3.44Å; L49-V125 CarbonylContact O-C 3.52Å; L49-V125 WeakPolarHBondContact O-CA 3.36Å; L49-K126 PolarHBondContact N-O 3.34Å; L49-K126 PolarHBondContact O-N 3.49Å
50	A	97.4	Very high	91.8	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	143.2	173.3	0	0	0	0	0	111	S38 A39 Y124 V125 A141 A142 A145	S38-A50 WeakPolarHBondContact CA-O 3.39Å; A39-A50 PolarHBondContact N-O 2.76Å; A39-A50 PolarHBondContact O-N 2.98Å; A50-Y124 CarbonylContact C-O 3.57Å; A50-Y124 WeakPolarHBondContact CA-O 3.39Å; A50-V125 HydrophobicContact CB-CG2 4.22Å; A50-A141 VanDerWaalsContact CB-C 3.44Å; A50-A141 HydrophobicContact CB-CB 3.72Å; A50-A141 WeakPolarHBondContact CB-O 3.47Å; A50-A142 HydrophobicContact CB-CB 4.26Å; A50-A145 HydrophobicContact CB-CB 3.84Å
51	V	97.6	Very high	90.3	Very high	16 Å²	16	47.4 Å²	47.4	10%	0.097	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	136.5	176.7	-173.1	0	0	0	0	108.2	F32 A35 L49 Y53 Y124	F32-V51 HydrophobicContact CD2-CG2 3.78Å; F32-V51 HydrophobicContact CE2-CG2 4.01Å; A35-V51 HydrophobicContact CB-CG1 3.33Å; L49-V51 HydrophobicContact CD2-CG2 3.44Å; L49-V51 VanDerWaalsContact CD2-CG2 3.44Å; V51-Y53 HydrophobicContact CG1-CD2 4.13Å; V51-Y53 HydrophobicContact CG1-CE2 3.59Å; V51-Y124 PolarHBondContact N-O 2.76Å; V51-Y124 PolarHBondContact O-N 2.8Å
52	V	97.3	Very high	88.9	Confident	0 Å²	0	58 Å²	58	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	134.5	177.5	178.9	0	0	0	0	108.9	D36 G37 I121 D122 I123 A145 V146 A149 I151	D36-V52 PolarHBondContact N-O 3.22Å; G37-V52 PolarHBondContact N-O 3.38Å; G37-V52 PolarHBondContact O-N 3.42Å; V52-I121 HydrophobicContact CG1-CG2 4.02Å; V52-D122 CarbonylContact C-O 3.58Å; V52-D122 WeakPolarHBondContact CA-O 3.31Å; V52-I123 HydrophobicContact CG2-CG1 4.19Å; V52-I123 HydrophobicContact CG2-CG2 4.25Å; V52-A145 HydrophobicContact CG2-CB 3.69Å; V52-V146 HydrophobicContact CG2-CG2 3.83Å; V52-A149 HydrophobicContact CB-CB 4.37Å; V52-A149 HydrophobicContact CG1-CB 4.14Å; V52-I151 HydrophobicContact CG1-CD1 3.72Å
53	Y	95.5	Very high	87.7	Confident	97 Å²	97	61.2 Å²	61.2	38%	0.38	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	137.1	169.9	-68.8	-82.2	0	0	0	110	A35 D36 V51 D122 Y124	A35-Y53 HydrophobicContact CB-CD1 4.49Å; A35-Y53 HydrophobicContact CB-CE1 3.9Å; D36-Y53 WeakPolarHBondContact OD2-CA 3.21Å; V51-Y53 HydrophobicContact CG1-CD2 4.13Å; V51-Y53 HydrophobicContact CG1-CE2 3.59Å; Y53-D122 PolarHBondContact N-O 2.95Å; Y53-D122 PolarHBondContact O-N 3.02Å; Y53-Y124 AromaticContact CD2-CD2 3.77Å; Y53-Y124 HydrophobicContact CD2-CD2 3.77Å; Y53-Y124 AromaticContact CD2-CE2 3.69Å; Y53-Y124 HydrophobicContact CD2-CE2 3.69Å; Y53-Y124 HydrophobicContact CE2-CD2 4.08Å; Y53-Y124 HydrophobicContact CE2-CE2 4.2Å
54	G	88.8	Confident	86.7	Confident	7 Å²	7	68.6 Å²	68.6	7%	0.072	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	109.2	-175.4	177.8	0	0	0	0	0	113.6	D36	D36-G54 PolarHBondContact OD2-N 3.04Å
55	P	91.1	Very high	86.1	Confident	51 Å²	51	68.6 Å²	68.6	33%	0.331	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-71	125.1	9.4	26.5	-33	0	0	0	113.2	Y116 Q120 I121	P55-Y116 HydrophobicContact CB-CD1 3.98Å; P55-Y116 HydrophobicContact CB-CE1 4.44Å; P55-Y116 HydrophobicContact CB-CG 4.11Å; P55-Y116 HydrophobicContact CG-CD1 3.67Å; P55-Y116 HydrophobicContact CG-CE1 3.64Å; P55-Y116 HydrophobicContact CG-CG 4.18Å; P55-Q120 WeakPolarHBondContact CA-O 3.29Å; P55-I121 HydrophobicContact CB-CG1 4.27Å
56	H	91	Very high	85.6	Confident	48 Å²	48	67.7 Å²	67.7	22%	0.222	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	171.7	178.4	67	-84.3	0	0	0	111.8	S119 Q120 D122	H56-S119 CarbonylContact O-C 3.52Å; H56-S119 WeakPolarHBondContact O-CA 3.4Å; H56-Q120 PolarHBondContact N-O 3.01Å; H56-Q120 PolarHBondContact ND1-O 3.34Å; H56-Q120 PolarHBondContact O-N 3.5Å; H56-D122 IonicContact CE1-OD2 3.56Å; H56-D122 PolarHBondContact CE1-OD2 3.16Å; H56-D122 IonicContact NE2-OD2 3.14Å; H56-D122 PolarHBondContact NE2-OD2 3Å
57	E	88.8	Confident	85	Confident	157 Å²	157	74 Å²	74	73%	0.734	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.7	134.9	178.8	-170.6	176.9	-175.1	0	0	111.4	R59	E57-R59 PolarHBondContact O-N 3.48Å; E57-R59 VanDerWaalsContact O-N 3.13Å
58	V	83.6	Confident	84.6	Confident	19 Å²	19	75.2 Å²	75.2	12%	0.115	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-56.1	117	-179.8	176.2	0	0	0	0	110.8	T65 Q120	V58-T65 HydrophobicContact CB-CG2 3.61Å; V58-T65 HydrophobicContact CG1-CG2 3.89Å; V58-T65 HydrophobicContact CG2-CG2 3.69Å; V58-Q120 HydrophobicContact CG2-CB 3.97Å
59	R	75.1	Confident	84.3	Confident	213 Å²	213	80.7 Å²	80.7	80%	0.804	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-88.1	137.2	179.4	-67.6	-175.2	174.4	-179.2	1.2	111.8	E57 S61	E57-R59 PolarHBondContact O-N 3.48Å; E57-R59 VanDerWaalsContact O-N 3.13Å; R59-S61 PolarHBondContact O-N 3.36Å
60	G	69.4	Low	84	Confident	89 Å²	89	79.7 Å²	79.7	92%	0.918	40%	0.4	S	S	*	.	S	Bend	trans	86.8	-18.7	162.9	0	0	0	0	0	117.7
61	S	66.1	Low	83.7	Confident	49 Å²	49	80.7 Å²	80.7	34%	0.343	41%	0.406	S	S	.	.			trans	-156.7	110.8	170.2	-167.8	0	0	0	0	113.4	R59 S63 K64	R59-S61 PolarHBondContact O-N 3.36Å; S61-S63 PolarHBondContact O-N 3.42Å; S61-S63 VanDerWaalsContact O-N 3.09Å; S61-K64 PolarHBondContact O-N 3.05Å; S61-K64 VanDerWaalsContact O-N 3.14Å
62	R	66.9	Low	83.5	Confident	223 Å²	223	80 Å²	80	84%	0.842	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-11.1	172.9	-136.9	172.7	-171.2	146.8	3.2	113.4	T65	R62-T65 PolarHBondContact O-OG1 3.27Å
63	S	70.5	Confident	83.3	Confident	110 Å²	110	83 Å²	83	77%	0.769	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-25	176.4	-174.8	0	0	0	0	112.5	S61	S61-S63 PolarHBondContact O-N 3.42Å; S61-S63 VanDerWaalsContact O-N 3.09Å
64	K	72.4	Confident	83.3	Confident	158 Å²	158	78.9 Å²	78.9	69%	0.687	40%	0.403	S	S	*	.	S	Bend	trans	-87.8	-5.3	179.2	-66.6	-175.2	179.2	-179.4	0	113.3	S61 L66 V71	S61-K64 PolarHBondContact O-N 3.05Å; S61-K64 VanDerWaalsContact O-N 3.14Å; K64-L66 PolarHBondContact O-N 3.4Å; K64-V71 VanDerWaalsContact O-CG2 3.25Å; K64-V71 WeakPolarHBondContact O-CG2 3.45Å
65	T	78.6	Confident	83.6	Confident	29 Å²	29	81.8 Å²	81.8	18%	0.178	42%	0.415	C	S	.	.			trans	-70.7	121.5	179.2	54.7	0	0	0	0	109.9	V58 R62	V58-T65 HydrophobicContact CB-CG2 3.61Å; V58-T65 HydrophobicContact CG1-CG2 3.89Å; V58-T65 HydrophobicContact CG2-CG2 3.69Å; R62-T65 PolarHBondContact O-OG1 3.27Å
66	L	81.8	Confident	83.7	Confident	72 Å²	72	79.8 Å²	79.8	38%	0.377	40%	0.4	S	S	.	.			trans	-87.3	130.2	168.9	-67.5	170.4	0	0	0	108.6	K64 R69 V71 R118	K64-L66 PolarHBondContact O-N 3.4Å; L66-R69 HydrophobicContact CB-CG 3.89Å; L66-R69 VanDerWaalsContact CB-O 3.31Å; L66-R69 WeakPolarHBondContact CB-O 3.21Å; L66-R69 HydrophobicContact CD1-CG 3.58Å; L66-R69 HydrophobicContact CG-CG 4.34Å; L66-V71 HydrophobicContact CB-CG2 4.24Å; L66-V71 HydrophobicContact CD1-CG2 4.04Å; L66-V71 HydrophobicContact CG-CG2 4.05Å; L66-R118 WeakPolarHBondContact O-CA 3.27Å; L66-R118 PolarHBondContact O-N 3.2Å
67	H	82.8	Confident	83.8	Confident	133 Å²	133	78.6 Å²	78.6	62%	0.616	40%	0.397	S	S	*	.	S	Bend	trans	-81.7	-24	-178.2	-69.3	-68	0	0	0	112.7	P117	H67-P117 WeakPolarHBondContact O-CB 3.34Å
68	D	88.3	Confident	83.9	Confident	84 Å²	84	72 Å²	72	45%	0.449	37%	0.367	S	S	.	.	S	Bend	trans	-91.9	-28.6	-176.6	60.4	-32.8	0	0	0	113.1
69	R	89.8	Confident	84.3	Confident	115 Å²	115	71.2 Å²	71.2	43%	0.434	36%	0.363	S	S	.	.	S	Bend	trans	-147.8	163.9	-172.3	72.8	-172.3	89.5	-179	1.7	113.1	L66 T113	L66-R69 HydrophobicContact CB-CG 3.89Å; L66-R69 VanDerWaalsContact CB-O 3.31Å; L66-R69 WeakPolarHBondContact CB-O 3.21Å; L66-R69 HydrophobicContact CD1-CG 3.58Å; L66-R69 HydrophobicContact CG-CG 4.34Å; R69-T113 WeakPolarHBondContact CA-O 3.46Å
70	A	90.8	Very high	85	Confident	3 Å²	3	62.7 Å²	62.7	3%	0.025	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-68.8	146	167.5	0	0	0	0	0	112.1	T113 Y116 S119 I121	A70-T113 HydrophobicContact CB-CG2 4.22Å; A70-T113 PolarHBondContact N-O 2.91Å; A70-Y116 VanDerWaalsContact CA-O 3.25Å; A70-Y116 WeakPolarHBondContact CA-O 3.24Å; A70-Y116 VanDerWaalsContact CB-O 3.32Å; A70-Y116 WeakPolarHBondContact CB-O 3.5Å; A70-Y116 PolarHBondContact N-O 2.76Å; A70-Y116 VanDerWaalsContact N-O 3.13Å; A70-S119 CarbonylContact C-O 3.58Å; A70-S119 VanDerWaalsContact CA-O 3.32Å; A70-S119 WeakPolarHBondContact CA-O 3.17Å; A70-I121 HydrophobicContact CB-CD1 4.26Å
71	V	92.1	Very high	86	Confident	22 Å²	22	65.2 Å²	65.2	13%	0.133	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	119.3	170.5	-178.1	0	0	0	0	108.4	K64 L66 S119 Q120 I121	K64-V71 VanDerWaalsContact O-CG2 3.25Å; K64-V71 WeakPolarHBondContact O-CG2 3.45Å; L66-V71 HydrophobicContact CB-CG2 4.24Å; L66-V71 HydrophobicContact CD1-CG2 4.04Å; L66-V71 HydrophobicContact CG-CG2 4.05Å; V71-S119 PolarHBondContact N-O 2.99Å; V71-Q120 WeakPolarHBondContact O-CA 3.46Å; V71-I121 PolarHBondContact O-N 2.95Å
72	I	93.5	Very high	87.1	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.005	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	127.5	171.1	-65.2	170.1	0	0	0	108.6	K104 F107 E108 V111 T113 I123	I72-K104 HydrophobicContact CG2-CG 4.45Å; I72-K104 WeakPolarHBondContact O-CD 3.42Å; I72-K104 WeakPolarHBondContact O-CE 3.32Å; I72-F107 HydrophobicContact CD1-CB 4.36Å; I72-F107 WeakPolarHBondContact CD1-O 3.3Å; I72-F107 HydrophobicContact CG2-CB 4.33Å; I72-E108 HydrophobicContact CB-CG 4.06Å; I72-E108 HydrophobicContact CD1-CB 4.41Å; I72-E108 HydrophobicContact CD1-CG 3.9Å; I72-E108 HydrophobicContact CG1-CG 4.44Å; I72-V111 HydrophobicContact CD1-CB 4.04Å; I72-V111 HydrophobicContact CD1-CG1 4.46Å; I72-V111 HydrophobicContact CD1-CG2 4.42Å; I72-T113 HydrophobicContact CD1-CG2 3.49Å; I72-T113 VanDerWaalsContact CD1-CG2 3.49Å; I72-T113 HydrophobicContact CG1-CG2 3.97Å; I72-I123 HydrophobicContact CG2-CD1 4.35Å
73	N	93.7	Very high	88.1	Confident	64 Å²	64	54.1 Å²	54.1	34%	0.342	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	115.7	175.7	174.5	41.1	0	0	0	108.5	I121 D122 I123	N73-I121 PolarHBondContact N-O 3.26Å; N73-D122 WeakPolarHBondContact CB-OD1 3.44Å; N73-D122 PolarHBondContact ND2-OD1 2.79Å; N73-D122 CarbonylContact O-C 3.57Å; N73-D122 WeakPolarHBondContact O-CA 3.08Å; N73-I123 PolarHBondContact O-N 3.47Å
74	C	94.8	Very high	88.8	Confident	9 Å²	9	54.5 Å²	54.5	6%	0.061	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.7	179.1	-62.3	0	0	0	0	109	S100 L103 K104 I123	C74-S100 WeakPolarHBondContact O-CB 3.45Å; C74-L103 HydrophobicContact CB-CB 3.96Å; C74-K104 HydrophobicContact CB-CB 4.13Å; C74-K104 VanDerWaalsContact SG-CA 3.57Å; C74-I123 CarbonylContact C-O 3.58Å; C74-I123 VanDerWaalsContact CA-O 3.26Å; C74-I123 WeakPolarHBondContact CA-O 3.33Å
75	Q	94.4	Very high	89.5	Confident	69 Å²	69	55 Å²	55	32%	0.322	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	117.4	172.5	-169	-178.2	17.6	0	0	109.9	H91 I123 Y124 V125	Q75-H91 PolarHBondContact NE2-CD2 3.47Å; Q75-H91 PolarHBondContact NE2-CE1 2.97Å; Q75-H91 PolarHBondContact NE2-NE2 3.32Å; Q75-I123 PolarHBondContact N-O 3.18Å; Q75-Y124 HydrophobicContact CB-CD1 3.72Å; Q75-Y124 HydrophobicContact CB-CE1 3.98Å; Q75-Y124 HydrophobicContact CG-CD1 4.48Å; Q75-Y124 VanDerWaalsContact OE1-CD1 3.29Å; Q75-V125 PolarHBondContact O-N 2.86Å
76	Y	94.5	Very high	89.8	Confident	9 Å²	9	63.4 Å²	63.4	4%	0.035	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	133.8	172.2	174.7	-89.6	0	0	0	110.6	M78 H91 M99 S100 L103 I127 C138	Y76-M78 HydrophobicContact CE1-CB 4.08Å; Y76-H91 PolarHBondContact O-ND1 3.31Å; Y76-M99 HydrophobicContact CD1-CB 3.91Å; Y76-M99 HydrophobicContact CD1-CG 4.14Å; Y76-M99 HydrophobicContact CD2-CB 4.23Å; Y76-M99 HydrophobicContact CD2-CG 3.59Å; Y76-M99 HydrophobicContact CE1-CB 4.34Å; Y76-M99 HydrophobicContact CE1-CG 4.35Å; Y76-M99 HydrophobicContact CE2-CG 3.83Å; Y76-M99 HydrophobicContact CG-CB 3.83Å; Y76-M99 HydrophobicContact CG-CG 3.74Å; Y76-S100 WeakPolarHBondContact CB-OG 3.39Å; Y76-S100 PolarHBondContact N-OG 3.1Å; Y76-L103 HydrophobicContact CD2-CD1 4.38Å; Y76-I127 HydrophobicContact CE2-CD1 3.69Å; Y76-I127 HydrophobicContact CE2-CG1 3.82Å; Y76-I127 WeakPolarHBondContact OH-CD1 3.5Å; Y76-C138 VanDerWaalsContact CE2-SG 3.58Å
77	S	92.8	Very high	89.7	Confident	22 Å²	22	63.4 Å²	63.4	15%	0.154	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	151.6	170	-174.1	0	0	0	0	110.6	P90 V125 K126 I127	S77-P90 PolarHBondContact OG-O 3.42Å; S77-V125 PolarHBondContact N-O 3.21Å; S77-K126 VanDerWaalsContact O-CA 3.31Å; S77-K126 WeakPolarHBondContact O-CA 3.2Å; S77-K126 WeakPolarHBondContact O-CD 3.14Å; S77-K126 PolarHBondContact OG-NZ 3.02Å; S77-I127 PolarHBondContact O-N 2.93Å
78	M	90.9	Very high	89.4	Confident	18 Å²	18	68.3 Å²	68.3	9%	0.089	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	132.3	-177.7	-172.7	177	155.3	0	0	107.7	Y76 S82 T83 K87 P90 K126 I127	Y76-M78 HydrophobicContact CE1-CB 4.08Å; M78-S82 WeakPolarHBondContact CE-OG 3.48Å; M78-S82 WeakPolarHBondContact CG-OG 3.3Å; M78-T83 HydrophobicContact CE-CG2 3.37Å; M78-K87 HydrophobicContact CE-CD 3.87Å; M78-K87 HydrophobicContact SD-CD 4.26Å; M78-K87 PolarHBondContact SD-NZ 3.47Å; M78-P90 PolarHBondContact N-O 2.9Å; M78-P90 WeakPolarHBondContact O-CA 3Å; M78-P90 WeakPolarHBondContact O-CB 3.5Å; M78-K126 VanDerWaalsContact C-NZ 3.31Å; M78-K126 PolarHBondContact O-NZ 2.91Å; M78-I127 HydrophobicContact CG-CB 4.38Å
79	A	90.8	Very high	88.9	Confident	4 Å²	4	72.3 Å²	72.3	3%	0.033	34%	0.337	C	S	.	.			trans	-66.1	146.4	179.4	0	0	0	0	0	110.2	F81 S82 I127	A79-F81 HydrophobicContact CB-CD1 4.19Å; A79-F81 HydrophobicContact CB-CD2 4.18Å; A79-F81 HydrophobicContact CB-CE1 3.9Å; A79-F81 HydrophobicContact CB-CE2 3.87Å; A79-F81 HydrophobicContact CB-CG 4.33Å; A79-F81 HydrophobicContact CB-CZ 3.73Å; A79-F81 PolarHBondContact O-N 2.96Å; A79-S82 VanDerWaalsContact O-CB 3.31Å; A79-S82 WeakPolarHBondContact O-CB 3.42Å; A79-S82 PolarHBondContact O-N 2.74Å; A79-S82 VanDerWaalsContact O-N 3.09Å; A79-S82 PolarHBondContact O-OG 2.75Å; A79-I127 WeakPolarHBondContact CB-O 3.44Å; A79-I127 PolarHBondContact N-O 3.09Å
80	T	89.9	Confident	88	Confident	33 Å²	33	69.4 Å²	69.4	20%	0.202	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-26.7	-179.1	55.9	0	0	0	0	112.3	R86 K87 P90	T80-R86 VanDerWaalsContact O-CA 3.31Å; T80-R86 WeakPolarHBondContact O-CA 3.28Å; T80-R86 WeakPolarHBondContact O-CG 3.48Å; T80-K87 WeakPolarHBondContact CB-O 3.41Å; T80-K87 WeakPolarHBondContact CG2-O 3.31Å; T80-K87 PolarHBondContact O-N 2.82Å; T80-P90 HydrophobicContact CG2-CB 4.15Å; T80-P90 HydrophobicContact CG2-CG 4.35Å
81	F	90.9	Very high	87.2	Confident	143 Å²	143	73.1 Å²	73.1	63%	0.627	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.9	6.5	176.9	58.5	-102	0	0	0	113.9	A79 T83 L128	A79-F81 HydrophobicContact CB-CD1 4.19Å; A79-F81 HydrophobicContact CB-CD2 4.18Å; A79-F81 HydrophobicContact CB-CE1 3.9Å; A79-F81 HydrophobicContact CB-CE2 3.87Å; A79-F81 HydrophobicContact CB-CG 4.33Å; A79-F81 HydrophobicContact CB-CZ 3.73Å; A79-F81 PolarHBondContact O-N 2.96Å; F81-T83 VanDerWaalsContact C-N 3.31Å; F81-T83 PolarHBondContact O-N 3.11Å; F81-L128 WeakPolarHBondContact CE2-O 3.31Å
82	S	88.8	Confident	86.5	Confident	5 Å²	5	74.8 Å²	74.8	4%	0.035	37%	0.371	C	S	.	.	S	Bend	trans	-70.7	-25.7	-174.9	58	0	0	0	0	114.2	M78 A79 L128 S130	M78-S82 WeakPolarHBondContact CE-OG 3.48Å; M78-S82 WeakPolarHBondContact CG-OG 3.3Å; A79-S82 VanDerWaalsContact O-CB 3.31Å; A79-S82 WeakPolarHBondContact O-CB 3.42Å; A79-S82 PolarHBondContact O-N 2.74Å; A79-S82 VanDerWaalsContact O-N 3.09Å; A79-S82 PolarHBondContact O-OG 2.75Å; S82-L128 VanDerWaalsContact CA-O 3.25Å; S82-L128 WeakPolarHBondContact CA-O 3.11Å; S82-L128 WeakPolarHBondContact CB-O 3.31Å; S82-S130 PolarHBondContact O-N 3.1Å
83	T	88.7	Confident	86.1	Confident	33 Å²	33	77.9 Å²	77.9	20%	0.202	39%	0.388	C	S	.	.	S	Bend	trans	-107.9	157.8	175.7	42.2	0	0	0	0	110.1	M78 F81 E85	M78-T83 HydrophobicContact CE-CG2 3.37Å; F81-T83 VanDerWaalsContact C-N 3.31Å; F81-T83 PolarHBondContact O-N 3.11Å; T83-E85 PolarHBondContact O-N 3.15Å; T83-E85 PolarHBondContact OG1-O 3.42Å
84	A	84.1	Confident	85.9	Confident	118 Å²	118	85.4 Å²	85.4	98%	0.975	41%	0.412	S	S	*	.	S	Bend	trans	-53.9	-42.1	176.4	0	0	0	0	0	111.8
85	E	87.1	Confident	85.5	Confident	169 Å²	169	91.6 Å²	91.6	79%	0.79	44%	0.438	S	S	*	.	S	Bend	trans	-88.2	128.6	169.2	-65.1	-172.9	172.4	0	0	111.1	T83 K87	T83-E85 PolarHBondContact O-N 3.15Å; T83-E85 PolarHBondContact OG1-O 3.42Å; E85-K87 PolarHBondContact O-N 2.92Å
86	R	85.4	Confident	85.3	Confident	205 Å²	205	88.7 Å²	88.7	77%	0.774	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-69.8	124	-178.6	-172.4	-178	-178	-169	0.9	110.9	T80	T80-R86 VanDerWaalsContact O-CA 3.31Å; T80-R86 WeakPolarHBondContact O-CA 3.28Å; T80-R86 WeakPolarHBondContact O-CG 3.48Å
87	K	79.3	Confident	85.2	Confident	73 Å²	73	92.3 Å²	92.3	32%	0.317	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-78	144	173.6	-65.2	-166.4	178.6	-177.7	0	112.1	M78 T80 E85	M78-K87 HydrophobicContact CE-CD 3.87Å; M78-K87 HydrophobicContact SD-CD 4.26Å; M78-K87 PolarHBondContact SD-NZ 3.47Å; T80-K87 WeakPolarHBondContact CB-O 3.41Å; T80-K87 WeakPolarHBondContact CG2-O 3.31Å; T80-K87 PolarHBondContact O-N 2.82Å; E85-K87 PolarHBondContact O-N 2.92Å
88	R	77.1	Confident	85.2	Confident	235 Å²	235	95.5 Å²	95.5	89%	0.887	46%	0.46	S	S	*	.	S	Bend	trans	-75.4	-35.2	-179.6	-167.6	176.9	178	-168.1	0.5	113.3
89	R	76.9	Confident	85.3	Confident	169 Å²	169	95.6 Å²	95.6	64%	0.638	46%	0.461	S	S	*	.			trans	-128.9	132.5	-180	-68.7	-174.3	178	178.9	-0.2	110.5
90	P	71	Confident	85.5	Confident	54 Å²	54	96.1 Å²	96.1	35%	0.351	46%	0.464	S	S	.	.	S	Bend	trans	-90.4	-10.4	178.6	33.7	-34.7	0	0	0	114.2	S77 M78 T80	S77-P90 PolarHBondContact OG-O 3.42Å; M78-P90 PolarHBondContact N-O 2.9Å; M78-P90 WeakPolarHBondContact O-CA 3Å; M78-P90 WeakPolarHBondContact O-CB 3.5Å; T80-P90 HydrophobicContact CG2-CB 4.15Å; T80-P90 HydrophobicContact CG2-CG 4.35Å
91	H	73.8	Confident	85.7	Confident	80 Å²	80	98.7 Å²	98.7	37%	0.37	48%	0.476	S	S	.	.	S	Bend	trans	-151.7	158.3	-176.3	-167.1	61.5	0	0	0	111.5	Q75 Y76 D93	Q75-H91 PolarHBondContact NE2-CD2 3.47Å; Q75-H91 PolarHBondContact NE2-CE1 2.97Å; Q75-H91 PolarHBondContact NE2-NE2 3.32Å; Y76-H91 PolarHBondContact O-ND1 3.31Å; H91-D93 VanDerWaalsContact C-N 3.31Å
92	G	78.3	Confident	85.9	Confident	57 Å²	57	92.6 Å²	92.6	59%	0.588	45%	0.45	S	S	*	.	S	Bend	trans	83.5	4.5	179.7	0	0	0	0	0	114.4	S96	G92-S96 PolarHBondContact N-OG 3.14Å
93	D	85.8	Confident	86.2	Confident	66 Å²	66	92.4 Å²	92.4	35%	0.353	45%	0.448	S	S	.	.			trans	-78.7	147.7	173.3	-68.8	-15.2	0	0	0	110.1	H91 K95 S96 T97	H91-D93 VanDerWaalsContact C-N 3.31Å; D93-K95 VanDerWaalsContact C-N 3.25Å; D93-K95 PolarHBondContact O-N 3Å; D93-S96 PolarHBondContact N-OG 2.83Å; D93-S96 VanDerWaalsContact N-OG 3.11Å; D93-S96 WeakPolarHBondContact O-CA 3.49Å; D93-S96 PolarHBondContact O-N 3.07Å; D93-S96 PolarHBondContact O-OG 3.01Å; D93-T97 PolarHBondContact O-N 2.78Å; D93-T97 PolarHBondContact O-OG1 3.16Å
94	R	88.6	Confident	86.5	Confident	223 Å²	223	94 Å²	94	84%	0.842	45%	0.452	S	S	*	.	H	α-helix	trans	-51.4	-44.1	178.1	-174.2	176.6	176.1	177	-1.2	112.6	S96 T97 E98	R94-S96 VanDerWaalsContact C-N 3.32Å; R94-S96 PolarHBondContact O-N 2.92Å; R94-T97 PolarHBondContact O-N 3.48Å; R94-E98 WeakPolarHBondContact O-CB 3.44Å; R94-E98 PolarHBondContact O-N 2.93Å
95	K	87.1	Confident	87	Confident	139 Å²	139	92.4 Å²	92.4	60%	0.604	43%	0.425	S	S	*	.	H	α-helix	trans	-63.1	-35.9	177.3	-173	169.6	-176.2	166.1	0	112.6	D93 M99	D93-K95 VanDerWaalsContact C-N 3.25Å; D93-K95 PolarHBondContact O-N 3Å; K95-M99 WeakPolarHBondContact O-CB 3.3Å; K95-M99 PolarHBondContact O-N 3.21Å
96	S	89.8	Confident	87.3	Confident	8 Å²	8	84.4 Å²	84.4	6%	0.056	39%	0.387	C	S	.	.	H	α-helix	trans	-71.6	-37	177.6	66.8	0	0	0	0	112.3	G92 D93 R94 S100	G92-S96 PolarHBondContact N-OG 3.14Å; D93-S96 PolarHBondContact N-OG 2.83Å; D93-S96 VanDerWaalsContact N-OG 3.11Å; D93-S96 WeakPolarHBondContact O-CA 3.49Å; D93-S96 PolarHBondContact O-N 3.07Å; D93-S96 PolarHBondContact O-OG 3.01Å; R94-S96 VanDerWaalsContact C-N 3.32Å; R94-S96 PolarHBondContact O-N 2.92Å; S96-S100 WeakPolarHBondContact O-CB 3.5Å; S96-S100 PolarHBondContact O-N 3.37Å; S96-S100 PolarHBondContact O-OG 3.47Å
97	T	92	Very high	87.8	Confident	84 Å²	84	74.6 Å²	74.6	52%	0.515	35%	0.35	S	S	.	.	H	α-helix	trans	-67.9	-43.6	175.5	-50.8	0	0	0	0	111.3	D93 R94 S100 L101	D93-T97 PolarHBondContact O-N 2.78Å; D93-T97 PolarHBondContact O-OG1 3.16Å; R94-T97 PolarHBondContact O-N 3.48Å; T97-S100 WeakPolarHBondContact O-CB 3.26Å; T97-S100 PolarHBondContact O-N 3.24Å; T97-L101 PolarHBondContact O-N 2.85Å
98	E	93.3	Very high	88.4	Confident	89 Å²	89	75.2 Å²	75.2	42%	0.416	35%	0.354	S	S	.	.	H	α-helix	trans	-59.7	-48.3	174.7	175.9	173.8	-165.4	0	0	111.5	R94 S100 L101 H102	R94-E98 WeakPolarHBondContact O-CB 3.44Å; R94-E98 PolarHBondContact O-N 2.93Å; E98-S100 VanDerWaalsContact C-N 3.28Å; E98-S100 PolarHBondContact O-N 3.38Å; E98-L101 WeakPolarHBondContact O-CB 3.25Å; E98-L101 PolarHBondContact O-N 2.87Å; E98-H102 WeakPolarHBondContact CG-CE1 3.27Å; E98-H102 PolarHBondContact O-N 3.42Å; E98-H102 IonicContact OE1-CE1 3.31Å
99	M	92.5	Very high	89.1	Confident	20 Å²	20	65.6 Å²	65.6	10%	0.099	33%	0.325	C	S	.	.	H	α-helix	trans	-61	-38.1	176.4	-160.9	62.9	68.4	0	0	112.6	Y76 K95 L101 H102 L103 Y135	Y76-M99 HydrophobicContact CD1-CB 3.91Å; Y76-M99 HydrophobicContact CD1-CG 4.14Å; Y76-M99 HydrophobicContact CD2-CB 4.23Å; Y76-M99 HydrophobicContact CD2-CG 3.59Å; Y76-M99 HydrophobicContact CE1-CB 4.34Å; Y76-M99 HydrophobicContact CE1-CG 4.35Å; Y76-M99 HydrophobicContact CE2-CG 3.83Å; Y76-M99 HydrophobicContact CG-CB 3.83Å; Y76-M99 HydrophobicContact CG-CG 3.74Å; K95-M99 WeakPolarHBondContact O-CB 3.3Å; K95-M99 PolarHBondContact O-N 3.21Å; M99-L101 VanDerWaalsContact C-N 3.31Å; M99-L101 PolarHBondContact O-N 2.71Å; M99-H102 PolarHBondContact O-N 3.09Å; M99-L103 WeakPolarHBondContact O-CG 3.39Å; M99-L103 PolarHBondContact O-N 3.36Å; M99-Y135 HydrophobicContact SD-CD2 3.31Å; M99-Y135 WeakPolarHBondContact SD-CD2 3.44Å; M99-Y135 HydrophobicContact SD-CE2 4.25Å; M99-Y135 HydrophobicContact SD-CG 3.93Å
100	S	94.6	Very high	89.9	Confident	15 Å²	15	57.6 Å²	57.6	11%	0.105	30%	0.295	C	S	.	.	H	α-helix	trans	-62.9	-39.2	174.9	-58.2	0	0	0	0	111.6	C74 Y76 S96 T97 E98 K104	C74-S100 WeakPolarHBondContact O-CB 3.45Å; Y76-S100 WeakPolarHBondContact CB-OG 3.39Å; Y76-S100 PolarHBondContact N-OG 3.1Å; S96-S100 WeakPolarHBondContact O-CB 3.5Å; S96-S100 PolarHBondContact O-N 3.37Å; S96-S100 PolarHBondContact O-OG 3.47Å; T97-S100 WeakPolarHBondContact O-CB 3.26Å; T97-S100 PolarHBondContact O-N 3.24Å; E98-S100 VanDerWaalsContact C-N 3.28Å; E98-S100 PolarHBondContact O-N 3.38Å; S100-K104 WeakPolarHBondContact O-CB 3.32Å; S100-K104 PolarHBondContact O-N 3.46Å
101	L	94.1	Very high	91	Very high	88 Å²	88	55.2 Å²	55.2	46%	0.461	28%	0.28	S	S	.	.	H	α-helix	trans	-66.7	-42.5	176.7	-176.5	65.9	0	0	0	111.5	T97 E98 M99 K104 Q105	T97-L101 PolarHBondContact O-N 2.85Å; E98-L101 WeakPolarHBondContact O-CB 3.25Å; E98-L101 PolarHBondContact O-N 2.87Å; M99-L101 VanDerWaalsContact C-N 3.31Å; M99-L101 PolarHBondContact O-N 2.71Å; L101-K104 WeakPolarHBondContact O-CB 3.14Å; L101-K104 PolarHBondContact O-N 2.93Å; L101-Q105 WeakPolarHBondContact O-CG 3.29Å; L101-Q105 PolarHBondContact O-N 2.93Å
102	H	94.9	Very high	91.9	Very high	15 Å²	15	54.2 Å²	54.2	7%	0.069	28%	0.277	C	S	.	.	H	α-helix	trans	-61.5	-48.4	176.6	-65.1	160.3	0	0	0	111.7	E98 M99 K104 Q105 T106 Y135 L198 Q200	E98-H102 WeakPolarHBondContact CG-CE1 3.27Å; E98-H102 PolarHBondContact O-N 3.42Å; E98-H102 IonicContact OE1-CE1 3.31Å; M99-H102 PolarHBondContact O-N 3.09Å; H102-K104 VanDerWaalsContact C-N 3.31Å; H102-K104 PolarHBondContact O-N 3.19Å; H102-Q105 PolarHBondContact O-N 3.43Å; H102-T106 WeakPolarHBondContact O-CG2 3.45Å; H102-T106 PolarHBondContact O-N 3.35Å; H102-T106 PolarHBondContact O-OG1 2.69Å; H102-Y135 HydrophobicContact CB-CE2 3.85Å; H102-L198 HydrophobicContact CB-CD2 3.55Å; H102-Q200 PolarHBondContact CE1-NE2 3.24Å; H102-Q200 PolarHBondContact CE1-OE1 3.05Å; H102-Q200 VanDerWaalsContact ND1-CD 3.3Å; H102-Q200 PolarHBondContact ND1-OE1 3.43Å; H102-Q200 PolarHBondContact NE2-NE2 2.68Å
103	L	95.3	Very high	92.6	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	25%	0.254	C	S	.	.	H	α-helix	trans	-57.4	-46.7	174.3	-70.1	173	0	0	0	110.8	C74 Y76 M99 Q105 T106 F107 V125 Y135 C138 V139	C74-L103 HydrophobicContact CB-CB 3.96Å; Y76-L103 HydrophobicContact CD2-CD1 4.38Å; M99-L103 WeakPolarHBondContact O-CG 3.39Å; M99-L103 PolarHBondContact O-N 3.36Å; L103-Q105 PolarHBondContact O-N 2.9Å; L103-T106 WeakPolarHBondContact CA-OG1 3.44Å; L103-T106 PolarHBondContact O-N 3.14Å; L103-T106 PolarHBondContact O-OG1 3.4Å; L103-F107 HydrophobicContact CD2-CE2 4.31Å; L103-F107 WeakPolarHBondContact O-CD2 3.34Å; L103-F107 PolarHBondContact O-N 3.23Å; L103-V125 HydrophobicContact CD1-CB 4.4Å; L103-V125 HydrophobicContact CD1-CG2 4.12Å; L103-Y135 HydrophobicContact CD2-CD2 4.42Å; L103-Y135 HydrophobicContact CD2-CE2 4.04Å; L103-Y135 HydrophobicContact CG-CE2 4.42Å; L103-C138 HydrophobicContact CD1-CB 4.44Å; L103-C138 HydrophobicContact CD2-CB 4.23Å; L103-V139 HydrophobicContact CD2-CB 4.46Å; L103-V139 HydrophobicContact CD2-CG2 3.58Å
104	K	95.3	Very high	92.9	Very high	66 Å²	66	54.5 Å²	54.5	29%	0.287	27%	0.265	S	S	.	.	H	α-helix	trans	-56.4	-50	176.8	178.7	176.6	172.2	171.9	0	112.1	I72 C74 S100 L101 H102 T106 F107 E108	I72-K104 HydrophobicContact CG2-CG 4.45Å; I72-K104 WeakPolarHBondContact O-CD 3.42Å; I72-K104 WeakPolarHBondContact O-CE 3.32Å; C74-K104 HydrophobicContact CB-CB 4.13Å; C74-K104 VanDerWaalsContact SG-CA 3.57Å; S100-K104 WeakPolarHBondContact O-CB 3.32Å; S100-K104 PolarHBondContact O-N 3.46Å; L101-K104 WeakPolarHBondContact O-CB 3.14Å; L101-K104 PolarHBondContact O-N 2.93Å; H102-K104 VanDerWaalsContact C-N 3.31Å; H102-K104 PolarHBondContact O-N 3.19Å; K104-T106 VanDerWaalsContact C-N 3.31Å; K104-T106 PolarHBondContact O-N 3.42Å; K104-F107 PolarHBondContact O-N 3.15Å; K104-E108 WeakPolarHBondContact CE-OE1 3.34Å; K104-E108 HydrophobicContact CG-CG 4.25Å; K104-E108 IonicContact NZ-OE1 3.11Å; K104-E108 WeakPolarHBondContact O-CB 3.45Å; K104-E108 VanDerWaalsContact O-CG 3.3Å; K104-E108 WeakPolarHBondContact O-CG 2.88Å; K104-E108 PolarHBondContact O-N 3.01Å
105	Q	94.4	Very high	93.1	Very high	85 Å²	85	49 Å²	49	40%	0.397	25%	0.252	S	S	.	.	H	α-helix	trans	-59.8	-40.9	179	-74	174.1	-26.4	0	0	112.1	L101 H102 L103 A109	L101-Q105 WeakPolarHBondContact O-CG 3.29Å; L101-Q105 PolarHBondContact O-N 2.93Å; H102-Q105 PolarHBondContact O-N 3.43Å; L103-Q105 PolarHBondContact O-N 2.9Å; Q105-A109 PolarHBondContact O-N 2.87Å
106	T	94.6	Very high	93.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.8	-46.3	177.9	54.9	0	0	0	0	113.4	H102 L103 K104 A109 A110 Y135 A188 A197 L198	H102-T106 WeakPolarHBondContact O-CG2 3.45Å; H102-T106 PolarHBondContact O-N 3.35Å; H102-T106 PolarHBondContact O-OG1 2.69Å; L103-T106 WeakPolarHBondContact CA-OG1 3.44Å; L103-T106 PolarHBondContact O-N 3.14Å; L103-T106 PolarHBondContact O-OG1 3.4Å; K104-T106 VanDerWaalsContact C-N 3.31Å; K104-T106 PolarHBondContact O-N 3.42Å; T106-A109 PolarHBondContact O-N 3.01Å; T106-A110 PolarHBondContact O-N 3.19Å; T106-Y135 WeakPolarHBondContact CG2-OH 3.33Å; T106-A188 HydrophobicContact CG2-CB 3.91Å; T106-A197 HydrophobicContact CG2-CB 4.25Å; T106-L198 HydrophobicContact CG2-CB 3.52Å; T106-L198 HydrophobicContact CG2-CD2 4.31Å; T106-L198 HydrophobicContact CG2-CG 4.48Å
107	F	94.9	Very high	93.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-74.8	-28.2	-179.9	-72.1	-69	0	0	0	112.3	I72 L103 K104 A109 A110 V111 I123 A142 V146 V157	I72-F107 HydrophobicContact CD1-CB 4.36Å; I72-F107 WeakPolarHBondContact CD1-O 3.3Å; I72-F107 HydrophobicContact CG2-CB 4.33Å; L103-F107 HydrophobicContact CD2-CE2 4.31Å; L103-F107 WeakPolarHBondContact O-CD2 3.34Å; L103-F107 PolarHBondContact O-N 3.23Å; K104-F107 PolarHBondContact O-N 3.15Å; F107-A109 VanDerWaalsContact C-N 3.28Å; F107-A109 PolarHBondContact O-N 3.41Å; F107-A110 PolarHBondContact O-N 3.42Å; F107-V111 HydrophobicContact CB-CG2 4.32Å; F107-V111 HydrophobicContact CD1-CG2 4.33Å; F107-V111 VanDerWaalsContact O-CB 3.27Å; F107-V111 WeakPolarHBondContact O-CB 3.48Å; F107-V111 WeakPolarHBondContact O-CG2 3.41Å; F107-V111 PolarHBondContact O-N 3.42Å; F107-I123 HydrophobicContact CB-CD1 4.04Å; F107-I123 HydrophobicContact CD1-CD1 4.31Å; F107-I123 HydrophobicContact CD2-CD1 3.91Å; F107-I123 HydrophobicContact CG-CD1 3.81Å; F107-A142 HydrophobicContact CE1-CB 4.33Å; F107-A142 HydrophobicContact CE2-CB 3.42Å; F107-A142 VanDerWaalsContact CE2-CB 3.42Å; F107-A142 HydrophobicContact CZ-CB 3.31Å; F107-V146 HydrophobicContact CD1-CG2 4.38Å; F107-V146 HydrophobicContact CE1-CG2 4.32Å; F107-V157 HydrophobicContact CE1-CG2 4.47Å
108	E	92.9	Very high	93.1	Very high	85 Å²	85	51.5 Å²	51.5	40%	0.397	26%	0.255	S	S	.	.	H	α-helix	trans	-62	-34.6	169.2	-78.8	-179	164.2	0	0	112.9	I72 K104	I72-E108 HydrophobicContact CB-CG 4.06Å; I72-E108 HydrophobicContact CD1-CB 4.41Å; I72-E108 HydrophobicContact CD1-CG 3.9Å; I72-E108 HydrophobicContact CG1-CG 4.44Å; K104-E108 WeakPolarHBondContact CE-OE1 3.34Å; K104-E108 HydrophobicContact CG-CG 4.25Å; K104-E108 IonicContact NZ-OE1 3.11Å; K104-E108 WeakPolarHBondContact O-CB 3.45Å; K104-E108 VanDerWaalsContact O-CG 3.3Å; K104-E108 WeakPolarHBondContact O-CG 2.88Å; K104-E108 PolarHBondContact O-N 3.01Å
109	A	91.9	Very high	93	Very high	34 Å²	34	48.4 Å²	48.4	28%	0.281	24%	0.244	S	C	.	.	H	α-helix	trans	-75.9	-30.8	176.1	0	0	0	0	0	113.1	Q105 T106 F107 R154	Q105-A109 PolarHBondContact O-N 2.87Å; T106-A109 PolarHBondContact O-N 3.01Å; F107-A109 VanDerWaalsContact C-N 3.28Å; F107-A109 PolarHBondContact O-N 3.41Å; A109-R154 PolarHBondContact O-NH1 3.32Å
110	A	92.9	Very high	93	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-94.9	-40.6	-172.3	0	0	0	0	0	114.4	T106 F107 R154 V157 L190	T106-A110 PolarHBondContact O-N 3.19Å; F107-A110 PolarHBondContact O-N 3.42Å; A110-R154 PolarHBondContact O-N 3.23Å; A110-V157 HydrophobicContact CB-CG2 3.13Å; A110-L190 HydrophobicContact CB-CD2 3.99Å
111	V	93.9	Very high	93.1	Very high	5 Å²	5	48 Å²	48	3%	0.03	24%	0.24	C	C	.	.	B	Isolated β-bridge	trans	-78.5	138.4	-176.9	176.4	0	0	0	0	110.3	I72 F107 T113 I121 V146 I151	I72-V111 HydrophobicContact CD1-CB 4.04Å; I72-V111 HydrophobicContact CD1-CG1 4.46Å; I72-V111 HydrophobicContact CD1-CG2 4.42Å; F107-V111 HydrophobicContact CB-CG2 4.32Å; F107-V111 HydrophobicContact CD1-CG2 4.33Å; F107-V111 VanDerWaalsContact O-CB 3.27Å; F107-V111 WeakPolarHBondContact O-CB 3.48Å; F107-V111 WeakPolarHBondContact O-CG2 3.41Å; F107-V111 PolarHBondContact O-N 3.42Å; V111-T113 HydrophobicContact CB-CG2 4.42Å; V111-T113 HydrophobicContact CG1-CG2 4.22Å; V111-T113 PolarHBondContact O-N 3.32Å; V111-I121 HydrophobicContact CG1-CD1 4.14Å; V111-V146 HydrophobicContact CG2-CG1 4.27Å; V111-I151 HydrophobicContact CG1-CG2 3.76Å
112	L	93.9	Very high	93.1	Very high	59 Å²	59	44.3 Å²	44.3	31%	0.309	22%	0.221	S	C	.	.			trans	-79.8	70.2	177.6	-67.3	173	0	0	0	111	N114 L115 P152 R154	L112-N114 PolarHBondContact O-N 2.91Å; L112-N114 VanDerWaalsContact O-N 3.13Å; L112-L115 HydrophobicContact CB-CD1 3.8Å; L112-L115 HydrophobicContact CB-CG 4.21Å; L112-L115 HydrophobicContact CD1-CD1 4.15Å; L112-L115 PolarHBondContact O-N 3.47Å; L112-L115 VanDerWaalsContact O-N 3.13Å; L112-P152 HydrophobicContact CD1-CB 4.34Å; L112-P152 PolarHBondContact N-O 3.02Å; L112-R154 HydrophobicContact CD2-CG 3.55Å; L112-R154 HydrophobicContact CG-CG 4.07Å
113	T	91.9	Very high	93.2	Very high	16 Å²	16	43.6 Å²	43.6	10%	0.098	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-60.3	-23.8	-176	52.5	0	0	0	0	114.3	R69 A70 I72 V111 L115 Y116	R69-T113 WeakPolarHBondContact CA-O 3.46Å; A70-T113 HydrophobicContact CB-CG2 4.22Å; A70-T113 PolarHBondContact N-O 2.91Å; I72-T113 HydrophobicContact CD1-CG2 3.49Å; I72-T113 VanDerWaalsContact CD1-CG2 3.49Å; I72-T113 HydrophobicContact CG1-CG2 3.97Å; V111-T113 HydrophobicContact CB-CG2 4.42Å; V111-T113 HydrophobicContact CG1-CG2 4.22Å; V111-T113 PolarHBondContact O-N 3.32Å; T113-L115 PolarHBondContact O-N 3.06Å; T113-Y116 PolarHBondContact O-N 2.77Å
114	N	91.9	Very high	93.2	Very high	112 Å²	112	47.3 Å²	47.3	60%	0.599	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-64	-22	177.5	-62.2	-11	0	0	0	113.4	L112 Y116	L112-N114 PolarHBondContact O-N 2.91Å; L112-N114 VanDerWaalsContact O-N 3.13Å; N114-Y116 VanDerWaalsContact C-N 3.26Å; N114-Y116 PolarHBondContact O-N 2.95Å
115	L	92.2	Very high	93.3	Very high	107 Å²	107	44.3 Å²	44.3	56%	0.56	22%	0.219	S	C	*	.	G	3₁₀ helix	trans	-75.9	-16.8	179.1	-62.5	174.7	0	0	0	112.5	L112 T113 P117 P152	L112-L115 HydrophobicContact CB-CD1 3.8Å; L112-L115 HydrophobicContact CB-CG 4.21Å; L112-L115 HydrophobicContact CD1-CD1 4.15Å; L112-L115 PolarHBondContact O-N 3.47Å; L112-L115 VanDerWaalsContact O-N 3.13Å; T113-L115 PolarHBondContact O-N 3.06Å; L115-P117 VanDerWaalsContact C-CD 3.47Å; L115-P117 WeakPolarHBondContact O-CD 3.24Å; L115-P152 HydrophobicContact CD1-CB 3.91Å; L115-P152 HydrophobicContact CD1-CG 3.61Å
116	Y	90.8	Very high	93.3	Very high	63 Å²	63	43.1 Å²	43.1	25%	0.247	21%	0.213	C	C	.	.	S	Bend	trans	-126.2	66	-175.4	-57.6	-70.5	0	0	0	111.9	P55 A70 T113 N114 S119 I151 P152	P55-Y116 HydrophobicContact CB-CD1 3.98Å; P55-Y116 HydrophobicContact CB-CE1 4.44Å; P55-Y116 HydrophobicContact CB-CG 4.11Å; P55-Y116 HydrophobicContact CG-CD1 3.67Å; P55-Y116 HydrophobicContact CG-CE1 3.64Å; P55-Y116 HydrophobicContact CG-CG 4.18Å; A70-Y116 VanDerWaalsContact CA-O 3.25Å; A70-Y116 WeakPolarHBondContact CA-O 3.24Å; A70-Y116 VanDerWaalsContact CB-O 3.32Å; A70-Y116 WeakPolarHBondContact CB-O 3.5Å; A70-Y116 PolarHBondContact N-O 2.76Å; A70-Y116 VanDerWaalsContact N-O 3.13Å; T113-Y116 PolarHBondContact O-N 2.77Å; N114-Y116 VanDerWaalsContact C-N 3.26Å; N114-Y116 PolarHBondContact O-N 2.95Å; Y116-S119 PolarHBondContact O-N 3.11Å; Y116-I151 HydrophobicContact CE2-CG2 4.35Å; Y116-P152 HydrophobicContact CE2-CG 3.51Å; Y116-P152 WeakPolarHBondContact OH-CD 3.23Å; Y116-P152 WeakPolarHBondContact OH-CG 3.39Å
117	P	89.9	Confident	93.3	Very high	62 Å²	62	43.1 Å²	43.1	40%	0.403	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	140.7	178.6	28.2	-34.8	0	0	0	110.9	H67 L115 S119	H67-P117 WeakPolarHBondContact O-CB 3.34Å; L115-P117 VanDerWaalsContact C-CD 3.47Å; L115-P117 WeakPolarHBondContact O-CD 3.24Å; P117-S119 PolarHBondContact O-N 3.09Å
118	R	88.8	Confident	93.3	Very high	159 Å²	159	45.7 Å²	45.7	60%	0.6	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	63	12.6	-179.6	-50.2	177.1	-127.3	-166	1.9	115.3	L66	L66-R118 WeakPolarHBondContact O-CA 3.27Å; L66-R118 PolarHBondContact O-N 3.2Å
119	S	91.8	Very high	93.4	Very high	25 Å²	25	45.5 Å²	45.5	18%	0.175	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	161.5	174.5	-55.8	0	0	0	0	111.9	H56 A70 V71 Y116 P117	H56-S119 CarbonylContact O-C 3.52Å; H56-S119 WeakPolarHBondContact O-CA 3.4Å; A70-S119 CarbonylContact C-O 3.58Å; A70-S119 VanDerWaalsContact CA-O 3.32Å; A70-S119 WeakPolarHBondContact CA-O 3.17Å; V71-S119 PolarHBondContact N-O 2.99Å; Y116-S119 PolarHBondContact O-N 3.11Å; P117-S119 PolarHBondContact O-N 3.09Å
120	Q	92.8	Very high	93.4	Very high	24 Å²	24	44.6 Å²	44.6	11%	0.112	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	136.9	171.9	-167.9	168.5	-34.7	0	0	109.9	P55 H56 V58 V71 D122	P55-Q120 WeakPolarHBondContact CA-O 3.29Å; H56-Q120 PolarHBondContact N-O 3.01Å; H56-Q120 PolarHBondContact ND1-O 3.34Å; H56-Q120 PolarHBondContact O-N 3.5Å; V58-Q120 HydrophobicContact CG2-CB 3.97Å; V71-Q120 WeakPolarHBondContact O-CA 3.46Å; Q120-D122 PolarHBondContact NE2-OD1 2.74Å; Q120-D122 PolarHBondContact NE2-OD2 2.93Å
121	I	94.9	Very high	93.3	Very high	2 Å²	2	46.1 Å²	46.1	1%	0.01	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	115.8	170.3	-59.9	167.2	0	0	0	106.5	V52 P55 A70 V71 N73 V111 I123 I151	V52-I121 HydrophobicContact CG1-CG2 4.02Å; P55-I121 HydrophobicContact CB-CG1 4.27Å; A70-I121 HydrophobicContact CB-CD1 4.26Å; V71-I121 PolarHBondContact O-N 2.95Å; N73-I121 PolarHBondContact N-O 3.26Å; V111-I121 HydrophobicContact CG1-CD1 4.14Å; I121-I123 HydrophobicContact CG2-CG1 4.19Å; I121-I151 HydrophobicContact CD1-CD1 4.25Å; I121-I151 HydrophobicContact CD1-CG2 4.07Å; I121-I151 HydrophobicContact CG1-CD1 4.37Å; I121-I151 HydrophobicContact CG2-CD1 3.79Å
122	D	95.3	Very high	93.1	Very high	11 Å²	11	46 Å²	46	6%	0.059	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	119.3	179.9	-73.7	-41.8	0	0	0	109.8	V52 Y53 H56 N73 Q120 Y124	V52-D122 CarbonylContact C-O 3.58Å; V52-D122 WeakPolarHBondContact CA-O 3.31Å; Y53-D122 PolarHBondContact N-O 2.95Å; Y53-D122 PolarHBondContact O-N 3.02Å; H56-D122 IonicContact CE1-OD2 3.56Å; H56-D122 PolarHBondContact CE1-OD2 3.16Å; H56-D122 IonicContact NE2-OD2 3.14Å; H56-D122 PolarHBondContact NE2-OD2 3Å; N73-D122 WeakPolarHBondContact CB-OD1 3.44Å; N73-D122 PolarHBondContact ND2-OD1 2.79Å; N73-D122 CarbonylContact O-C 3.57Å; N73-D122 WeakPolarHBondContact O-CA 3.08Å; Q120-D122 PolarHBondContact NE2-OD1 2.74Å; Q120-D122 PolarHBondContact NE2-OD2 2.93Å; D122-Y124 HydrophobicContact CB-CD2 4.39Å; D122-Y124 HydrophobicContact CB-CE2 3.59Å
123	I	96.4	Very high	92.9	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	113	178.9	-51.9	-178.9	0	0	0	108.4	V52 I72 N73 C74 Q75 F107 I121 V125 A142 V146	V52-I123 HydrophobicContact CG2-CG1 4.19Å; V52-I123 HydrophobicContact CG2-CG2 4.25Å; I72-I123 HydrophobicContact CG2-CD1 4.35Å; N73-I123 PolarHBondContact O-N 3.47Å; C74-I123 CarbonylContact C-O 3.58Å; C74-I123 VanDerWaalsContact CA-O 3.26Å; C74-I123 WeakPolarHBondContact CA-O 3.33Å; Q75-I123 PolarHBondContact N-O 3.18Å; F107-I123 HydrophobicContact CB-CD1 4.04Å; F107-I123 HydrophobicContact CD1-CD1 4.31Å; F107-I123 HydrophobicContact CD2-CD1 3.91Å; F107-I123 HydrophobicContact CG-CD1 3.81Å; I121-I123 HydrophobicContact CG2-CG1 4.19Å; I123-V125 HydrophobicContact CG2-CG2 4.12Å; I123-A142 HydrophobicContact CG2-CB 3.87Å; I123-V146 HydrophobicContact CD1-CG2 3.91Å
124	Y	96.3	Very high	92.9	Very high	78 Å²	78	43.8 Å²	43.8	31%	0.306	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	125.5	177.2	-61.1	-79.2	0	0	0	109.7	A50 V51 Y53 Q75 D122	A50-Y124 CarbonylContact C-O 3.57Å; A50-Y124 WeakPolarHBondContact CA-O 3.39Å; V51-Y124 PolarHBondContact N-O 2.76Å; V51-Y124 PolarHBondContact O-N 2.8Å; Y53-Y124 AromaticContact CD2-CD2 3.77Å; Y53-Y124 HydrophobicContact CD2-CD2 3.77Å; Y53-Y124 AromaticContact CD2-CE2 3.69Å; Y53-Y124 HydrophobicContact CD2-CE2 3.69Å; Y53-Y124 HydrophobicContact CE2-CD2 4.08Å; Y53-Y124 HydrophobicContact CE2-CE2 4.2Å; Q75-Y124 HydrophobicContact CB-CD1 3.72Å; Q75-Y124 HydrophobicContact CB-CE1 3.98Å; Q75-Y124 HydrophobicContact CG-CD1 4.48Å; Q75-Y124 VanDerWaalsContact OE1-CD1 3.29Å; D122-Y124 HydrophobicContact CB-CD2 4.39Å; D122-Y124 HydrophobicContact CB-CE2 3.59Å
125	V	95.9	Very high	93	Very high	3 Å²	3	39 Å²	39	2%	0.018	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	129.2	177.8	-169.1	0	0	0	0	110.3	L49 A50 Q75 S77 L103 I123 C138 A142	L49-V125 CarbonylContact O-C 3.52Å; L49-V125 WeakPolarHBondContact O-CA 3.36Å; A50-V125 HydrophobicContact CB-CG2 4.22Å; Q75-V125 PolarHBondContact O-N 2.86Å; S77-V125 PolarHBondContact N-O 3.21Å; L103-V125 HydrophobicContact CD1-CB 4.4Å; L103-V125 HydrophobicContact CD1-CG2 4.12Å; I123-V125 HydrophobicContact CG2-CG2 4.12Å; V125-C138 HydrophobicContact CG1-CB 3.71Å; V125-C138 VanDerWaalsContact CG1-SG 3.54Å; V125-A142 HydrophobicContact CG2-CB 4.04Å
126	K	95	Very high	93.1	Very high	61 Å²	61	33.9 Å²	33.9	27%	0.265	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	119.4	179.5	-172.4	63.3	168.2	-177.5	0	110.7	L49 S77 M78 L128	L49-K126 PolarHBondContact N-O 3.34Å; L49-K126 PolarHBondContact O-N 3.49Å; S77-K126 VanDerWaalsContact O-CA 3.31Å; S77-K126 WeakPolarHBondContact O-CA 3.2Å; S77-K126 WeakPolarHBondContact O-CD 3.14Å; S77-K126 PolarHBondContact OG-NZ 3.02Å; M78-K126 VanDerWaalsContact C-NZ 3.31Å; M78-K126 PolarHBondContact O-NZ 2.91Å; K126-L128 HydrophobicContact CG-CD2 4.18Å
127	I	95.2	Very high	93.3	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	124.6	167.7	-58	-165.4	0	0	0	109.4	Y76 S77 M78 A79 Q129 N134 C138	Y76-I127 HydrophobicContact CE2-CD1 3.69Å; Y76-I127 HydrophobicContact CE2-CG1 3.82Å; Y76-I127 WeakPolarHBondContact OH-CD1 3.5Å; S77-I127 PolarHBondContact O-N 2.93Å; M78-I127 HydrophobicContact CG-CB 4.38Å; A79-I127 WeakPolarHBondContact CB-O 3.44Å; A79-I127 PolarHBondContact N-O 3.09Å; I127-Q129 WeakPolarHBondContact CG2-O 3.44Å; I127-N134 HydrophobicContact CD1-CB 3.57Å; I127-N134 WeakPolarHBondContact CD1-OD1 3.47Å; I127-C138 VanDerWaalsContact CG1-SG 3.54Å
128	L	94.2	Very high	93.5	Very high	53 Å²	53	27.9 Å²	27.9	28%	0.277	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-42.9	174.9	-58.8	-177.9	0	0	0	111.3	Y40 K47 F81 S82 K126	Y40-L128 HydrophobicContact CE2-CD1 3.98Å; K47-L128 HydrophobicContact CB-CB 4.13Å; K47-L128 PolarHBondContact O-N 2.92Å; F81-L128 WeakPolarHBondContact CE2-O 3.31Å; S82-L128 VanDerWaalsContact CA-O 3.25Å; S82-L128 WeakPolarHBondContact CA-O 3.11Å; S82-L128 WeakPolarHBondContact CB-O 3.31Å; K126-L128 HydrophobicContact CG-CD2 4.18Å
129	Q	94.6	Very high	93.9	Very high	81 Å²	81	20.3 Å²	20.3	38%	0.379	10%	0.1	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	135.1	178.6	-173.3	173.8	-10	0	0	109	N45 T46 K47 I127	N45-Q129 VanDerWaalsContact O-CD 3.24Å; N45-Q129 VanDerWaalsContact O-CG 3.27Å; N45-Q129 WeakPolarHBondContact O-CG 3.31Å; T46-Q129 CarbonylContact C-O 3.58Å; T46-Q129 WeakPolarHBondContact CA-O 3.37Å; K47-Q129 HydrophobicContact CB-CB 4.06Å; K47-Q129 HydrophobicContact CD-CB 4.05Å; K47-Q129 VanDerWaalsContact CE-OE1 3.3Å; K47-Q129 HydrophobicContact CG-CB 4.2Å; K47-Q129 PolarHBondContact N-O 3.38Å; K47-Q129 PolarHBondContact O-N 2.73Å; I127-Q129 WeakPolarHBondContact CG2-O 3.44Å
130	S	92.6	Very high	94.1	Very high	16 Å²	16	19.1 Å²	19.1	11%	0.112	9%	0.092	C	C	.	.			trans	-117.2	117.6	-175.9	158.2	0	0	0	0	110	S82 N134	S82-S130 PolarHBondContact O-N 3.1Å; S130-N134 VanDerWaalsContact CB-OD1 3.27Å; S130-N134 WeakPolarHBondContact CB-OD1 3.48Å; S130-N134 PolarHBondContact OG-ND2 3.31Å; S130-N134 PolarHBondContact OG-OD1 2.88Å; S130-N134 VanDerWaalsContact OG-OD1 3.12Å
131	D	91.3	Very high	94.3	Very high	32 Å²	32	18 Å²	18	17%	0.171	9%	0.086	C	C	.	.	S	Bend	trans	-129.3	38.4	175.9	-173.6	34.7	0	0	0	111.5	R23 N45 T46 C174 H175	R23-D131 PolarHBondContact NH1-O 2.73Å; R23-D131 IonicContact NH1-OD2 3.54Å; R23-D131 PolarHBondContact NH1-OD2 3.5Å; R23-D131 VanDerWaalsContact NH1-OD2 3.09Å; N45-D131 HydrophobicContact CB-CB 3.7Å; N45-D131 WeakPolarHBondContact CB-OD2 3.43Å; N45-D131 PolarHBondContact ND2-OD2 3.35Å; T46-D131 WeakPolarHBondContact OG1-CA 3.39Å; T46-D131 PolarHBondContact OG1-N 3.06Å; D131-C174 WeakPolarHBondContact O-CA 3.13Å; D131-H175 PolarHBondContact O-N 3.45Å; D131-H175 VanDerWaalsContact O-N 3.1Å
132	G	89.2	Confident	94.4	Very high	2 Å²	2	17.9 Å²	17.9	2%	0.021	9%	0.086	C	C	.	.	S	Bend	trans	85.4	164.8	-173.9	0	0	0	0	0	112.5	T46 N134	T46-G132 PolarHBondContact OG1-O 2.89Å; G132-N134 PolarHBondContact O-N 3.26Å
133	G	89.6	Confident	94.5	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.01	8%	0.083	C	C	.	.			trans	62.2	30.8	-179.3	0	0	0	0	0	113.6	Y135 S136 A137 E178	G133-Y135 VanDerWaalsContact C-N 3.32Å; G133-Y135 PolarHBondContact O-N 3.5Å; G133-S136 VanDerWaalsContact C-OG 3.31Å; G133-S136 WeakPolarHBondContact CA-OG 3.36Å; G133-S136 PolarHBondContact O-N 3.49Å; G133-S136 PolarHBondContact O-OG 3.25Å; G133-A137 PolarHBondContact O-N 2.79Å; G133-E178 PolarHBondContact N-OE1 3.47Å
134	N	92.3	Very high	94.5	Very high	27 Å²	27	17.4 Å²	17.4	14%	0.144	8%	0.083	C	C	.	.	H	α-helix	trans	-58.4	-42.6	-173.8	-76.8	-40.8	0	0	0	112.8	I127 S130 G132 C138	I127-N134 HydrophobicContact CD1-CB 3.57Å; I127-N134 WeakPolarHBondContact CD1-OD1 3.47Å; S130-N134 VanDerWaalsContact CB-OD1 3.27Å; S130-N134 WeakPolarHBondContact CB-OD1 3.48Å; S130-N134 PolarHBondContact OG-ND2 3.31Å; S130-N134 PolarHBondContact OG-OD1 2.88Å; S130-N134 VanDerWaalsContact OG-OD1 3.12Å; G132-N134 PolarHBondContact O-N 3.26Å; N134-C138 WeakPolarHBondContact O-CB 3.47Å; N134-C138 PolarHBondContact O-N 3.2Å; N134-C138 VanDerWaalsContact O-N 3.13Å; N134-C138 PolarHBondContact O-SG 3.46Å
135	Y	93.4	Very high	94.5	Very high	11 Å²	11	13.7 Å²	13.7	4%	0.043	7%	0.069	C	C	.	.	H	α-helix	trans	-65.4	-46.2	178.3	173.7	-108.6	0	0	0	111.7	M99 H102 L103 T106 G133 A137 C138 V139 A159 A186 A188 L198	M99-Y135 HydrophobicContact SD-CD2 3.31Å; M99-Y135 WeakPolarHBondContact SD-CD2 3.44Å; M99-Y135 HydrophobicContact SD-CE2 4.25Å; M99-Y135 HydrophobicContact SD-CG 3.93Å; H102-Y135 HydrophobicContact CB-CE2 3.85Å; L103-Y135 HydrophobicContact CD2-CD2 4.42Å; L103-Y135 HydrophobicContact CD2-CE2 4.04Å; L103-Y135 HydrophobicContact CG-CE2 4.42Å; T106-Y135 WeakPolarHBondContact CG2-OH 3.33Å; G133-Y135 VanDerWaalsContact C-N 3.32Å; G133-Y135 PolarHBondContact O-N 3.5Å; Y135-A137 PolarHBondContact O-N 2.98Å; Y135-C138 WeakPolarHBondContact O-CB 3.42Å; Y135-C138 PolarHBondContact O-N 3.11Å; Y135-C138 VanDerWaalsContact O-N 3.16Å; Y135-V139 HydrophobicContact CD1-CG2 4.33Å; Y135-V139 HydrophobicContact CD2-CG2 4.04Å; Y135-V139 HydrophobicContact CE1-CG2 3.85Å; Y135-V139 HydrophobicContact CE2-CG2 3.55Å; Y135-V139 HydrophobicContact CG-CG2 4.44Å; Y135-V139 VanDerWaalsContact CZ-CG2 3.42Å; Y135-V139 WeakPolarHBondContact O-CG2 3.28Å; Y135-V139 PolarHBondContact O-N 2.54Å; Y135-A159 HydrophobicContact CE1-CB 4.4Å; Y135-A186 HydrophobicContact CD1-CB 3.88Å; Y135-A188 HydrophobicContact CE1-CB 4.35Å; Y135-L198 HydrophobicContact CE1-CD2 4.06Å; Y135-L198 HydrophobicContact CE2-CD2 4.11Å; Y135-L198 VanDerWaalsContact CZ-CD2 3.47Å; Y135-L198 WeakPolarHBondContact OH-CD2 3.38Å
136	S	94.3	Very high	94.5	Very high	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-59.8	-46.2	178.9	34.9	0	0	0	0	112.2	G133 C138 V139 N140 A159	G133-S136 VanDerWaalsContact C-OG 3.31Å; G133-S136 WeakPolarHBondContact CA-OG 3.36Å; G133-S136 PolarHBondContact O-N 3.49Å; G133-S136 PolarHBondContact O-OG 3.25Å; S136-C138 VanDerWaalsContact C-N 3.28Å; S136-C138 PolarHBondContact O-N 2.72Å; S136-V139 PolarHBondContact O-N 3.37Å; S136-N140 WeakPolarHBondContact O-CB 3.39Å; S136-N140 PolarHBondContact O-N 2.8Å; S136-N140 PolarHBondContact O-ND2 3.43Å; S136-A159 WeakPolarHBondContact CB-O 3.31Å
137	A	95.2	Very high	94.5	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-60.9	-39.2	177	0	0	0	0	0	111.7	T46 A48 G133 Y135 A141	T46-A137 HydrophobicContact CG2-CB 3.65Å; A48-A137 HydrophobicContact CB-CB 4.22Å; G133-A137 PolarHBondContact O-N 2.79Å; Y135-A137 PolarHBondContact O-N 2.98Å; A137-A141 VanDerWaalsContact O-CB 3.28Å; A137-A141 WeakPolarHBondContact O-CB 3.46Å; A137-A141 PolarHBondContact O-N 3.05Å
138	C	95.7	Very high	94.5	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.6	-44.3	178	-71.2	0	0	0	0	113.1	Y76 L103 V125 I127 N134 Y135 S136 A141 A142	Y76-C138 VanDerWaalsContact CE2-SG 3.58Å; L103-C138 HydrophobicContact CD1-CB 4.44Å; L103-C138 HydrophobicContact CD2-CB 4.23Å; V125-C138 HydrophobicContact CG1-CB 3.71Å; V125-C138 VanDerWaalsContact CG1-SG 3.54Å; I127-C138 VanDerWaalsContact CG1-SG 3.54Å; N134-C138 WeakPolarHBondContact O-CB 3.47Å; N134-C138 PolarHBondContact O-N 3.2Å; N134-C138 VanDerWaalsContact O-N 3.13Å; N134-C138 PolarHBondContact O-SG 3.46Å; Y135-C138 WeakPolarHBondContact O-CB 3.42Å; Y135-C138 PolarHBondContact O-N 3.11Å; Y135-C138 VanDerWaalsContact O-N 3.16Å; S136-C138 VanDerWaalsContact C-N 3.28Å; S136-C138 PolarHBondContact O-N 2.72Å; C138-A141 PolarHBondContact O-N 2.77Å; C138-A142 VanDerWaalsContact O-CB 3.28Å; C138-A142 WeakPolarHBondContact O-CB 3.44Å; C138-A142 PolarHBondContact O-N 2.98Å
139	V	96.4	Very high	94.5	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-62.3	-49.2	176.6	172.3	0	0	0	0	109.8	L103 Y135 S136 A141 A142 T143 V157 A159	L103-V139 HydrophobicContact CD2-CB 4.46Å; L103-V139 HydrophobicContact CD2-CG2 3.58Å; Y135-V139 HydrophobicContact CD1-CG2 4.33Å; Y135-V139 HydrophobicContact CD2-CG2 4.04Å; Y135-V139 HydrophobicContact CE1-CG2 3.85Å; Y135-V139 HydrophobicContact CE2-CG2 3.55Å; Y135-V139 HydrophobicContact CG-CG2 4.44Å; Y135-V139 VanDerWaalsContact CZ-CG2 3.42Å; Y135-V139 WeakPolarHBondContact O-CG2 3.28Å; Y135-V139 PolarHBondContact O-N 2.54Å; S136-V139 PolarHBondContact O-N 3.37Å; V139-A141 VanDerWaalsContact C-N 3.34Å; V139-A141 PolarHBondContact O-N 2.91Å; V139-A142 PolarHBondContact O-N 2.68Å; V139-T143 WeakPolarHBondContact O-CB 3.44Å; V139-T143 PolarHBondContact O-N 2.99Å; V139-T143 PolarHBondContact O-OG1 3.47Å; V139-V157 HydrophobicContact CG1-CB 4.22Å; V139-V157 HydrophobicContact CG1-CG1 3.59Å; V139-A159 HydrophobicContact CB-CB 3.7Å; V139-A159 HydrophobicContact CG1-CB 3.74Å; V139-A159 HydrophobicContact CG2-CB 4.04Å
140	N	96.2	Very high	94.5	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-62.1	-41.3	-179.2	-63.4	-26.2	0	0	0	111.7	I41 S136 T143 L144 C158 A159 L228	I41-N140 HydrophobicContact CD1-CB 3.63Å; S136-N140 WeakPolarHBondContact O-CB 3.39Å; S136-N140 PolarHBondContact O-N 2.8Å; S136-N140 PolarHBondContact O-ND2 3.43Å; N140-T143 PolarHBondContact O-N 2.87Å; N140-L144 WeakPolarHBondContact O-CG 3.27Å; N140-L144 PolarHBondContact O-N 3.27Å; N140-C158 WeakPolarHBondContact OD1-CA 3.42Å; N140-A159 PolarHBondContact ND2-O 2.87Å; N140-A159 PolarHBondContact OD1-N 3.25Å; N140-L228 HydrophobicContact CB-CD1 4.22Å
141	A	96.8	Very high	94.6	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-61.4	-48.3	173.6	0	0	0	0	0	111.9	A39 I41 A48 A50 A137 C138 V139 T143 L144 A145	A39-A141 WeakPolarHBondContact CB-O 3.33Å; I41-A141 HydrophobicContact CB-CB 4.38Å; I41-A141 HydrophobicContact CG2-CB 3.64Å; A48-A141 HydrophobicContact CB-CB 4.31Å; A50-A141 VanDerWaalsContact CB-C 3.44Å; A50-A141 HydrophobicContact CB-CB 3.72Å; A50-A141 WeakPolarHBondContact CB-O 3.47Å; A137-A141 VanDerWaalsContact O-CB 3.28Å; A137-A141 WeakPolarHBondContact O-CB 3.46Å; A137-A141 PolarHBondContact O-N 3.05Å; C138-A141 PolarHBondContact O-N 2.77Å; V139-A141 VanDerWaalsContact C-N 3.34Å; V139-A141 PolarHBondContact O-N 2.91Å; A141-T143 VanDerWaalsContact C-N 3.33Å; A141-T143 PolarHBondContact O-N 2.77Å; A141-L144 PolarHBondContact O-N 2.98Å; A141-A145 PolarHBondContact O-N 2.83Å
142	A	96.9	Very high	94.7	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-65.2	-37.4	-179.1	0	0	0	0	0	111.8	A50 F107 I123 V125 C138 V139 L144 A145 V146	A50-A142 HydrophobicContact CB-CB 4.26Å; F107-A142 HydrophobicContact CE1-CB 4.33Å; F107-A142 HydrophobicContact CE2-CB 3.42Å; F107-A142 VanDerWaalsContact CE2-CB 3.42Å; F107-A142 HydrophobicContact CZ-CB 3.31Å; I123-A142 HydrophobicContact CG2-CB 3.87Å; V125-A142 HydrophobicContact CG2-CB 4.04Å; C138-A142 VanDerWaalsContact O-CB 3.28Å; C138-A142 WeakPolarHBondContact O-CB 3.44Å; C138-A142 PolarHBondContact O-N 2.98Å; V139-A142 PolarHBondContact O-N 2.68Å; A142-L144 PolarHBondContact O-N 3.48Å; A142-A145 PolarHBondContact O-N 2.87Å; A142-V146 WeakPolarHBondContact O-CB 3.32Å; A142-V146 VanDerWaalsContact O-CG2 3.23Å; A142-V146 WeakPolarHBondContact O-CG2 3.31Å; A142-V146 PolarHBondContact O-N 3.19Å
143	T	96.6	Very high	94.9	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-57.2	-48.7	172.9	-63.5	0	0	0	0	111.1	V139 N140 A141 A145 V146 V147 M153 Y156 V157	V139-T143 WeakPolarHBondContact O-CB 3.44Å; V139-T143 PolarHBondContact O-N 2.99Å; V139-T143 PolarHBondContact O-OG1 3.47Å; N140-T143 PolarHBondContact O-N 2.87Å; A141-T143 VanDerWaalsContact C-N 3.33Å; A141-T143 PolarHBondContact O-N 2.77Å; T143-A145 PolarHBondContact O-N 3.17Å; T143-V146 PolarHBondContact O-N 3.4Å; T143-V147 WeakPolarHBondContact O-CG2 3.5Å; T143-V147 PolarHBondContact O-N 2.96Å; T143-M153 HydrophobicContact CG2-CE 3.93Å; T143-Y156 HydrophobicContact CG2-CD1 4.06Å; T143-V157 WeakPolarHBondContact CB-O 3.28Å; T143-V157 WeakPolarHBondContact OG1-CB 3.41Å; T143-V157 PolarHBondContact OG1-O 3.08Å
144	L	96.5	Very high	95.1	Very high	1 Å²	1	21 Å²	21	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-62.6	-41.8	176.6	-69.1	174.5	0	0	0	112	A27 M29 A39 N140 A141 A142 V146 V147 D148 L228 V232	A27-L144 HydrophobicContact CB-CD1 3.49Å; A27-L144 VanDerWaalsContact CB-CD1 3.49Å; M29-L144 WeakPolarHBondContact CE-O 3.41Å; M29-L144 HydrophobicContact CG-CB 4.31Å; M29-L144 HydrophobicContact CG-CD2 4.38Å; M29-L144 HydrophobicContact SD-CD2 3.97Å; A39-L144 HydrophobicContact CB-CB 3.51Å; A39-L144 HydrophobicContact CB-CD1 4.5Å; N140-L144 WeakPolarHBondContact O-CG 3.27Å; N140-L144 PolarHBondContact O-N 3.27Å; A141-L144 PolarHBondContact O-N 2.98Å; A142-L144 PolarHBondContact O-N 3.48Å; L144-V146 VanDerWaalsContact C-N 3.33Å; L144-V146 PolarHBondContact O-N 2.89Å; L144-V147 PolarHBondContact O-N 2.91Å; L144-D148 WeakPolarHBondContact O-CB 3.45Å; L144-D148 PolarHBondContact O-N 3.36Å; L144-L228 HydrophobicContact CD1-CD2 3.81Å; L144-L228 HydrophobicContact CD2-CB 4.5Å; L144-L228 HydrophobicContact CD2-CD2 4.09Å; L144-L228 HydrophobicContact CG-CD2 4.03Å; L144-V232 HydrophobicContact CD2-CG2 3.57Å
145	A	96.8	Very high	95.1	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-66.8	-33.7	179.2	0	0	0	0	0	112.9	A39 A50 V52 A141 A142 T143 A149	A39-A145 HydrophobicContact CB-CB 3.96Å; A50-A145 HydrophobicContact CB-CB 3.84Å; V52-A145 HydrophobicContact CG2-CB 3.69Å; A141-A145 PolarHBondContact O-N 2.83Å; A142-A145 PolarHBondContact O-N 2.87Å; T143-A145 PolarHBondContact O-N 3.17Å; A145-A149 PolarHBondContact O-N 3.31Å; A145-A149 VanDerWaalsContact O-N 3.07Å
146	V	96	Very high	95.1	Very high	0 Å²	0	22.1 Å²	22.1	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-69	-38.4	174.5	171.2	0	0	0	0	111	V52 F107 V111 I123 A142 T143 L144 A149 G150 I151 M153	V52-V146 HydrophobicContact CG2-CG2 3.83Å; F107-V146 HydrophobicContact CD1-CG2 4.38Å; F107-V146 HydrophobicContact CE1-CG2 4.32Å; V111-V146 HydrophobicContact CG2-CG1 4.27Å; I123-V146 HydrophobicContact CD1-CG2 3.91Å; A142-V146 WeakPolarHBondContact O-CB 3.32Å; A142-V146 VanDerWaalsContact O-CG2 3.23Å; A142-V146 WeakPolarHBondContact O-CG2 3.31Å; A142-V146 PolarHBondContact O-N 3.19Å; T143-V146 PolarHBondContact O-N 3.4Å; L144-V146 VanDerWaalsContact C-N 3.33Å; L144-V146 PolarHBondContact O-N 2.89Å; V146-A149 PolarHBondContact O-N 2.92Å; V146-G150 PolarHBondContact O-N 2.93Å; V146-I151 HydrophobicContact CG1-CB 3.89Å; V146-I151 HydrophobicContact CG1-CG2 4.26Å; V146-I151 PolarHBondContact O-N 3.13Å; V146-M153 HydrophobicContact CG1-SD 4.42Å
147	V	95.6	Very high	95.1	Very high	36 Å²	36	22.1 Å²	22.1	22%	0.218	12%	0.122	C	C	.	.	H	α-helix	trans	-66.3	-42.8	175.2	174.1	0	0	0	0	110.8	M29 T143 L144 A149 G150 M153 Y156 V232	M29-V147 HydrophobicContact CE-CB 4.22Å; M29-V147 HydrophobicContact CE-CG1 3.99Å; T143-V147 WeakPolarHBondContact O-CG2 3.5Å; T143-V147 PolarHBondContact O-N 2.96Å; L144-V147 PolarHBondContact O-N 2.91Å; V147-A149 VanDerWaalsContact C-N 3.31Å; V147-A149 PolarHBondContact O-N 3.5Å; V147-G150 WeakPolarHBondContact O-CA 3.01Å; V147-G150 PolarHBondContact O-N 3.35Å; V147-M153 HydrophobicContact CG2-SD 3.55Å; V147-M153 VanDerWaalsContact CG2-SD 3.55Å; V147-Y156 HydrophobicContact CG2-CD1 4.16Å; V147-Y156 HydrophobicContact CG2-CE1 3.81Å; V147-V232 HydrophobicContact CG1-CG1 4.04Å; V147-V232 HydrophobicContact CG1-CG2 4.41Å
148	D	95.1	Very high	95.1	Very high	44 Å²	44	22.1 Å²	22.1	24%	0.235	12%	0.122	C	C	.	.	H	α-helix	trans	-59.8	-40.9	175.8	-168	49.3	0	0	0	111.7	M29 G30 G37 S38 L144 G150 H235	M29-D148 HydrophobicContact CE-CB 3.84Å; G30-D148 WeakPolarHBondContact CA-OD2 3.47Å; G30-D148 PolarHBondContact N-OD2 2.93Å; G37-D148 WeakPolarHBondContact CA-OD2 3.03Å; S38-D148 PolarHBondContact N-OD2 2.98Å; S38-D148 VanDerWaalsContact O-OD2 3.1Å; L144-D148 WeakPolarHBondContact O-CB 3.45Å; L144-D148 PolarHBondContact O-N 3.36Å; D148-G150 PolarHBondContact O-N 3.16Å; D148-G150 VanDerWaalsContact O-N 3.14Å; D148-H235 IonicContact OD1-NE2 3.88Å
149	A	94.3	Very high	95	Very high	23 Å²	23	22.1 Å²	22.1	19%	0.19	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-5.2	173.6	0	0	0	0	0	114.2	D36 V52 A145 V146 V147 I151	D36-A149 HydrophobicContact CB-CB 4.5Å; D36-A149 WeakPolarHBondContact O-CA 3.46Å; V52-A149 HydrophobicContact CB-CB 4.37Å; V52-A149 HydrophobicContact CG1-CB 4.14Å; A145-A149 PolarHBondContact O-N 3.31Å; A145-A149 VanDerWaalsContact O-N 3.07Å; V146-A149 PolarHBondContact O-N 2.92Å; V147-A149 VanDerWaalsContact C-N 3.31Å; V147-A149 PolarHBondContact O-N 3.5Å; A149-I151 HydrophobicContact CB-CD1 3.98Å; A149-I151 HydrophobicContact CB-CG1 3.9Å; A149-I151 PolarHBondContact O-N 3.45Å
150	G	93.3	Very high	94.9	Very high	57 Å²	57	22.1 Å²	22.1	59%	0.588	12%	0.122	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.7	22.5	-178.4	0	0	0	0	0	114	V146 V147 D148	V146-G150 PolarHBondContact O-N 2.93Å; V147-G150 WeakPolarHBondContact O-CA 3.01Å; V147-G150 PolarHBondContact O-N 3.35Å; D148-G150 PolarHBondContact O-N 3.16Å; D148-G150 VanDerWaalsContact O-N 3.14Å
151	I	95.3	Very high	94.8	Very high	7 Å²	7	22.4 Å²	22.4	4%	0.036	12%	0.124	C	C	.	.			trans	-78.5	125.6	-178.2	-61.7	174.3	0	0	0	109.4	V52 V111 Y116 I121 V146 A149 M153	V52-I151 HydrophobicContact CG1-CD1 3.72Å; V111-I151 HydrophobicContact CG1-CG2 3.76Å; Y116-I151 HydrophobicContact CE2-CG2 4.35Å; I121-I151 HydrophobicContact CD1-CD1 4.25Å; I121-I151 HydrophobicContact CD1-CG2 4.07Å; I121-I151 HydrophobicContact CG1-CD1 4.37Å; I121-I151 HydrophobicContact CG2-CD1 3.79Å; V146-I151 HydrophobicContact CG1-CB 3.89Å; V146-I151 HydrophobicContact CG1-CG2 4.26Å; V146-I151 PolarHBondContact O-N 3.13Å; A149-I151 HydrophobicContact CB-CD1 3.98Å; A149-I151 HydrophobicContact CB-CG1 3.9Å; A149-I151 PolarHBondContact O-N 3.45Å; I151-M153 PolarHBondContact O-N 2.72Å
152	P	94.1	Very high	94.6	Very high	36 Å²	36	22.4 Å²	22.4	23%	0.234	12%	0.124	C	C	.	.			trans	-63.5	122.1	-179.8	25.8	-36	0	0	0	111.8	L112 L115 Y116	L112-P152 HydrophobicContact CD1-CB 4.34Å; L112-P152 PolarHBondContact N-O 3.02Å; L115-P152 HydrophobicContact CD1-CB 3.91Å; L115-P152 HydrophobicContact CD1-CG 3.61Å; Y116-P152 HydrophobicContact CE2-CG 3.51Å; Y116-P152 WeakPolarHBondContact OH-CD 3.23Å; Y116-P152 WeakPolarHBondContact OH-CG 3.39Å
153	M	93.6	Very high	94.3	Very high	37 Å²	37	22.4 Å²	22.4	18%	0.182	12%	0.124	C	C	.	.	B	Isolated β-bridge	trans	-123.5	153.8	175.9	65.2	-160.6	-58.4	0	0	110.7	T143 V146 V147 I151 D155 V157	T143-M153 HydrophobicContact CG2-CE 3.93Å; V146-M153 HydrophobicContact CG1-SD 4.42Å; V147-M153 HydrophobicContact CG2-SD 3.55Å; V147-M153 VanDerWaalsContact CG2-SD 3.55Å; I151-M153 PolarHBondContact O-N 2.72Å; M153-D155 VanDerWaalsContact C-N 3.34Å; M153-D155 WeakPolarHBondContact CE-O 3.48Å; M153-V157 HydrophobicContact CE-CG2 4.38Å
154	R	92.4	Very high	93.9	Very high	161 Å²	161	23.5 Å²	23.5	61%	0.608	13%	0.129	S	C	*	.	S	Bend	trans	-63.7	-42.8	177.9	-70.3	174.4	172.8	167.4	-6.4	111.7	A109 A110 L112	A109-R154 PolarHBondContact O-NH1 3.32Å; A110-R154 PolarHBondContact O-N 3.23Å; L112-R154 HydrophobicContact CD2-CG 3.55Å; L112-R154 HydrophobicContact CG-CG 4.07Å
155	D	92.7	Very high	93.4	Very high	15 Å²	15	23.9 Å²	23.9	8%	0.08	13%	0.131	C	C	.	.	S	Bend	trans	-165.1	166.7	-177	-169	16.5	0	0	0	109.6	M153 L190 P191 R192	M153-D155 VanDerWaalsContact C-N 3.34Å; M153-D155 WeakPolarHBondContact CE-O 3.48Å; D155-L190 HydrophobicContact CB-CB 4.35Å; D155-L190 HydrophobicContact CB-CD2 3.82Å; D155-L190 VanDerWaalsContact OD2-C 3.31Å; D155-P191 WeakPolarHBondContact OD2-CD 3.31Å; D155-P191 VanDerWaalsContact OD2-N 3.1Å; D155-R192 WeakPolarHBondContact OD1-CD 3.27Å; D155-R192 WeakPolarHBondContact OD1-CG 2.97Å; D155-R192 WeakPolarHBondContact OD2-CA 3.43Å; D155-R192 WeakPolarHBondContact OD2-CB 3.35Å; D155-R192 WeakPolarHBondContact OD2-CG 3.38Å; D155-R192 PolarHBondContact OD2-N 3.47Å
156	Y	92.9	Very high	92.7	Very high	47 Å²	47	29.4 Å²	29.4	18%	0.184	16%	0.16	C	C	.	.			trans	-58.9	135.5	170.7	-67.7	-59.8	0	0	0	110.7	T143 V147 P191 D229 V232	T143-Y156 HydrophobicContact CG2-CD1 4.06Å; V147-Y156 HydrophobicContact CG2-CD1 4.16Å; V147-Y156 HydrophobicContact CG2-CE1 3.81Å; Y156-P191 WeakPolarHBondContact O-CD 3.38Å; Y156-D229 HydrophobicContact CE2-CB 4.35Å; Y156-D229 PolarHBondContact OH-OD1 2.92Å; Y156-V232 HydrophobicContact CE1-CG2 4.4Å
157	V	94.5	Very high	92	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.189	C	C	.	.			trans	-96.7	112.1	169.1	-170.5	0	0	0	0	107.7	F107 A110 V139 T143 M153 A188 L190	F107-V157 HydrophobicContact CE1-CG2 4.47Å; A110-V157 HydrophobicContact CB-CG2 3.13Å; V139-V157 HydrophobicContact CG1-CB 4.22Å; V139-V157 HydrophobicContact CG1-CG1 3.59Å; T143-V157 WeakPolarHBondContact CB-O 3.28Å; T143-V157 WeakPolarHBondContact OG1-CB 3.41Å; T143-V157 PolarHBondContact OG1-O 3.08Å; M153-V157 HydrophobicContact CE-CG2 4.38Å; V157-A188 HydrophobicContact CG1-CB 4.27Å; V157-L190 HydrophobicContact CG2-CD2 4.28Å
158	C	94.6	Very high	91.6	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	132.2	178.1	-59.2	0	0	0	0	108.7	N140 L189 S225	N140-C158 WeakPolarHBondContact OD1-CA 3.42Å; C158-L189 PolarHBondContact N-O 3.44Å; C158-L189 PolarHBondContact O-N 2.92Å; C158-S225 VanDerWaalsContact SG-CA 3.51Å; C158-S225 WeakPolarHBondContact SG-CB 3.37Å
159	A	95	Very high	91.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	142.7	176.7	0	0	0	0	0	111.6	Y135 S136 V139 N140 L187 A188	Y135-A159 HydrophobicContact CE1-CB 4.4Å; S136-A159 WeakPolarHBondContact CB-O 3.31Å; V139-A159 HydrophobicContact CB-CB 3.7Å; V139-A159 HydrophobicContact CG1-CB 3.74Å; V139-A159 HydrophobicContact CG2-CB 4.04Å; N140-A159 PolarHBondContact ND2-O 2.87Å; N140-A159 PolarHBondContact OD1-N 3.25Å; A159-L187 CarbonylContact C-O 3.54Å; A159-L187 WeakPolarHBondContact CA-O 3.22Å; A159-L187 VanDerWaalsContact CB-O 3.31Å; A159-L187 WeakPolarHBondContact CB-O 3.19Å; A159-A188 HydrophobicContact CB-CB 4.03Å
160	C	93.9	Very high	91.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	152.5	172.6	-69.4	0	0	0	0	109.7	L187 A220 C221 V224	C160-L187 PolarHBondContact N-O 2.93Å; C160-L187 PolarHBondContact O-N 2.88Å; C160-A220 HydrophobicContact CB-CB 3.83Å; C160-C221 PolarHBondContact N-SG 2.82Å; C160-C221 VanDerWaalsContact N-SG 3.42Å; C160-V224 WeakPolarHBondContact SG-CG2 3.48Å
161	T	93.1	Very high	91.2	Very high	7 Å²	7	32.2 Å²	32.2	4%	0.043	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	147.4	162.8	52	0	0	0	0	109.8	D172 L173 L185 A186	T161-D172 WeakPolarHBondContact O-CA 3.43Å; T161-D172 PolarHBondContact O-N 3.29Å; T161-L173 PolarHBondContact OG1-N 2.73Å; T161-L185 CarbonylContact C-O 3.44Å; T161-L185 VanDerWaalsContact CA-O 3.27Å; T161-L185 WeakPolarHBondContact CA-O 3.25Å; T161-A186 HydrophobicContact CG2-CB 4.02Å
162	A	92.8	Very high	91	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	159.7	165.3	0	0	0	0	0	108.1	L170 L185 L213 A217	A162-L170 CarbonylContact C-O 3.54Å; A162-L170 WeakPolarHBondContact CA-O 3.44Å; A162-L185 PolarHBondContact N-O 2.8Å; A162-L185 PolarHBondContact O-N 2.88Å; A162-L185 VanDerWaalsContact O-O 3.11Å; A162-L213 HydrophobicContact CB-CD1 3.74Å; A162-L213 HydrophobicContact CB-CG 4.44Å; A162-A217 HydrophobicContact CB-CB 3.67Å
163	G	90.8	Very high	90.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	165.9	-177.5	0	0	0	0	0	111.6	P169 L170 L173 T183 L213	G163-P169 CarbonylContact O-C 3.6Å; G163-P169 WeakPolarHBondContact O-CA 3.4Å; G163-L170 PolarHBondContact N-O 2.83Å; G163-L170 PolarHBondContact O-N 2.89Å; G163-L173 VanDerWaalsContact CA-CD1 3.49Å; G163-T183 CarbonylContact C-O 3.59Å; G163-T183 WeakPolarHBondContact CA-O 3.35Å; G163-L213 WeakPolarHBondContact O-CD1 3.37Å
164	F	89.1	Confident	90.6	Very high	22 Å²	22	28.6 Å²	28.6	10%	0.096	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	117	-173.4	-161.9	-103.9	0	0	0	108.9	E167 T183 L205 H209	F164-E167 VanDerWaalsContact CZ-C 3.47Å; F164-E167 VanDerWaalsContact CZ-CA 3.41Å; F164-E167 HydrophobicContact CZ-CB 4.36Å; F164-E167 WeakPolarHBondContact CZ-OE2 3.49Å; F164-T183 PolarHBondContact N-O 3.4Å; F164-T183 VanDerWaalsContact N-O 3.11Å; F164-T183 PolarHBondContact O-N 2.81Å; F164-L205 HydrophobicContact CB-CD1 3.82Å; F164-L205 HydrophobicContact CD1-CD1 3.79Å; F164-L205 HydrophobicContact CE1-CD1 4.49Å; F164-L205 HydrophobicContact CG-CD1 3.85Å; F164-H209 HydrophobicContact CD2-CB 4.46Å; F164-H209 HydrophobicContact CE1-CB 4.31Å; F164-H209 AromaticContact CE1-CD2 3.96Å; F164-H209 AromaticContact CE1-CG 3.96Å; F164-H209 HydrophobicContact CE2-CB 4.01Å; F164-H209 HydrophobicContact CZ-CB 3.9Å; F164-H209 AromaticContact CZ-CD2 3.97Å; F164-H209 AromaticContact CZ-CG 3.55Å; F164-H209 AromaticContact CZ-ND1 3.6Å
165	V	85.5	Confident	90.4	Very high	9 Å²	9	25.5 Å²	25.5	6%	0.055	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	128.8	-177.3	-179.7	0	0	0	0	107.9	L6 E167 T168 L170	L6-V165 HydrophobicContact CB-CG1 3.95Å; L6-V165 HydrophobicContact CD1-CG1 3.75Å; L6-V165 HydrophobicContact CD1-CG2 4.4Å; L6-V165 HydrophobicContact CG-CG1 4.5Å; V165-E167 VanDerWaalsContact C-N 3.31Å; V165-E167 PolarHBondContact O-N 2.9Å; V165-T168 PolarHBondContact N-O 2.85Å; V165-T168 PolarHBondContact O-N 2.9Å; V165-T168 VanDerWaalsContact O-O 3.11Å; V165-T168 PolarHBondContact O-OG1 2.9Å; V165-L170 HydrophobicContact CB-CD1 3.79Å; V165-L170 HydrophobicContact CB-CG 4.4Å; V165-L170 HydrophobicContact CG2-CD1 3.68Å; V165-L170 HydrophobicContact CG2-CG 4.5Å
166	D	81.4	Confident	90.1	Very high	116 Å²	116	26.4 Å²	26.4	62%	0.62	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.3	48.7	176.7	-56.6	-36.6	0	0	0	113.7	T168	D166-T168 PolarHBondContact O-N 3.33Å; D166-T168 VanDerWaalsContact O-N 3.16Å
167	E	82.8	Confident	89.8	Confident	130 Å²	130	24.2 Å²	24.2	61%	0.607	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.1	11.7	-177.9	-59.8	-61.4	143.4	0	0	115.6	F164 V165 H209	F164-E167 VanDerWaalsContact CZ-C 3.47Å; F164-E167 VanDerWaalsContact CZ-CA 3.41Å; F164-E167 HydrophobicContact CZ-CB 4.36Å; F164-E167 WeakPolarHBondContact CZ-OE2 3.49Å; V165-E167 VanDerWaalsContact C-N 3.31Å; V165-E167 PolarHBondContact O-N 2.9Å; E167-H209 IonicContact OE2-CE1 3.78Å; E167-H209 PolarHBondContact OE2-CE1 2.93Å; E167-H209 IonicContact OE2-ND1 3.09Å; E167-H209 IonicContact OE2-NE2 2.78Å; E167-H209 PolarHBondContact OE2-NE2 3.12Å
168	T	87.3	Confident	89.4	Confident	42 Å²	42	27.2 Å²	27.2	26%	0.258	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	134.7	179.5	65.8	0	0	0	0	112.5	L7 V165 D166	L7-T168 HydrophobicContact CD2-CG2 4.14Å; V165-T168 PolarHBondContact N-O 2.85Å; V165-T168 PolarHBondContact O-N 2.9Å; V165-T168 VanDerWaalsContact O-O 3.11Å; V165-T168 PolarHBondContact O-OG1 2.9Å; D166-T168 PolarHBondContact O-N 3.33Å; D166-T168 VanDerWaalsContact O-N 3.16Å
169	P	90.1	Very high	89	Confident	44 Å²	44	31.2 Å²	31.2	29%	0.286	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	124.3	172.9	30.6	-32.1	0	0	0	110.5	G163 L213 A216	G163-P169 CarbonylContact O-C 3.6Å; G163-P169 WeakPolarHBondContact O-CA 3.4Å; P169-L213 HydrophobicContact CB-CD1 4.5Å; P169-A216 HydrophobicContact CB-CB 3.97Å
170	L	91	Very high	88.1	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	126.8	175.8	-59.2	-175.7	0	0	0	109.8	L7 A19 A162 G163 V165 L173	L7-L170 HydrophobicContact CD1-CD2 4.25Å; A19-L170 HydrophobicContact CB-CD2 3.71Å; A19-L170 WeakPolarHBondContact O-CA 3.38Å; A162-L170 CarbonylContact C-O 3.54Å; A162-L170 WeakPolarHBondContact CA-O 3.44Å; G163-L170 PolarHBondContact N-O 2.83Å; G163-L170 PolarHBondContact O-N 2.89Å; V165-L170 HydrophobicContact CB-CD1 3.79Å; V165-L170 HydrophobicContact CB-CG 4.4Å; V165-L170 HydrophobicContact CG2-CD1 3.68Å; V165-L170 HydrophobicContact CG2-CG 4.5Å; L170-L173 HydrophobicContact CB-CD1 4.28Å; L170-L173 WeakPolarHBondContact O-CD1 3.34Å
171	A	91.6	Very high	87	Confident	4 Å²	4	36.8 Å²	36.8	3%	0.033	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	145.7	167.4	0	0	0	0	0	111.6	R13 A19 L22 A220	R13-A171 PolarHBondContact NH1-O 3.25Å; R13-A171 PolarHBondContact NH2-O 2.88Å; A19-A171 PolarHBondContact O-N 3.16Å; L22-A171 HydrophobicContact CD2-CB 4.25Å; A171-A220 HydrophobicContact CB-CB 3.96Å
172	D	91.3	Very high	86.1	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	24%	0.237	C	C	.	.	S	Bend	trans	55	74.3	171.8	-173.8	32.9	0	0	0	115	R17 L22 R23 Q43 T161	R17-D172 IonicContact NH1-OD2 3.61Å; L22-D172 HydrophobicContact CD2-CB 3.67Å; R23-D172 WeakPolarHBondContact CB-OD2 3.41Å; R23-D172 VanDerWaalsContact CG-OD2 3.29Å; R23-D172 WeakPolarHBondContact CG-OD2 3.47Å; R23-D172 PolarHBondContact N-OD2 3.3Å; R23-D172 PolarHBondContact NH2-O 3.18Å; R23-D172 IonicContact NH2-OD1 3.47Å; Q43-D172 VanDerWaalsContact NE2-CG 3.29Å; Q43-D172 PolarHBondContact NE2-OD1 2.82Å; Q43-D172 PolarHBondContact NE2-OD2 3.2Å; T161-D172 WeakPolarHBondContact O-CA 3.43Å; T161-D172 PolarHBondContact O-N 3.29Å
173	L	90	Very high	85.7	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	24%	0.24	C	C	.	.			trans	-71	135.6	-171.6	-86.8	75.6	0	0	0	113.5	R23 T161 G163 L170 E177 E178	R23-L173 PolarHBondContact NH2-O 3.35Å; T161-L173 PolarHBondContact OG1-N 2.73Å; G163-L173 VanDerWaalsContact CA-CD1 3.49Å; L170-L173 HydrophobicContact CB-CD1 4.28Å; L170-L173 WeakPolarHBondContact O-CD1 3.34Å; L173-E177 WeakPolarHBondContact CA-OE2 3.35Å; L173-E177 HydrophobicContact CB-CB 4.37Å; L173-E177 HydrophobicContact CD2-CB 4.2Å; L173-E177 HydrophobicContact CG-CB 4.15Å; L173-E178 HydrophobicContact CB-CG 3.96Å; L173-E178 HydrophobicContact CD2-CG 4.39Å
174	C	89	Confident	85.6	Confident	3 Å²	3	39.3 Å²	39.3	2%	0.02	25%	0.251	C	S	.	.			trans	-85.6	167	174	75.4	0	0	0	0	111.7	R23 D131 A176 E177 E178	R23-C174 VanDerWaalsContact CZ-CB 3.49Å; D131-C174 WeakPolarHBondContact O-CA 3.13Å; C174-A176 PolarHBondContact O-N 3.14Å; C174-E177 PolarHBondContact N-OE2 3.34Å; C174-E177 PolarHBondContact O-N 3.27Å; C174-E177 VanDerWaalsContact O-N 3.16Å; C174-E177 VanDerWaalsContact SG-CG 3.52Å; C174-E177 PolarHBondContact SG-N 3.41Å; C174-E178 PolarHBondContact O-N 2.96Å
175	H	89.3	Confident	85.8	Confident	96 Å²	96	38.3 Å²	38.3	44%	0.444	25%	0.247	S	C	.	.	H	α-helix	trans	-59.1	-36.4	-179.9	-175	53.1	0	0	0	112.2	D131 E178 S179	D131-H175 PolarHBondContact O-N 3.45Å; D131-H175 VanDerWaalsContact O-N 3.1Å; H175-E178 PolarHBondContact O-N 2.88Å; H175-S179 VanDerWaalsContact O-CB 3.24Å; H175-S179 WeakPolarHBondContact O-CB 3.32Å; H175-S179 PolarHBondContact O-N 3.22Å; H175-S179 PolarHBondContact O-OG 3.45Å
176	A	87	Confident	86.1	Confident	34 Å²	34	38.6 Å²	38.6	28%	0.281	25%	0.25	S	S	.	.	H	α-helix	trans	-63.6	-46	176.9	0	0	0	0	0	111.4	L14 C174 S179 G180	L14-A176 HydrophobicContact CD1-CB 3.89Å; C174-A176 PolarHBondContact O-N 3.14Å; A176-S179 PolarHBondContact O-N 3.33Å; A176-S179 PolarHBondContact O-OG 3.07Å; A176-G180 PolarHBondContact O-N 2.89Å
177	E	86.8	Confident	86.7	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.5	-43.4	177	-68.9	164.9	170.5	0	0	111.7	L6 R13 L173 C174 S179 G180	L6-E177 HydrophobicContact CD2-CG 4.48Å; R13-E177 WeakPolarHBondContact CD-OE1 3.33Å; R13-E177 IonicContact CZ-OE1 3.39Å; R13-E177 IonicContact NE-OE1 3.18Å; R13-E177 IonicContact NH1-OE1 3.5Å; R13-E177 PolarHBondContact NH1-OE1 3.14Å; R13-E177 VanDerWaalsContact NH1-OE1 3.14Å; R13-E177 IonicContact NH1-OE2 3.66Å; R13-E177 PolarHBondContact NH1-OE2 3.45Å; L173-E177 WeakPolarHBondContact CA-OE2 3.35Å; L173-E177 HydrophobicContact CB-CB 4.37Å; L173-E177 HydrophobicContact CD2-CB 4.2Å; L173-E177 HydrophobicContact CG-CB 4.15Å; C174-E177 PolarHBondContact N-OE2 3.34Å; C174-E177 PolarHBondContact O-N 3.27Å; C174-E177 VanDerWaalsContact O-N 3.16Å; C174-E177 VanDerWaalsContact SG-CG 3.52Å; C174-E177 PolarHBondContact SG-N 3.41Å; E177-S179 VanDerWaalsContact C-N 3.33Å; E177-S179 PolarHBondContact O-N 2.95Å; E177-G180 PolarHBondContact O-N 3.05Å
178	E	86	Confident	87.3	Confident	63 Å²	63	26.9 Å²	26.9	29%	0.294	19%	0.192	S	C	.	.	H	α-helix	trans	-62.7	-38.9	174.8	-72.7	-177.9	-179.5	0	0	111.8	G133 L173 C174 H175 G180	G133-E178 PolarHBondContact N-OE1 3.47Å; L173-E178 HydrophobicContact CB-CG 3.96Å; L173-E178 HydrophobicContact CD2-CG 4.39Å; C174-E178 PolarHBondContact O-N 2.96Å; H175-E178 PolarHBondContact O-N 2.88Å; E178-G180 VanDerWaalsContact C-N 3.3Å; E178-G180 PolarHBondContact O-N 3.47Å
179	S	84.9	Confident	87.7	Confident	85 Å²	85	25 Å²	25	59%	0.594	18%	0.18	S	C	*	.	H	α-helix	trans	-74.1	-21	178.5	74.4	0	0	0	0	113.5	H175 A176 E177 G181	H175-S179 VanDerWaalsContact O-CB 3.24Å; H175-S179 WeakPolarHBondContact O-CB 3.32Å; H175-S179 PolarHBondContact O-N 3.22Å; H175-S179 PolarHBondContact O-OG 3.45Å; A176-S179 PolarHBondContact O-N 3.33Å; A176-S179 PolarHBondContact O-OG 3.07Å; E177-S179 VanDerWaalsContact C-N 3.33Å; E177-S179 PolarHBondContact O-N 2.95Å; S179-G181 PolarHBondContact O-N 2.85Å; S179-G181 VanDerWaalsContact O-N 3.11Å
180	G	76.7	Confident	87.9	Confident	49 Å²	49	23.7 Å²	23.7	51%	0.505	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-1.6	-179.8	0	0	0	0	0	114.4	A176 E177 E178 G182	A176-G180 PolarHBondContact O-N 2.89Å; E177-G180 PolarHBondContact O-N 3.05Å; E178-G180 VanDerWaalsContact C-N 3.3Å; E178-G180 PolarHBondContact O-N 3.47Å; G180-G182 VanDerWaalsContact C-N 3.31Å
181	G	70.2	Confident	87.8	Confident	68 Å²	68	25.1 Å²	25.1	70%	0.701	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.7	10.8	178	0	0	0	0	0	114.2	S179	S179-G181 PolarHBondContact O-N 2.85Å; S179-G181 VanDerWaalsContact O-N 3.11Å
182	G	74.5	Confident	87.6	Confident	18 Å²	18	35.3 Å²	35.3	19%	0.186	22%	0.217	C	C	.	.			trans	-66.1	161	172.4	0	0	0	0	0	112.2	G180	G180-G182 VanDerWaalsContact C-N 3.31Å
183	T	85.1	Confident	87.2	Confident	10 Å²	10	37.4 Å²	37.4	6%	0.061	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	135.4	173.8	-63.7	0	0	0	0	109.8	G163 F164 M201 A203 R204 L205 L213	G163-T183 CarbonylContact C-O 3.59Å; G163-T183 WeakPolarHBondContact CA-O 3.35Å; F164-T183 PolarHBondContact N-O 3.4Å; F164-T183 VanDerWaalsContact N-O 3.11Å; F164-T183 PolarHBondContact O-N 2.81Å; T183-M201 HydrophobicContact CG2-CG 4.13Å; T183-M201 HydrophobicContact CG2-SD 4.28Å; T183-A203 HydrophobicContact CG2-CB 4.39Å; T183-R204 PolarHBondContact OG1-O 2.88Å; T183-R204 VanDerWaalsContact OG1-O 3.09Å; T183-L205 HydrophobicContact CG2-CB 4.08Å; T183-L205 HydrophobicContact CG2-CD1 4.32Å; T183-L205 HydrophobicContact CG2-CD2 4.43Å; T183-L213 HydrophobicContact CG2-CD2 4.23Å
184	S	88.8	Confident	86.9	Confident	32 Å²	32	39.4 Å²	39.4	22%	0.224	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	127.9	174.3	69	0	0	0	0	110.5	M201 D202	S184-M201 WeakPolarHBondContact O-CA 3.21Å; S184-D202 PolarHBondContact N-O 3.07Å; S184-D202 VanDerWaalsContact N-O 3.11Å; S184-D202 PolarHBondContact O-N 3.35Å; S184-D202 VanDerWaalsContact O-O 3.14Å; S184-D202 PolarHBondContact OG-O 3.28Å
185	L	92.2	Very high	87	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.005	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	121.4	175.7	-177.8	150.1	0	0	0	107.9	T161 A162 L187 L199 Q200 M201 L210 L213 M214 A217	T161-L185 CarbonylContact C-O 3.44Å; T161-L185 VanDerWaalsContact CA-O 3.27Å; T161-L185 WeakPolarHBondContact CA-O 3.25Å; A162-L185 PolarHBondContact N-O 2.8Å; A162-L185 PolarHBondContact O-N 2.88Å; A162-L185 VanDerWaalsContact O-O 3.11Å; L185-L187 HydrophobicContact CD2-CB 3.86Å; L185-L187 HydrophobicContact CD2-CD1 4.36Å; L185-L199 HydrophobicContact CD1-CD1 4.47Å; L185-Q200 CarbonylContact C-O 3.47Å; L185-Q200 VanDerWaalsContact CA-O 3.31Å; L185-Q200 WeakPolarHBondContact CA-O 3.45Å; L185-M201 HydrophobicContact CB-CG 4.31Å; L185-M201 HydrophobicContact CD1-CB 4.39Å; L185-M201 HydrophobicContact CD1-CG 4.41Å; L185-M201 HydrophobicContact CD1-SD 4.33Å; L185-M201 HydrophobicContact CG-CB 4.44Å; L185-L210 HydrophobicContact CD1-CD1 4.16Å; L185-L213 HydrophobicContact CB-CD2 3.78Å; L185-L213 HydrophobicContact CB-CG 4.24Å; L185-L213 HydrophobicContact CD1-CD2 3.97Å; L185-L213 HydrophobicContact CD1-CG 4.28Å; L185-L213 HydrophobicContact CG-CD2 4.49Å; L185-M214 HydrophobicContact CD1-CG 4.14Å; L185-A217 HydrophobicContact CD2-CB 3.93Å
186	A	93	Very high	87.2	Confident	15 Å²	15	44.2 Å²	44.2	12%	0.124	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	125.3	173.2	0	0	0	0	0	109.4	Y135 T161 Q200	Y135-A186 HydrophobicContact CD1-CB 3.88Å; T161-A186 HydrophobicContact CG2-CB 4.02Å; A186-Q200 HydrophobicContact CB-CB 4.38Å; A186-Q200 PolarHBondContact N-O 3.25Å; A186-Q200 PolarHBondContact O-N 2.97Å
187	L	94.3	Very high	87.5	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	133.5	-175.9	-172.7	148.6	0	0	0	109.6	A159 C160 L185 L189 I196 L199 A217 M218	A159-L187 CarbonylContact C-O 3.54Å; A159-L187 WeakPolarHBondContact CA-O 3.22Å; A159-L187 VanDerWaalsContact CB-O 3.31Å; A159-L187 WeakPolarHBondContact CB-O 3.19Å; C160-L187 PolarHBondContact N-O 2.93Å; C160-L187 PolarHBondContact O-N 2.88Å; L185-L187 HydrophobicContact CD2-CB 3.86Å; L185-L187 HydrophobicContact CD2-CD1 4.36Å; L187-L189 HydrophobicContact CD2-CB 3.67Å; L187-L189 HydrophobicContact CD2-CD1 4.03Å; L187-L189 HydrophobicContact CD2-CG 4.49Å; L187-I196 HydrophobicContact CD1-CD1 4.04Å; L187-I196 HydrophobicContact CD1-CG1 4.31Å; L187-I196 HydrophobicContact CD1-CG2 4.44Å; L187-I196 HydrophobicContact CG-CG2 4.16Å; L187-L199 HydrophobicContact CD1-CD1 4.27Å; L187-A217 HydrophobicContact CB-CB 4.13Å; L187-A217 HydrophobicContact CD1-CB 4.23Å; L187-M218 HydrophobicContact CD1-CG 4.21Å; L187-M218 HydrophobicContact CD2-CG 4.48Å
188	A	95.3	Very high	87.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	124.5	169.7	0	0	0	0	0	109.5	T106 Y135 V157 A159 I196 A197 L198	T106-A188 HydrophobicContact CG2-CB 3.91Å; Y135-A188 HydrophobicContact CE1-CB 4.35Å; V157-A188 HydrophobicContact CG1-CB 4.27Å; A159-A188 HydrophobicContact CB-CB 4.03Å; A188-I196 CarbonylContact O-C 3.6Å; A188-A197 HydrophobicContact CB-CB 4.45Å; A188-A197 PolarHBondContact O-N 2.64Å; A188-L198 HydrophobicContact CB-CB 4.24Å; A188-L198 PolarHBondContact N-O 3.09Å; A188-L198 PolarHBondContact O-N 2.89Å
189	L	95.1	Very high	88.2	Confident	2 Å²	2	45 Å²	45	1%	0.01	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	143.4	-170.4	-172.5	118.7	0	0	0	111.2	C158 L187 P191 I196 M218 C221	C158-L189 PolarHBondContact N-O 3.44Å; C158-L189 PolarHBondContact O-N 2.92Å; L187-L189 HydrophobicContact CD2-CB 3.67Å; L187-L189 HydrophobicContact CD2-CD1 4.03Å; L187-L189 HydrophobicContact CD2-CG 4.49Å; L189-P191 VanDerWaalsContact CD2-CA 3.47Å; L189-P191 HydrophobicContact CD2-CB 4.02Å; L189-P191 WeakPolarHBondContact O-CD 3.31Å; L189-I196 HydrophobicContact CD1-CG1 4.43Å; L189-M218 HydrophobicContact CD1-CB 4.35Å; L189-M218 HydrophobicContact CD1-CG 3.83Å; L189-M218 HydrophobicContact CD1-SD 4.32Å; L189-C221 HydrophobicContact CB-CB 4.02Å; L189-C221 HydrophobicContact CD2-CB 4.22Å
190	L	94.1	Very high	88.6	Confident	17 Å²	17	43.1 Å²	43.1	9%	0.089	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	103.2	164.1	-64.5	133.1	0	0	0	108.2	A110 D155 V157 R192 G193 G194 H195 A197	A110-L190 HydrophobicContact CB-CD2 3.99Å; D155-L190 HydrophobicContact CB-CB 4.35Å; D155-L190 HydrophobicContact CB-CD2 3.82Å; D155-L190 VanDerWaalsContact OD2-C 3.31Å; V157-L190 HydrophobicContact CG2-CD2 4.28Å; L190-R192 PolarHBondContact O-N 2.84Å; L190-G193 PolarHBondContact O-N 2.78Å; L190-G194 WeakPolarHBondContact O-CA 3.46Å; L190-G194 PolarHBondContact O-N 3.01Å; L190-H195 HydrophobicContact CD1-CB 4.09Å; L190-H195 PolarHBondContact N-O 2.84Å; L190-A197 HydrophobicContact CD1-CB 4.21Å
191	P	89.1	Confident	89.3	Confident	29 Å²	29	44.4 Å²	44.4	19%	0.188	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-32.4	-166.2	24.9	-32.8	0	0	0	115.4	D155 Y156 L189 S225	D155-P191 WeakPolarHBondContact OD2-CD 3.31Å; D155-P191 VanDerWaalsContact OD2-N 3.1Å; Y156-P191 WeakPolarHBondContact O-CD 3.38Å; L189-P191 VanDerWaalsContact CD2-CA 3.47Å; L189-P191 HydrophobicContact CD2-CB 4.02Å; L189-P191 WeakPolarHBondContact O-CD 3.31Å; P191-S225 WeakPolarHBondContact CG-OG 3.13Å
192	R	87.1	Confident	89.9	Confident	219 Å²	219	46.2 Å²	46.2	83%	0.826	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-41.8	177.9	-68.2	179	149.1	-172.4	-5.3	112.3	D155 L190	D155-R192 WeakPolarHBondContact OD1-CD 3.27Å; D155-R192 WeakPolarHBondContact OD1-CG 2.97Å; D155-R192 WeakPolarHBondContact OD2-CA 3.43Å; D155-R192 WeakPolarHBondContact OD2-CB 3.35Å; D155-R192 WeakPolarHBondContact OD2-CG 3.38Å; D155-R192 PolarHBondContact OD2-N 3.47Å; L190-R192 PolarHBondContact O-N 2.84Å
193	G	82.1	Confident	90.4	Very high	44 Å²	44	48.2 Å²	48.2	45%	0.454	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-16.6	-179	0	0	0	0	0	114	L190 H195	L190-G193 PolarHBondContact O-N 2.78Å; G193-H195 PolarHBondContact O-N 2.87Å
194	G	85.4	Confident	90.5	Very high	43 Å²	43	59.4 Å²	59.4	44%	0.443	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	12.5	-170.7	0	0	0	0	0	113.5	L190	L190-G194 WeakPolarHBondContact O-CA 3.46Å; L190-G194 PolarHBondContact O-N 3.01Å
195	H	90.6	Very high	90.4	Very high	130 Å²	130	59.8 Å²	59.8	60%	0.602	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.3	133.7	-179	-62.9	-59.4	0	0	0	110.4	L190 G193	L190-H195 HydrophobicContact CD1-CB 4.09Å; L190-H195 PolarHBondContact N-O 2.84Å; G193-H195 PolarHBondContact O-N 2.87Å
196	I	93.4	Very high	90.4	Very high	69 Å²	69	65.3 Å²	65.3	35%	0.354	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	117.3	174.2	-59.6	170	0	0	0	107.8	L187 A188 L189 L198 L199 M214	L187-I196 HydrophobicContact CD1-CD1 4.04Å; L187-I196 HydrophobicContact CD1-CG1 4.31Å; L187-I196 HydrophobicContact CD1-CG2 4.44Å; L187-I196 HydrophobicContact CG-CG2 4.16Å; A188-I196 CarbonylContact O-C 3.6Å; L189-I196 HydrophobicContact CD1-CG1 4.43Å; I196-L198 WeakPolarHBondContact CG2-O 3.3Å; I196-L199 HydrophobicContact CG2-CB 4.08Å; I196-M214 HydrophobicContact CD1-CE 3.79Å
197	A	92.9	Very high	90.2	Very high	24 Å²	24	72.3 Å²	72.3	20%	0.198	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-38.3	178.3	0	0	0	0	0	111.6	T106 A188 L190	T106-A197 HydrophobicContact CG2-CB 4.25Å; A188-A197 HydrophobicContact CB-CB 4.45Å; A188-A197 PolarHBondContact O-N 2.64Å; L190-A197 HydrophobicContact CD1-CB 4.21Å
198	L	94.3	Very high	90.1	Very high	20 Å²	20	77.7 Å²	77.7	11%	0.105	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	140.7	174.2	-171.7	79	0	0	0	109.8	H102 T106 Y135 A188 I196 Q200	H102-L198 HydrophobicContact CB-CD2 3.55Å; T106-L198 HydrophobicContact CG2-CB 3.52Å; T106-L198 HydrophobicContact CG2-CD2 4.31Å; T106-L198 HydrophobicContact CG2-CG 4.48Å; Y135-L198 HydrophobicContact CE1-CD2 4.06Å; Y135-L198 HydrophobicContact CE2-CD2 4.11Å; Y135-L198 VanDerWaalsContact CZ-CD2 3.47Å; Y135-L198 WeakPolarHBondContact OH-CD2 3.38Å; A188-L198 HydrophobicContact CB-CB 4.24Å; A188-L198 PolarHBondContact N-O 3.09Å; A188-L198 PolarHBondContact O-N 2.89Å; I196-L198 WeakPolarHBondContact CG2-O 3.3Å; L198-Q200 HydrophobicContact CD2-CG 3.74Å; L198-Q200 HydrophobicContact CG-CG 4.02Å
199	L	93.5	Very high	89.9	Confident	71 Å²	71	80.1 Å²	80.1	37%	0.372	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	127.6	167.9	-174.3	149	0	0	0	108.2	L185 L187 I196 M214	L185-L199 HydrophobicContact CD1-CD1 4.47Å; L187-L199 HydrophobicContact CD1-CD1 4.27Å; I196-L199 HydrophobicContact CG2-CB 4.08Å; L199-M214 HydrophobicContact CD1-CE 3.82Å; L199-M214 HydrophobicContact CD1-CG 4.34Å; L199-M214 HydrophobicContact CD1-SD 4.07Å
200	Q	93	Very high	89.7	Confident	45 Å²	45	82.8 Å²	82.8	21%	0.21	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	133.8	174	-65	-124.9	-68.3	0	0	108.4	H102 L185 A186 L198	H102-Q200 PolarHBondContact CE1-NE2 3.24Å; H102-Q200 PolarHBondContact CE1-OE1 3.05Å; H102-Q200 VanDerWaalsContact ND1-CD 3.3Å; H102-Q200 PolarHBondContact ND1-OE1 3.43Å; H102-Q200 PolarHBondContact NE2-NE2 2.68Å; L185-Q200 CarbonylContact C-O 3.47Å; L185-Q200 VanDerWaalsContact CA-O 3.31Å; L185-Q200 WeakPolarHBondContact CA-O 3.45Å; A186-Q200 HydrophobicContact CB-CB 4.38Å; A186-Q200 PolarHBondContact N-O 3.25Å; A186-Q200 PolarHBondContact O-N 2.97Å; L198-Q200 HydrophobicContact CD2-CG 3.74Å; L198-Q200 HydrophobicContact CG-CG 4.02Å
201	M	91.2	Very high	89.6	Confident	75 Å²	75	88.6 Å²	88.6	37%	0.369	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	123	175.7	-174	-178.4	75.5	0	0	108.4	T183 S184 L185 L205 L210	T183-M201 HydrophobicContact CG2-CG 4.13Å; T183-M201 HydrophobicContact CG2-SD 4.28Å; S184-M201 WeakPolarHBondContact O-CA 3.21Å; L185-M201 HydrophobicContact CB-CG 4.31Å; L185-M201 HydrophobicContact CD1-CB 4.39Å; L185-M201 HydrophobicContact CD1-CG 4.41Å; L185-M201 HydrophobicContact CD1-SD 4.33Å; L185-M201 HydrophobicContact CG-CB 4.44Å; M201-L205 HydrophobicContact SD-CB 4.4Å; M201-L205 HydrophobicContact SD-CD2 4.28Å; M201-L210 HydrophobicContact SD-CD1 3.95Å
202	D	83.9	Confident	89.7	Confident	107 Å²	107	90.1 Å²	90.1	57%	0.572	46%	0.457	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.4	124.2	176.3	-66.4	-30.4	0	0	0	107.5	S184	S184-D202 PolarHBondContact N-O 3.07Å; S184-D202 VanDerWaalsContact N-O 3.11Å; S184-D202 PolarHBondContact O-N 3.35Å; S184-D202 VanDerWaalsContact O-O 3.14Å; S184-D202 PolarHBondContact OG-O 3.28Å
203	A	84.6	Confident	89.9	Confident	59 Å²	59	79.7 Å²	79.7	49%	0.488	42%	0.418	S	S	.	.	S	Bend	trans	110.9	174.1	-179.4	0	0	0	0	0	114.6	T183	T183-A203 HydrophobicContact CG2-CB 4.39Å
204	R	86.3	Confident	90.3	Very high	245 Å²	245	79.8 Å²	79.8	93%	0.925	41%	0.407	S	S	*	.			trans	-92.1	123.9	-177.6	-63.8	179.8	178.9	-177.8	-0.8	109.4	T183	T183-R204 PolarHBondContact OG1-O 2.88Å; T183-R204 VanDerWaalsContact OG1-O 3.09Å
205	L	87.9	Confident	90.7	Very high	40 Å²	40	82.7 Å²	82.7	21%	0.209	41%	0.409	C	S	.	.			trans	-130.4	144	174.6	-169.7	70	0	0	0	109.2	F164 T183 M201 H209 L210 L213	F164-L205 HydrophobicContact CB-CD1 3.82Å; F164-L205 HydrophobicContact CD1-CD1 3.79Å; F164-L205 HydrophobicContact CE1-CD1 4.49Å; F164-L205 HydrophobicContact CG-CD1 3.85Å; T183-L205 HydrophobicContact CG2-CB 4.08Å; T183-L205 HydrophobicContact CG2-CD1 4.32Å; T183-L205 HydrophobicContact CG2-CD2 4.43Å; M201-L205 HydrophobicContact SD-CB 4.4Å; M201-L205 HydrophobicContact SD-CD2 4.28Å; L205-H209 HydrophobicContact CD1-CB 4.05Å; L205-H209 HydrophobicContact CD2-CB 4.4Å; L205-H209 HydrophobicContact CG-CB 4.22Å; L205-L210 HydrophobicContact CD2-CB 4.33Å; L205-L210 HydrophobicContact CD2-CD1 4.26Å; L205-L213 HydrophobicContact CD2-CD2 3.71Å
206	H	90.5	Very high	90.7	Very high	118 Å²	118	77.6 Å²	77.6	55%	0.546	39%	0.39	S	S	.	.			trans	-71.8	143.6	169.3	-164.7	57.8	0	0	0	110.2	D208 H209	H206-D208 IonicContact CD2-OD2 3.79Å; H206-D208 IonicContact NE2-OD2 2.72Å; H206-D208 PolarHBondContact NE2-OD2 3.02Å; H206-D208 PolarHBondContact O-N 2.87Å; H206-H209 PolarHBondContact O-N 2.9Å; H206-H209 VanDerWaalsContact O-N 3.15Å
207	Q	90.6	Very high	90.7	Very high	161 Å²	161	74.3 Å²	74.3	75%	0.752	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-58.1	-36	-173.1	-178	176.2	-18.4	0	0	112.5	H209 L210	Q207-H209 PolarHBondContact O-N 3.13Å; Q207-L210 VanDerWaalsContact O-CB 3.3Å; Q207-L210 WeakPolarHBondContact O-CB 3.33Å; Q207-L210 PolarHBondContact O-N 3.13Å; Q207-L210 VanDerWaalsContact O-N 3.09Å
208	D	91.4	Very high	90.7	Very high	113 Å²	113	75.6 Å²	75.6	60%	0.604	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-64.4	-25.3	-176.8	-59.2	-10.2	0	0	0	113.2	H206	H206-D208 IonicContact CD2-OD2 3.79Å; H206-D208 IonicContact NE2-OD2 2.72Å; H206-D208 PolarHBondContact NE2-OD2 3.02Å; H206-D208 PolarHBondContact O-N 2.87Å
209	H	90.2	Very high	90.7	Very high	51 Å²	51	79.2 Å²	79.2	24%	0.236	40%	0.398	C	S	.	.	G	3₁₀ helix	trans	-91.9	-4.3	178.8	-54	-59.2	0	0	0	113.3	F164 E167 L205 H206 Q207 T212 L213	F164-H209 HydrophobicContact CD2-CB 4.46Å; F164-H209 HydrophobicContact CE1-CB 4.31Å; F164-H209 AromaticContact CE1-CD2 3.96Å; F164-H209 AromaticContact CE1-CG 3.96Å; F164-H209 HydrophobicContact CE2-CB 4.01Å; F164-H209 HydrophobicContact CZ-CB 3.9Å; F164-H209 AromaticContact CZ-CD2 3.97Å; F164-H209 AromaticContact CZ-CG 3.55Å; F164-H209 AromaticContact CZ-ND1 3.6Å; E167-H209 IonicContact OE2-CE1 3.78Å; E167-H209 PolarHBondContact OE2-CE1 2.93Å; E167-H209 IonicContact OE2-ND1 3.09Å; E167-H209 IonicContact OE2-NE2 2.78Å; E167-H209 PolarHBondContact OE2-NE2 3.12Å; L205-H209 HydrophobicContact CD1-CB 4.05Å; L205-H209 HydrophobicContact CD2-CB 4.4Å; L205-H209 HydrophobicContact CG-CB 4.22Å; H206-H209 PolarHBondContact O-N 2.9Å; H206-H209 VanDerWaalsContact O-N 3.15Å; Q207-H209 PolarHBondContact O-N 3.13Å; H209-T212 PolarHBondContact O-OG1 3.43Å; H209-L213 WeakPolarHBondContact O-CB 3.35Å; H209-L213 PolarHBondContact O-N 2.87Å; H209-L213 VanDerWaalsContact O-N 3.16Å
210	L	90.9	Very high	90.7	Very high	59 Å²	59	76.1 Å²	76.1	31%	0.309	38%	0.383	S	S	.	.	H	α-helix	trans	-67.3	-40.7	-178.1	-177.9	63.1	0	0	0	111.7	L185 M201 L205 Q207 L213 M214	L185-L210 HydrophobicContact CD1-CD1 4.16Å; M201-L210 HydrophobicContact SD-CD1 3.95Å; L205-L210 HydrophobicContact CD2-CB 4.33Å; L205-L210 HydrophobicContact CD2-CD1 4.26Å; Q207-L210 VanDerWaalsContact O-CB 3.3Å; Q207-L210 WeakPolarHBondContact O-CB 3.33Å; Q207-L210 PolarHBondContact O-N 3.13Å; Q207-L210 VanDerWaalsContact O-N 3.09Å; L210-L213 PolarHBondContact O-N 2.84Å; L210-M214 HydrophobicContact CD1-CG 4.3Å; L210-M214 HydrophobicContact CD1-SD 4.33Å; L210-M214 HydrophobicContact CG-CG 4.47Å; L210-M214 HydrophobicContact CG-SD 4.11Å; L210-M214 WeakPolarHBondContact O-CB 3.35Å; L210-M214 VanDerWaalsContact O-CG 3.31Å; L210-M214 WeakPolarHBondContact O-CG 3.35Å; L210-M214 PolarHBondContact O-N 3.35Å
211	E	92.3	Very high	90.7	Very high	139 Å²	139	74 Å²	74	65%	0.65	37%	0.373	S	S	*	.	H	α-helix	trans	-63.1	-48.9	-179	-174.6	169.5	-161	0	0	111.2	L213 M214 E215	E211-L213 VanDerWaalsContact C-N 3.32Å; E211-L213 PolarHBondContact O-N 3.19Å; E211-M214 PolarHBondContact O-N 3.29Å; E211-E215 WeakPolarHBondContact O-CG 3.4Å; E211-E215 PolarHBondContact O-N 2.98Å
212	T	91.3	Very high	90.8	Very high	61 Å²	61	75.7 Å²	75.7	37%	0.374	38%	0.378	S	S	.	.	H	α-helix	trans	-63.1	-38.8	179	59.7	0	0	0	0	112.1	H209 E215 A216	H209-T212 PolarHBondContact O-OG1 3.43Å; T212-E215 PolarHBondContact O-N 3.25Å; T212-A216 WeakPolarHBondContact O-CB 3.31Å; T212-A216 PolarHBondContact O-N 3.39Å
213	L	91.3	Very high	91.2	Very high	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-66	-43.2	176.3	-175.7	63.9	0	0	0	112	A162 G163 P169 T183 L185 L205 H209 L210 E211 A216 A217	A162-L213 HydrophobicContact CB-CD1 3.74Å; A162-L213 HydrophobicContact CB-CG 4.44Å; G163-L213 WeakPolarHBondContact O-CD1 3.37Å; P169-L213 HydrophobicContact CB-CD1 4.5Å; T183-L213 HydrophobicContact CG2-CD2 4.23Å; L185-L213 HydrophobicContact CB-CD2 3.78Å; L185-L213 HydrophobicContact CB-CG 4.24Å; L185-L213 HydrophobicContact CD1-CD2 3.97Å; L185-L213 HydrophobicContact CD1-CG 4.28Å; L185-L213 HydrophobicContact CG-CD2 4.49Å; L205-L213 HydrophobicContact CD2-CD2 3.71Å; H209-L213 WeakPolarHBondContact O-CB 3.35Å; H209-L213 PolarHBondContact O-N 2.87Å; H209-L213 VanDerWaalsContact O-N 3.16Å; L210-L213 PolarHBondContact O-N 2.84Å; E211-L213 VanDerWaalsContact C-N 3.32Å; E211-L213 PolarHBondContact O-N 3.19Å; L213-A216 PolarHBondContact O-N 3.27Å; L213-A217 WeakPolarHBondContact O-CB 3.2Å; L213-A217 PolarHBondContact O-N 3Å
214	M	91.9	Very high	91.6	Very high	46 Å²	46	69 Å²	69	23%	0.227	34%	0.34	C	S	.	.	H	α-helix	trans	-64.3	-43.2	176.7	-76.7	-177.4	63.8	0	0	111.5	L185 I196 L199 L210 E211 A216 A217 M218	L185-M214 HydrophobicContact CD1-CG 4.14Å; I196-M214 HydrophobicContact CD1-CE 3.79Å; L199-M214 HydrophobicContact CD1-CE 3.82Å; L199-M214 HydrophobicContact CD1-CG 4.34Å; L199-M214 HydrophobicContact CD1-SD 4.07Å; L210-M214 HydrophobicContact CD1-CG 4.3Å; L210-M214 HydrophobicContact CD1-SD 4.33Å; L210-M214 HydrophobicContact CG-CG 4.47Å; L210-M214 HydrophobicContact CG-SD 4.11Å; L210-M214 WeakPolarHBondContact O-CB 3.35Å; L210-M214 VanDerWaalsContact O-CG 3.31Å; L210-M214 WeakPolarHBondContact O-CG 3.35Å; L210-M214 PolarHBondContact O-N 3.35Å; E211-M214 PolarHBondContact O-N 3.29Å; M214-A216 VanDerWaalsContact C-N 3.34Å; M214-A216 PolarHBondContact O-N 3.03Å; M214-A217 PolarHBondContact O-N 3.38Å; M214-M218 HydrophobicContact CB-CE 4.47Å; M214-M218 WeakPolarHBondContact O-CB 3.11Å; M214-M218 VanDerWaalsContact O-CG 3.28Å; M214-M218 WeakPolarHBondContact O-CG 3.42Å; M214-M218 PolarHBondContact O-N 3.25Å
215	E	92	Very high	92	Very high	103 Å²	103	58.1 Å²	58.1	48%	0.481	30%	0.302	S	S	.	.	H	α-helix	trans	-61.3	-42	176.2	-73.6	-175	163.1	0	0	112.6	E211 T212 M218 T219	E211-E215 WeakPolarHBondContact O-CG 3.4Å; E211-E215 PolarHBondContact O-N 2.98Å; T212-E215 PolarHBondContact O-N 3.25Å; E215-M218 HydrophobicContact CG-CE 4.12Å; E215-M218 PolarHBondContact O-N 2.88Å; E215-T219 WeakPolarHBondContact O-CB 3.38Å; E215-T219 PolarHBondContact O-N 3.44Å; E215-T219 PolarHBondContact O-OG1 2.97Å
216	A	92.3	Very high	92.3	Very high	24 Å²	24	63.2 Å²	63.2	20%	0.198	32%	0.322	C	S	.	.	H	α-helix	trans	-61.1	-45.7	174.1	0	0	0	0	0	111.2	P169 T212 L213 M214 M218 T219 A220	P169-A216 HydrophobicContact CB-CB 3.97Å; T212-A216 WeakPolarHBondContact O-CB 3.31Å; T212-A216 PolarHBondContact O-N 3.39Å; L213-A216 PolarHBondContact O-N 3.27Å; M214-A216 VanDerWaalsContact C-N 3.34Å; M214-A216 PolarHBondContact O-N 3.03Å; A216-M218 PolarHBondContact O-N 2.95Å; A216-T219 PolarHBondContact O-N 3.37Å; A216-A220 WeakPolarHBondContact O-CB 3.49Å; A216-A220 PolarHBondContact O-N 3.48Å
217	A	92.8	Very high	92.4	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.4	-42.3	176.9	0	0	0	0	0	112.5	A162 L185 L187 L213 M214 A220 C221	A162-A217 HydrophobicContact CB-CB 3.67Å; L185-A217 HydrophobicContact CD2-CB 3.93Å; L187-A217 HydrophobicContact CB-CB 4.13Å; L187-A217 HydrophobicContact CD1-CB 4.23Å; L213-A217 WeakPolarHBondContact O-CB 3.2Å; L213-A217 PolarHBondContact O-N 3Å; M214-A217 PolarHBondContact O-N 3.38Å; A217-A220 WeakPolarHBondContact O-CB 3.49Å; A217-A220 PolarHBondContact O-N 3.04Å; A217-C221 PolarHBondContact O-N 3.31Å; A217-C221 PolarHBondContact O-SG 2.84Å
218	M	93.3	Very high	92.6	Very high	51 Å²	51	52.1 Å²	52.1	25%	0.251	27%	0.274	S	S	.	.	H	α-helix	trans	-65.5	-40.5	177.8	-72.3	-171.7	-74	0	0	111.7	L187 L189 M214 E215 A216 C221 K222	L187-M218 HydrophobicContact CD1-CG 4.21Å; L187-M218 HydrophobicContact CD2-CG 4.48Å; L189-M218 HydrophobicContact CD1-CB 4.35Å; L189-M218 HydrophobicContact CD1-CG 3.83Å; L189-M218 HydrophobicContact CD1-SD 4.32Å; M214-M218 HydrophobicContact CB-CE 4.47Å; M214-M218 WeakPolarHBondContact O-CB 3.11Å; M214-M218 VanDerWaalsContact O-CG 3.28Å; M214-M218 WeakPolarHBondContact O-CG 3.42Å; M214-M218 PolarHBondContact O-N 3.25Å; E215-M218 HydrophobicContact CG-CE 4.12Å; E215-M218 PolarHBondContact O-N 2.88Å; A216-M218 PolarHBondContact O-N 2.95Å; M218-C221 PolarHBondContact O-N 3.19Å; M218-K222 WeakPolarHBondContact O-CG 3.36Å; M218-K222 PolarHBondContact O-N 2.8Å
219	T	93.3	Very high	92.8	Very high	95 Å²	95	48.6 Å²	48.6	58%	0.583	26%	0.255	S	S	*	.	H	α-helix	trans	-66.2	-42.2	177.1	-55.6	0	0	0	0	111	E215 A216 K222 G223	E215-T219 WeakPolarHBondContact O-CB 3.38Å; E215-T219 PolarHBondContact O-N 3.44Å; E215-T219 PolarHBondContact O-OG1 2.97Å; A216-T219 PolarHBondContact O-N 3.37Å; T219-K222 PolarHBondContact O-N 2.85Å; T219-G223 PolarHBondContact O-N 3.27Å
220	A	93	Very high	93	Very high	7 Å²	7	51.7 Å²	51.7	6%	0.058	27%	0.269	C	S	.	.	H	α-helix	trans	-57.4	-48.2	172	0	0	0	0	0	112.1	L22 C160 A171 A216 A217 K222 G223 V224	L22-A220 HydrophobicContact CD2-CB 3.8Å; C160-A220 HydrophobicContact CB-CB 3.83Å; A171-A220 HydrophobicContact CB-CB 3.96Å; A216-A220 WeakPolarHBondContact O-CB 3.49Å; A216-A220 PolarHBondContact O-N 3.48Å; A217-A220 WeakPolarHBondContact O-CB 3.49Å; A217-A220 PolarHBondContact O-N 3.04Å; A220-K222 VanDerWaalsContact C-N 3.31Å; A220-K222 PolarHBondContact O-N 2.91Å; A220-G223 WeakPolarHBondContact O-CA 3.38Å; A220-G223 PolarHBondContact O-N 2.97Å; A220-V224 PolarHBondContact O-N 3.4Å
221	C	93.2	Very high	93.2	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60	-40.4	177.9	-68.4	0	0	0	0	112.2	C160 L189 A217 M218 G223 V224 S225	C160-C221 PolarHBondContact N-SG 2.82Å; C160-C221 VanDerWaalsContact N-SG 3.42Å; L189-C221 HydrophobicContact CB-CB 4.02Å; L189-C221 HydrophobicContact CD2-CB 4.22Å; A217-C221 PolarHBondContact O-N 3.31Å; A217-C221 PolarHBondContact O-SG 2.84Å; M218-C221 PolarHBondContact O-N 3.19Å; C221-G223 VanDerWaalsContact C-N 3.32Å; C221-G223 PolarHBondContact O-N 3.01Å; C221-V224 PolarHBondContact O-N 3.42Å; C221-S225 WeakPolarHBondContact O-CB 2.78Å; C221-S225 PolarHBondContact O-N 2.87Å
222	K	93.1	Very high	93.3	Very high	111 Å²	111	43.6 Å²	43.6	48%	0.483	23%	0.232	S	C	.	.	H	α-helix	trans	-64.6	-36.3	174.5	-71.5	173.5	-178	175.7	0	112	M218 T219 A220 S225 K226	M218-K222 WeakPolarHBondContact O-CG 3.36Å; M218-K222 PolarHBondContact O-N 2.8Å; T219-K222 PolarHBondContact O-N 2.85Å; A220-K222 VanDerWaalsContact C-N 3.31Å; A220-K222 PolarHBondContact O-N 2.91Å; K222-S225 PolarHBondContact O-N 2.92Å; K222-K226 PolarHBondContact O-N 3.02Å
223	G	93	Very high	93.5	Very high	25 Å²	25	47.8 Å²	47.8	26%	0.258	24%	0.241	S	C	.	.	H	α-helix	trans	-61	-50	172.6	0	0	0	0	0	111.9	T219 A220 C221 S225 K226 V227	T219-G223 PolarHBondContact O-N 3.27Å; A220-G223 WeakPolarHBondContact O-CA 3.38Å; A220-G223 PolarHBondContact O-N 2.97Å; C221-G223 VanDerWaalsContact C-N 3.32Å; C221-G223 PolarHBondContact O-N 3.01Å; G223-S225 VanDerWaalsContact C-N 3.33Å; G223-S225 PolarHBondContact O-N 3.35Å; G223-K226 PolarHBondContact O-N 2.86Å; G223-V227 PolarHBondContact O-N 3.25Å
224	V	93.8	Very high	93.7	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-61.5	-40.8	176.8	172.9	0	0	0	0	111.8	L22 C160 A220 C221 K226 V227 L228	L22-V224 HydrophobicContact CD1-CG2 3.74Å; C160-V224 WeakPolarHBondContact SG-CG2 3.48Å; A220-V224 PolarHBondContact O-N 3.4Å; C221-V224 PolarHBondContact O-N 3.42Å; V224-K226 VanDerWaalsContact C-N 3.26Å; V224-K226 PolarHBondContact O-N 3.49Å; V224-V227 PolarHBondContact O-N 2.9Å; V224-V227 VanDerWaalsContact O-N 3.1Å; V224-L228 HydrophobicContact CG1-CD1 3.84Å; V224-L228 HydrophobicContact CG1-CG 3.98Å; V224-L228 WeakPolarHBondContact O-CG 3.42Å; V224-L228 PolarHBondContact O-N 3.2Å
225	S	93.8	Very high	93.7	Very high	17 Å²	17	52.7 Å²	52.7	12%	0.119	26%	0.263	C	S	.	.	H	α-helix	trans	-56.3	-39.7	178.2	176.8	0	0	0	0	113	C158 P191 C221 K222 G223 L228 D229	C158-S225 VanDerWaalsContact SG-CA 3.51Å; C158-S225 WeakPolarHBondContact SG-CB 3.37Å; P191-S225 WeakPolarHBondContact CG-OG 3.13Å; C221-S225 WeakPolarHBondContact O-CB 2.78Å; C221-S225 PolarHBondContact O-N 2.87Å; K222-S225 PolarHBondContact O-N 2.92Å; G223-S225 VanDerWaalsContact C-N 3.33Å; G223-S225 PolarHBondContact O-N 3.35Å; S225-L228 PolarHBondContact O-N 2.91Å; S225-D229 WeakPolarHBondContact O-CB 3.47Å; S225-D229 PolarHBondContact O-N 2.76Å
226	K	94	Very high	93.7	Very high	146 Å²	146	52.9 Å²	52.9	64%	0.635	27%	0.267	S	S	*	.	H	α-helix	trans	-64.5	-44.5	176.8	-68.1	177.4	-178.6	-178	0	111.5	K222 G223 V224 D229 E230	K222-K226 PolarHBondContact O-N 3.02Å; G223-K226 PolarHBondContact O-N 2.86Å; V224-K226 VanDerWaalsContact C-N 3.26Å; V224-K226 PolarHBondContact O-N 3.49Å; K226-D229 PolarHBondContact O-N 3.19Å; K226-E230 WeakPolarHBondContact O-CG 3.37Å; K226-E230 PolarHBondContact O-N 3.36Å
227	V	94	Very high	93.8	Very high	46 Å²	46	58.2 Å²	58.2	28%	0.279	29%	0.288	S	S	.	.	H	α-helix	trans	-63.2	-43.4	178.2	-179.4	0	0	0	0	111	V25 G223 V224 E230 V231	V25-V227 HydrophobicContact CB-CG1 4.16Å; V25-V227 HydrophobicContact CG1-CG1 4.42Å; G223-V227 PolarHBondContact O-N 3.25Å; V224-V227 PolarHBondContact O-N 2.9Å; V224-V227 VanDerWaalsContact O-N 3.1Å; V227-E230 PolarHBondContact O-N 3.04Å; V227-V231 WeakPolarHBondContact O-CG2 3.2Å; V227-V231 PolarHBondContact O-N 2.97Å
228	L	94	Very high	93.7	Very high	1 Å²	1	64.2 Å²	64.2	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-64	-42.9	176.7	-65	179.1	0	0	0	111.6	I41 N140 L144 V224 S225 E230 V231 V232	I41-L228 HydrophobicContact CD1-CD2 4.19Å; N140-L228 HydrophobicContact CB-CD1 4.22Å; L144-L228 HydrophobicContact CD1-CD2 3.81Å; L144-L228 HydrophobicContact CD2-CB 4.5Å; L144-L228 HydrophobicContact CD2-CD2 4.09Å; L144-L228 HydrophobicContact CG-CD2 4.03Å; V224-L228 HydrophobicContact CG1-CD1 3.84Å; V224-L228 HydrophobicContact CG1-CG 3.98Å; V224-L228 WeakPolarHBondContact O-CG 3.42Å; V224-L228 PolarHBondContact O-N 3.2Å; S225-L228 PolarHBondContact O-N 2.91Å; L228-E230 VanDerWaalsContact C-N 3.34Å; L228-E230 PolarHBondContact O-N 2.94Å; L228-V231 PolarHBondContact O-N 2.88Å; L228-V232 VanDerWaalsContact O-CG2 3.26Å; L228-V232 WeakPolarHBondContact O-CG2 3.26Å; L228-V232 PolarHBondContact O-N 2.7Å
229	D	94.8	Very high	93.5	Very high	39 Å²	39	64.8 Å²	64.8	21%	0.209	32%	0.322	C	S	.	.	H	α-helix	trans	-63.2	-39.5	177.5	-168.9	51.3	0	0	0	111.8	Y156 S225 K226 V232 R233	Y156-D229 HydrophobicContact CE2-CB 4.35Å; Y156-D229 PolarHBondContact OH-OD1 2.92Å; S225-D229 WeakPolarHBondContact O-CB 3.47Å; S225-D229 PolarHBondContact O-N 2.76Å; K226-D229 PolarHBondContact O-N 3.19Å; D229-V232 PolarHBondContact O-N 2.93Å; D229-R233 WeakPolarHBondContact O-CB 3.45Å; D229-R233 WeakPolarHBondContact O-CG 3.4Å; D229-R233 PolarHBondContact O-N 2.78Å; D229-R233 IonicContact OD1-NE 3.5Å; D229-R233 IonicContact OD2-CZ 3.9Å; D229-R233 IonicContact OD2-NE 3.36Å; D229-R233 PolarHBondContact OD2-NE 3.28Å; D229-R233 IonicContact OD2-NH2 3.95Å; D229-R233 PolarHBondContact OD2-NH2 3.05Å
230	E	95.1	Very high	93.3	Very high	116 Å²	116	62.9 Å²	62.9	54%	0.542	31%	0.313	S	S	.	.	H	α-helix	trans	-61.1	-46	173.6	-75.1	172.4	-169.4	0	0	111.9	K226 V227 L228 R233 Q234	K226-E230 WeakPolarHBondContact O-CG 3.37Å; K226-E230 PolarHBondContact O-N 3.36Å; V227-E230 PolarHBondContact O-N 3.04Å; L228-E230 VanDerWaalsContact C-N 3.34Å; L228-E230 PolarHBondContact O-N 2.94Å; E230-R233 PolarHBondContact O-N 2.82Å; E230-Q234 VanDerWaalsContact O-CG 3.31Å; E230-Q234 WeakPolarHBondContact O-CG 3.47Å; E230-Q234 PolarHBondContact O-N 3.19Å
231	V	94.9	Very high	93.2	Very high	23 Å²	23	66.4 Å²	66.4	14%	0.139	34%	0.341	C	S	.	.	H	α-helix	trans	-63.4	-45.4	178	171.2	0	0	0	0	111.4	A27 V227 L228 R233 Q234 H235	A27-V231 HydrophobicContact CB-CG1 3.99Å; A27-V231 HydrophobicContact CB-CG2 4.4Å; V227-V231 WeakPolarHBondContact O-CG2 3.2Å; V227-V231 PolarHBondContact O-N 2.97Å; L228-V231 PolarHBondContact O-N 2.88Å; V231-R233 VanDerWaalsContact C-N 3.35Å; V231-R233 PolarHBondContact O-N 3.25Å; V231-Q234 PolarHBondContact O-N 3.42Å; V231-H235 WeakPolarHBondContact O-CB 3.4Å; V231-H235 PolarHBondContact O-N 3.48Å
232	V	95.2	Very high	92.9	Very high	4 Å²	4	73.7 Å²	73.7	2%	0.024	38%	0.38	C	S	.	.	H	α-helix	trans	-61.4	-45.1	178.9	172.4	0	0	0	0	110.5	M29 L144 V147 Y156 L228 D229 Q234 H235 L236	M29-V232 HydrophobicContact CE-CG2 4.31Å; M29-V232 HydrophobicContact SD-CB 4.32Å; M29-V232 HydrophobicContact SD-CG2 3.71Å; L144-V232 HydrophobicContact CD2-CG2 3.57Å; V147-V232 HydrophobicContact CG1-CG1 4.04Å; V147-V232 HydrophobicContact CG1-CG2 4.41Å; Y156-V232 HydrophobicContact CE1-CG2 4.4Å; L228-V232 VanDerWaalsContact O-CG2 3.26Å; L228-V232 WeakPolarHBondContact O-CG2 3.26Å; L228-V232 PolarHBondContact O-N 2.7Å; D229-V232 PolarHBondContact O-N 2.93Å; V232-Q234 PolarHBondContact O-N 2.97Å; V232-H235 PolarHBondContact O-N 2.94Å; V232-L236 HydrophobicContact CG1-CD1 3.9Å; V232-L236 HydrophobicContact CG1-CG 4.35Å; V232-L236 WeakPolarHBondContact O-CB 3.25Å; V232-L236 VanDerWaalsContact O-CG 3.3Å; V232-L236 WeakPolarHBondContact O-CG 3.32Å; V232-L236 PolarHBondContact O-N 3.15Å
233	R	95.2	Very high	92.4	Very high	149 Å²	149	73.4 Å²	73.4	56%	0.562	39%	0.387	S	S	*	.	H	α-helix	trans	-62.9	-42.6	178.4	-73.1	174	-170.6	-138.7	10	112.7	D229 E230 V231 L236 Q237	D229-R233 WeakPolarHBondContact O-CB 3.45Å; D229-R233 WeakPolarHBondContact O-CG 3.4Å; D229-R233 PolarHBondContact O-N 2.78Å; D229-R233 IonicContact OD1-NE 3.5Å; D229-R233 IonicContact OD2-CZ 3.9Å; D229-R233 IonicContact OD2-NE 3.36Å; D229-R233 PolarHBondContact OD2-NE 3.28Å; D229-R233 IonicContact OD2-NH2 3.95Å; D229-R233 PolarHBondContact OD2-NH2 3.05Å; E230-R233 PolarHBondContact O-N 2.82Å; V231-R233 VanDerWaalsContact C-N 3.35Å; V231-R233 PolarHBondContact O-N 3.25Å; R233-L236 PolarHBondContact O-N 3.44Å; R233-Q237 VanDerWaalsContact O-CG 3.31Å; R233-Q237 WeakPolarHBondContact O-CG 3.31Å; R233-Q237 PolarHBondContact O-N 3.11Å
234	Q	94.5	Very high	91.1	Very high	112 Å²	112	75.5 Å²	75.5	52%	0.523	41%	0.409	S	S	.	.	H	α-helix	trans	-61.3	-46.9	176.1	-74.7	174.1	1.7	0	0	110.8	E230 V231 V232 L236 Q237 E238	E230-Q234 VanDerWaalsContact O-CG 3.31Å; E230-Q234 WeakPolarHBondContact O-CG 3.47Å; E230-Q234 PolarHBondContact O-N 3.19Å; V231-Q234 PolarHBondContact O-N 3.42Å; V232-Q234 PolarHBondContact O-N 2.97Å; Q234-L236 PolarHBondContact O-N 2.67Å; Q234-Q237 WeakPolarHBondContact O-CB 3.32Å; Q234-Q237 PolarHBondContact O-N 3.25Å; Q234-E238 WeakPolarHBondContact O-CG 3.25Å; Q234-E238 PolarHBondContact O-N 3.03Å
235	H	93.3	Very high	89	Confident	38 Å²	38	86.3 Å²	86.3	18%	0.176	46%	0.459	C	S	.	.	H	α-helix	trans	-60.2	-44.5	178	-175.5	59.2	0	0	0	112.2	M29 D148 V231 V232 Q237 E238 V239	M29-H235 HydrophobicContact SD-CB 4.25Å; D148-H235 IonicContact OD1-NE2 3.88Å; V231-H235 WeakPolarHBondContact O-CB 3.4Å; V231-H235 PolarHBondContact O-N 3.48Å; V232-H235 PolarHBondContact O-N 2.94Å; H235-Q237 VanDerWaalsContact C-N 3.32Å; H235-Q237 PolarHBondContact O-N 3.2Å; H235-E238 PolarHBondContact O-N 3.13Å; H235-V239 WeakPolarHBondContact O-CG2 3.41Å; H235-V239 PolarHBondContact O-N 3.39Å
236	L	91.9	Very high	88.8	Confident	106 Å²	106	89.8 Å²	89.8	56%	0.555	48%	0.477	S	S	*	.	H	α-helix	trans	-63.6	-36.4	177	-71.2	173.1	0	0	0	112.7	V232 R233 Q234 S240	V232-L236 HydrophobicContact CG1-CD1 3.9Å; V232-L236 HydrophobicContact CG1-CG 4.35Å; V232-L236 WeakPolarHBondContact O-CB 3.25Å; V232-L236 VanDerWaalsContact O-CG 3.3Å; V232-L236 WeakPolarHBondContact O-CG 3.32Å; V232-L236 PolarHBondContact O-N 3.15Å; R233-L236 PolarHBondContact O-N 3.44Å; Q234-L236 PolarHBondContact O-N 2.67Å; L236-S240 VanDerWaalsContact O-CB 3.25Å; L236-S240 WeakPolarHBondContact O-CB 3.21Å; L236-S240 PolarHBondContact O-N 2.79Å
237	Q	93.4	Very high	88.5	Confident	137 Å²	137	86.8 Å²	86.8	64%	0.64	47%	0.468	S	S	*	.	H	α-helix	trans	-65.3	-42.7	174.8	-74.9	173.7	-5.2	0	0	111.9	R233 Q234 H235 A241	R233-Q237 VanDerWaalsContact O-CG 3.31Å; R233-Q237 WeakPolarHBondContact O-CG 3.31Å; R233-Q237 PolarHBondContact O-N 3.11Å; Q234-Q237 WeakPolarHBondContact O-CB 3.32Å; Q234-Q237 PolarHBondContact O-N 3.25Å; H235-Q237 VanDerWaalsContact C-N 3.32Å; H235-Q237 PolarHBondContact O-N 3.2Å; Q237-A241 WeakPolarHBondContact O-CB 3.36Å; Q237-A241 PolarHBondContact O-N 2.82Å
238	E	90.8	Very high	88.2	Confident	125 Å²	125	89.1 Å²	89.1	58%	0.584	48%	0.479	S	S	*	.	H	α-helix	trans	-62.9	-45.5	176	-70.3	175.2	178.8	0	0	111.3	Q234 H235 A241 L242	Q234-E238 WeakPolarHBondContact O-CG 3.25Å; Q234-E238 PolarHBondContact O-N 3.03Å; H235-E238 PolarHBondContact O-N 3.13Å; E238-A241 PolarHBondContact O-N 3.22Å; E238-L242 VanDerWaalsContact O-CG 3.29Å; E238-L242 WeakPolarHBondContact O-CG 3.34Å; E238-L242 PolarHBondContact O-N 2.82Å
239	V	88.9	Confident	87.9	Confident	63 Å²	63	94.2 Å²	94.2	38%	0.382	51%	0.507	S	S	.	.	H	α-helix	trans	-65.1	-49.3	178.5	174.9	0	0	0	0	110.7	H235 A241 L242 T243	H235-V239 WeakPolarHBondContact O-CG2 3.41Å; H235-V239 PolarHBondContact O-N 3.39Å; V239-A241 VanDerWaalsContact C-N 3.32Å; V239-A241 PolarHBondContact O-N 3.34Å; V239-L242 WeakPolarHBondContact O-CB 3.34Å; V239-L242 PolarHBondContact O-N 3.13Å; V239-T243 PolarHBondContact O-N 3.31Å; V239-T243 PolarHBondContact O-OG1 3.14Å
240	S	90.3	Very high	87.5	Confident	56 Å²	56	97.7 Å²	97.7	39%	0.392	53%	0.525	S	S	.	.	H	α-helix	trans	-55.1	-46.5	177.3	158.4	0	0	0	0	111.6	L236 L242 T243 G244 E245	L236-S240 VanDerWaalsContact O-CB 3.25Å; L236-S240 WeakPolarHBondContact O-CB 3.21Å; L236-S240 PolarHBondContact O-N 2.79Å; S240-L242 PolarHBondContact O-N 2.87Å; S240-T243 PolarHBondContact O-N 3.47Å; S240-T243 VanDerWaalsContact O-N 3.15Å; S240-T243 PolarHBondContact O-OG1 3.11Å; S240-G244 PolarHBondContact O-N 2.73Å; S240-E245 PolarHBondContact OG-O 3.09Å
241	A	90.9	Very high	87	Confident	80 Å²	80	96.5 Å²	96.5	66%	0.661	52%	0.524	S	S	*	.	H	α-helix	trans	-59.2	-32.6	176.6	0	0	0	0	0	113.6	Q237 E238 V239	Q237-A241 WeakPolarHBondContact O-CB 3.36Å; Q237-A241 PolarHBondContact O-N 2.82Å; E238-A241 PolarHBondContact O-N 3.22Å; V239-A241 VanDerWaalsContact C-N 3.32Å; V239-A241 PolarHBondContact O-N 3.34Å
242	L	85.9	Confident	86.4	Confident	154 Å²	154	101.7 Å²	101.7	81%	0.806	55%	0.552	S	S	*	*	H	α-helix	trans	-77.5	-36.5	177.1	-69.3	167.9	0	0	0	112.7	E238 V239 S240 G244	E238-L242 VanDerWaalsContact O-CG 3.29Å; E238-L242 WeakPolarHBondContact O-CG 3.34Å; E238-L242 PolarHBondContact O-N 2.82Å; V239-L242 WeakPolarHBondContact O-CB 3.34Å; V239-L242 PolarHBondContact O-N 3.13Å; S240-L242 PolarHBondContact O-N 2.87Å; L242-G244 VanDerWaalsContact C-N 3.34Å
243	T	82.4	Confident	85.7	Confident	104 Å²	104	109.2 Å²	109.2	64%	0.638	59%	0.592	S	S	*	*	H	α-helix	trans	-77.4	-16.9	178	14.2	0	0	0	0	113.9	V239 S240 E245	V239-T243 PolarHBondContact O-N 3.31Å; V239-T243 PolarHBondContact O-OG1 3.14Å; S240-T243 PolarHBondContact O-N 3.47Å; S240-T243 VanDerWaalsContact O-N 3.15Å; S240-T243 PolarHBondContact O-OG1 3.11Å; T243-E245 VanDerWaalsContact C-N 3.32Å
244	G	67.1	Low	84.9	Confident	70 Å²	70	105.9 Å²	105.9	72%	0.722	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.9	16.4	175.2	0	0	0	0	0	115	S240 L242	S240-G244 PolarHBondContact O-N 2.73Å; L242-G244 VanDerWaalsContact C-N 3.34Å
245	E	49.8	Very low	84.1	Confident	226 Å²	226	105.4 Å²	105.4	100%	1.056	60%	0.601	S	S	*	*			trans	-105.8	0	167.7	-68.6	-169	167.3	0	0	111.2	S240 T243	S240-E245 PolarHBondContact OG-O 3.09Å; T243-E245 VanDerWaalsContact C-N 3.32Å

Retrieved 245 of 245 residues in 1726.2 ms (Link to these results)

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