A0A087YC09_POEFO Loading...

RNA ligase 1

Functions as an RNA ligase, in vitro. The ligation reaction entails three nucleotidyl transfer steps. In the first step, the RNA ligase reacts with ATP in the absence of nucleic acid to form a covalent ligase-AMP intermediate and release pyrophosphate. In step 2, the ligase-AMP binds to the nucleic acid and transfers the adenylate to the 5'-PO4 terminus to form an adenylylated intermediate. In step 3, the RNA ligase directs the attack of the 3'-OH on the 5'-phosphoanhydride linkage, resulting in a repaired 3'-5' phosphodiester and release of AMP. Exhibits selectivity for single-stranded RNA substrates and may not have nick-sealing activity on double-stranded DNA-RNA hybrids. May play a role in maintaining RNA integrity under stress conditions, for example in response to reactive oxygen species (ROS).

AlphaFold DB , UniProt , Accession A0A087YC09, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 322 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	40.7	Very low	74.9	Confident	207 Å²	207	84.1 Å²	84.1	100%	1.02	38%	0.383	S	S	*	.				0	138.2	0	-76.6	170.4	-169.3	0	0	109.2	R3	M1-R3 PolarHBondContact O-N 3.35Å
2	R	46.3	Very low	76.6	Confident	222 Å²	222	80.1 Å²	80.1	84%	0.838	37%	0.37	S	S	*	.			trans	-61.6	123	169.1	-151.3	174.5	-171	-176.3	0.8	106.6	L4	R2-L4 PolarHBondContact O-N 2.78Å
3	R	67.3	Low	78.1	Confident	165 Å²	165	74.6 Å²	74.6	62%	0.623	35%	0.347	S	S	*	.			trans	-68.1	103	-179.8	-67.6	-178.7	-179	-164.4	-3.5	107.8	M1 Q190	M1-R3 PolarHBondContact O-N 3.35Å; R3-Q190 PolarHBondContact NH1-O 2.69Å
4	L	70.5	Confident	79.5	Confident	60 Å²	60	69.3 Å²	69.3	31%	0.314	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-75.2	159.5	178.5	-68.3	168.2	0	0	0	110.2	R2 F53 G222 H255	R2-L4 PolarHBondContact O-N 2.78Å; L4-F53 HydrophobicContact CD1-CD1 3.32Å; L4-F53 HydrophobicContact CD1-CE1 3.37Å; L4-F53 HydrophobicContact CD1-CG 4.36Å; L4-F53 HydrophobicContact CD1-CZ 4.45Å; L4-F53 HydrophobicContact CD2-CD1 4.36Å; L4-F53 HydrophobicContact CG-CD1 4.47Å; L4-G222 WeakPolarHBondContact CD1-O 3.42Å; L4-H255 HydrophobicContact CB-CB 4.48Å; L4-H255 HydrophobicContact CD2-CB 4.07Å
5	G	67.6	Low	80.8	Confident	15 Å²	15	64.7 Å²	64.7	16%	0.155	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-51.7	139	-156.9	0	0	0	0	0	115.2	H255	G5-H255 PolarHBondContact N-ND1 2.88Å; G5-H255 VanDerWaalsContact N-ND1 3.2Å
6	S	83.8	Confident	81.7	Confident	29 Å²	29	65.3 Å²	65.3	20%	0.203	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-84.1	131.6	179.8	-173	0	0	0	0	111.3	Q8 T193	S6-Q8 VanDerWaalsContact C-N 3.28Å; S6-Q8 PolarHBondContact O-N 2.78Å; S6-Q8 PolarHBondContact OG-NE2 3.25Å; S6-T193 WeakPolarHBondContact CA-OG1 3.43Å; S6-T193 VanDerWaalsContact OG-CG2 3.24Å; S6-T193 WeakPolarHBondContact OG-CG2 3.45Å
7	V	89	Confident	82.4	Confident	17 Å²	17	65.5 Å²	65.5	10%	0.103	31%	0.313	C	S	.	.			trans	-76.7	76.9	179.9	-172.9	0	0	0	0	110.8	I11 R77 W142 T193 H221 L261	V7-I11 HydrophobicContact CG1-CD1 4.04Å; V7-I11 HydrophobicContact CG1-CG1 4.23Å; V7-I11 HydrophobicContact CG2-CD1 3.99Å; V7-R77 PolarHBondContact O-NH1 3.03Å; V7-W142 WeakPolarHBondContact O-CZ2 3.41Å; V7-T193 HydrophobicContact CB-CG2 4.35Å; V7-T193 PolarHBondContact N-OG1 3.12Å; V7-H221 HydrophobicContact CG2-CB 4.41Å; V7-H221 WeakPolarHBondContact CG2-CD2 3.17Å; V7-H221 WeakPolarHBondContact CG2-NE2 3.32Å; V7-L261 HydrophobicContact CG2-CD1 3.93Å
8	Q	87.6	Confident	82.8	Confident	8 Å²	8	67 Å²	67	4%	0.037	32%	0.323	C	S	.	.			trans	-98.7	-10.3	-178.3	-62	-66.4	-26.6	0	0	112.9	S6 A121 H122 R123	S6-Q8 VanDerWaalsContact C-N 3.28Å; S6-Q8 PolarHBondContact O-N 2.78Å; S6-Q8 PolarHBondContact OG-NE2 3.25Å; Q8-A121 HydrophobicContact CB-CB 4.4Å; Q8-A121 WeakPolarHBondContact O-CB 3.1Å; Q8-H122 HydrophobicContact CG-CB 4.25Å; Q8-R123 HydrophobicContact CB-CB 3.82Å; Q8-R123 HydrophobicContact CB-CG 3.87Å; Q8-R123 HydrophobicContact CG-CG 4.41Å
9	Q	89	Confident	83.1	Confident	82 Å²	82	67.5 Å²	67.5	38%	0.383	33%	0.33	S	S	.	.	S	Bend	trans	-139.3	170.4	179.5	-74.9	175.1	-24.1	0	0	110.1	I11 R123	Q9-I11 PolarHBondContact O-N 2.89Å; Q9-R123 HydrophobicContact CG-CB 3.84Å; Q9-R123 PolarHBondContact NE2-O 3.38Å
10	K	89	Confident	83.3	Confident	101 Å²	101	69.2 Å²	69.2	44%	0.439	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-64.6	121.8	169	-165.7	-177.8	-174.7	-177.4	0	109.1	P12 H136	K10-P12 WeakPolarHBondContact O-CD 3.43Å; K10-H136 WeakPolarHBondContact CD-CD2 3.37Å; K10-H136 PolarHBondContact NZ-CD2 3.47Å; K10-H136 PolarHBondContact NZ-CE1 3.21Å; K10-H136 PolarHBondContact NZ-NE2 3.11Å
11	I	93.6	Very high	83.4	Confident	19 Å²	19	73.5 Å²	73.5	10%	0.097	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-75.4	121.6	179	-54.4	175.2	0	0	0	109	V7 Q9 V253 L261 K263	V7-I11 HydrophobicContact CG1-CD1 4.04Å; V7-I11 HydrophobicContact CG1-CG1 4.23Å; V7-I11 HydrophobicContact CG2-CD1 3.99Å; Q9-I11 PolarHBondContact O-N 2.89Å; I11-V253 HydrophobicContact CD1-CG1 4.35Å; I11-L261 HydrophobicContact CD1-CB 4.19Å; I11-L261 HydrophobicContact CD1-CD1 3.93Å; I11-L261 HydrophobicContact CG1-CB 4.05Å; I11-L261 HydrophobicContact CG1-CD1 4.21Å; I11-L261 HydrophobicContact CG2-CB 3.87Å; I11-L261 WeakPolarHBondContact CG2-O 3.2Å; I11-K263 HydrophobicContact CB-CD 3.98Å; I11-K263 HydrophobicContact CB-CG 4.25Å; I11-K263 HydrophobicContact CG2-CB 3.77Å; I11-K263 HydrophobicContact CG2-CD 4.05Å; I11-K263 HydrophobicContact CG2-CG 3.79Å; I11-K263 WeakPolarHBondContact O-CE 3.44Å; I11-K263 PolarHBondContact O-NZ 2.78Å
12	P	94.3	Very high	85.6	Confident	36 Å²	36	67.4 Å²	67.4	23%	0.234	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-68.1	155.1	178.3	29.8	-37.5	0	0	0	112.1	K10 V43 L261 I262 K263	K10-P12 WeakPolarHBondContact O-CD 3.43Å; P12-V43 HydrophobicContact CG-CG1 4.39Å; P12-L261 WeakPolarHBondContact CD-O 3.41Å; P12-I262 HydrophobicContact CG-CD1 3.76Å; P12-K263 PolarHBondContact O-N 2.83Å
13	C	96.9	Very high	87.3	Confident	9 Å²	9	60 Å²	60	6%	0.061	31%	0.311	C	S	.	.	B	Isolated β-bridge	trans	-73.1	142.7	172.1	-174.1	0	0	0	0	110.4	F15 T17 N41 K263 H268	C13-F15 CarbonylContact C-O 3.55Å; C13-F15 VanDerWaalsContact CB-O 3.23Å; C13-F15 WeakPolarHBondContact CB-O 3.3Å; C13-F15 PolarHBondContact O-N 2.95Å; C13-F15 PolarHBondContact SG-O 3.17Å; C13-T17 HydrophobicContact CB-CG2 3.58Å; C13-N41 VanDerWaalsContact O-CB 3.31Å; C13-N41 WeakPolarHBondContact O-CB 3.49Å; C13-N41 PolarHBondContact O-ND2 3.37Å; C13-K263 CarbonylContact C-O 3.59Å; C13-K263 WeakPolarHBondContact CA-O 3.43Å; C13-H268 PolarHBondContact SG-ND1 2.91Å
14	V	98	Very high	88	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.287	C	S	.	.	S	Bend	trans	-61.8	-28.4	176.6	73.4	0	0	0	0	112	V40 N41 A44 V49 V232 W254 I262 K263 I264	V14-V40 WeakPolarHBondContact O-CG1 3.45Å; V14-N41 WeakPolarHBondContact O-CB 3.39Å; V14-N41 PolarHBondContact O-N 3.42Å; V14-A44 HydrophobicContact CG2-CB 4.11Å; V14-V49 HydrophobicContact CG2-CG2 4.3Å; V14-V232 HydrophobicContact CG2-CB 4.45Å; V14-V232 HydrophobicContact CG2-CG1 3.34Å; V14-V232 HydrophobicContact CG2-CG2 4.22Å; V14-W254 HydrophobicContact CB-CE3 4.45Å; V14-W254 HydrophobicContact CB-CZ3 3.94Å; V14-W254 HydrophobicContact CG1-CH2 4.28Å; V14-W254 HydrophobicContact CG1-CZ3 4.01Å; V14-W254 HydrophobicContact CG2-CZ3 4.23Å; V14-I262 VanDerWaalsContact CA-CG2 3.44Å; V14-I262 HydrophobicContact CB-CG2 3.52Å; V14-I262 HydrophobicContact CG2-CG2 3.74Å; V14-K263 PolarHBondContact N-O 3.42Å; V14-I264 HydrophobicContact CG1-CB 3.87Å; V14-I264 HydrophobicContact CG1-CD1 4.21Å; V14-I264 HydrophobicContact CG1-CG1 4.34Å
15	F	98	Very high	88.4	Confident	1 Å²	1	57.1 Å²	57.1	0%	0.004	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	153.1	169.6	-57.1	-67.9	0	0	0	110.6	C13 T17 A36 T37 N39 V40 V232 F234 L237 I264 L269	C13-F15 CarbonylContact C-O 3.55Å; C13-F15 VanDerWaalsContact CB-O 3.23Å; C13-F15 WeakPolarHBondContact CB-O 3.3Å; C13-F15 PolarHBondContact O-N 2.95Å; C13-F15 PolarHBondContact SG-O 3.17Å; F15-T17 PolarHBondContact O-N 3.27Å; F15-A36 HydrophobicContact CB-CB 3.82Å; F15-A36 HydrophobicContact CD2-CB 4.07Å; F15-A36 HydrophobicContact CG-CB 4.34Å; F15-T37 VanDerWaalsContact CB-O 3.25Å; F15-T37 WeakPolarHBondContact CB-O 3.35Å; F15-T37 WeakPolarHBondContact CG-O 3.46Å; F15-N39 CarbonylContact C-O 3.58Å; F15-N39 VanDerWaalsContact CA-O 3.25Å; F15-N39 WeakPolarHBondContact CA-O 3.39Å; F15-N39 WeakPolarHBondContact CB-O 3.48Å; F15-V40 HydrophobicContact CD1-CG2 4.23Å; F15-V40 HydrophobicContact CE1-CG2 4.05Å; F15-V232 HydrophobicContact CE1-CG1 4.48Å; F15-V232 HydrophobicContact CZ-CG1 4.5Å; F15-F234 HydrophobicContact CD1-CD2 4.47Å; F15-F234 AromaticContact CD2-CD2 3.97Å; F15-F234 HydrophobicContact CD2-CD2 3.97Å; F15-F234 HydrophobicContact CE1-CB 4.02Å; F15-F234 HydrophobicContact CE2-CB 4.38Å; F15-F234 HydrophobicContact CE2-CD2 4.03Å; F15-F234 HydrophobicContact CG-CD2 4.23Å; F15-F234 VanDerWaalsContact CZ-CA 3.45Å; F15-F234 HydrophobicContact CZ-CB 3.9Å; F15-F234 HydrophobicContact CZ-CD2 4.33Å; F15-L237 HydrophobicContact CE2-CD1 3.76Å; F15-L237 HydrophobicContact CZ-CD1 3.76Å; F15-I264 HydrophobicContact CD2-CD1 3.93Å; F15-I264 HydrophobicContact CE2-CD1 4.36Å; F15-L269 HydrophobicContact CE2-CD2 4.5Å
16	L	95.7	Very high	88.8	Confident	73 Å²	73	61.4 Å²	61.4	38%	0.382	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	138.8	166.6	-66.9	176.4	0	0	0	109.4	T37 N39 N41	L16-T37 PolarHBondContact O-N 2.98Å; L16-T37 PolarHBondContact O-OG1 3.04Å; L16-N39 HydrophobicContact CD1-CB 4.06Å; L16-N39 PolarHBondContact N-O 3.16Å; L16-N41 HydrophobicContact CD2-CB 4.4Å
17	T	93.4	Very high	88.5	Confident	70 Å²	70	64.6 Å²	64.6	43%	0.429	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	146.5	179.5	55.7	0	0	0	0	111.5	C13 F15 V34 V35	C13-T17 HydrophobicContact CB-CG2 3.58Å; F15-T17 PolarHBondContact O-N 3.27Å; T17-V34 HydrophobicContact CG2-CG1 4.19Å; T17-V35 CarbonylContact C-O 3.42Å; T17-V35 WeakPolarHBondContact CA-O 3.18Å
18	D	90.1	Very high	87.7	Confident	92 Å²	92	72.6 Å²	72.6	49%	0.492	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	156.7	174.7	-161.6	11	0	0	0	110.8	V34 V35 T37	D18-V34 CarbonylContact O-C 3.45Å; D18-V34 WeakPolarHBondContact O-CA 3.32Å; D18-V35 PolarHBondContact N-O 2.97Å; D18-V35 PolarHBondContact O-N 2.82Å; D18-T37 HydrophobicContact CB-CG2 4.12Å
19	V	87.8	Confident	87.4	Confident	76 Å²	76	80.3 Å²	80.3	46%	0.461	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	116.7	175.8	-176.7	0	0	0	0	108.4	F32 Q33 V34	V19-F32 HydrophobicContact CG1-CB 4.08Å; V19-F32 HydrophobicContact CG1-CD2 3.9Å; V19-F32 HydrophobicContact CG1-CG 4.33Å; V19-Q33 WeakPolarHBondContact CA-O 2.98Å; V19-V34 HydrophobicContact CG2-CG2 4.38Å
20	K	86.7	Confident	87.1	Confident	102 Å²	102	78.8 Å²	78.8	44%	0.443	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	130.7	173.7	-68.3	-174	175.4	178.1	0	110.1	E22 F32 Q33 V35	K20-E22 HydrophobicContact CB-CG 3.94Å; K20-E22 WeakPolarHBondContact CB-OE1 3.5Å; K20-E22 WeakPolarHBondContact CD-OE1 3.24Å; K20-E22 PolarHBondContact O-N 2.85Å; K20-F32 CarbonylContact O-C 3.43Å; K20-F32 WeakPolarHBondContact O-CA 3.44Å; K20-F32 WeakPolarHBondContact O-CB 3.22Å; K20-Q33 HydrophobicContact CB-CG 4.33Å; K20-Q33 PolarHBondContact N-O 2.99Å; K20-Q33 PolarHBondContact O-N 2.84Å; K20-V35 HydrophobicContact CD-CG2 3.67Å; K20-V35 HydrophobicContact CG-CG2 3.82Å
21	E	86.1	Confident	87	Confident	160 Å²	160	80.3 Å²	80.3	75%	0.748	40%	0.398	S	S	*	.	S	Bend	trans	-76.9	62.8	174.4	-62.3	-63.1	158.2	0	0	110.6	Q31	E21-Q31 CarbonylContact C-O 3.53Å
22	E	86.1	Confident	86.6	Confident	79 Å²	79	83.2 Å²	83.2	37%	0.369	41%	0.41	S	S	.	.	S	Bend	trans	-137.6	157	175.1	66.6	-171.8	154.3	0	0	110.3	K20 S24 Q31 F32 Q33	K20-E22 HydrophobicContact CB-CG 3.94Å; K20-E22 WeakPolarHBondContact CB-OE1 3.5Å; K20-E22 WeakPolarHBondContact CD-OE1 3.24Å; K20-E22 PolarHBondContact O-N 2.85Å; E22-S24 PolarHBondContact O-N 3.05Å; E22-Q31 CarbonylContact C-O 3.58Å; E22-Q31 PolarHBondContact N-O 3.44Å; E22-Q31 CarbonylContact O-C 3.58Å; E22-Q31 VanDerWaalsContact O-C 3.25Å; E22-F32 CarbonylContact O-C 3.25Å; E22-F32 WeakPolarHBondContact O-CA 3.43Å; E22-F32 PolarHBondContact O-N 3.45Å; E22-Q33 HydrophobicContact CG-CG 3.66Å; E22-Q33 PolarHBondContact O-N 3.18Å; E22-Q33 PolarHBondContact OE1-NE2 2.69Å
23	A	82.3	Confident	86.2	Confident	66 Å²	66	82.1 Å²	82.1	55%	0.545	40%	0.401	S	S	.	.			trans	-56.6	129.2	-176.5	0	0	0	0	0	111.8	R25 Q30	A23-R25 PolarHBondContact O-N 3.08Å; A23-Q30 WeakPolarHBondContact CA-O 3.37Å
24	S	82.8	Confident	85.9	Confident	18 Å²	18	84.5 Å²	84.5	13%	0.126	42%	0.416	C	S	.	.			trans	-66.2	129.1	-179.1	179.8	0	0	0	0	111.6	E22 K26 H27 Q30	E22-S24 PolarHBondContact O-N 3.05Å; S24-K26 PolarHBondContact O-N 2.85Å; S24-K26 PolarHBondContact OG-N 2.78Å; S24-K26 VanDerWaalsContact OG-N 3.14Å; S24-H27 PolarHBondContact OG-N 2.82Å; S24-Q30 PolarHBondContact N-O 3.22Å
25	R	79.6	Confident	85.6	Confident	147 Å²	147	85 Å²	85	56%	0.555	42%	0.419	S	S	*	.	S	Bend	trans	-72	-11.3	171.1	-61.3	179.6	-177.8	-168.4	0.3	113.1	A23 G270	A23-R25 PolarHBondContact O-N 3.08Å; R25-G270 WeakPolarHBondContact CD-O 3.41Å; R25-G270 PolarHBondContact NH1-O 3.38Å
26	K	75.5	Confident	85.5	Confident	104 Å²	104	85.4 Å²	85.4	45%	0.452	42%	0.422	S	S	.	.	S	Bend	trans	-98	-30.9	179.5	-172.9	179.3	-178.8	165.4	0	112.9	S24	S24-K26 PolarHBondContact O-N 2.85Å; S24-K26 PolarHBondContact OG-N 2.78Å; S24-K26 VanDerWaalsContact OG-N 3.14Å
27	H	76.9	Confident	85.5	Confident	96 Å²	96	83.7 Å²	83.7	44%	0.444	42%	0.415	S	S	.	.			trans	-137.1	114.3	-171.9	-63.3	-63.2	0	0	0	111.1	S24 H29 Q30	S24-H27 PolarHBondContact OG-N 2.82Å; H27-H29 PolarHBondContact O-N 2.79Å; H27-Q30 HydrophobicContact CB-CB 3.83Å; H27-Q30 PolarHBondContact CD2-OE1 2.85Å; H27-Q30 PolarHBondContact O-N 2.87Å; H27-Q30 VanDerWaalsContact O-N 3.09Å
28	E	73.4	Confident	85.6	Confident	186 Å²	186	86.3 Å²	86.3	87%	0.869	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-22.3	-172.3	-80.8	-174.2	147.2	0	0	115.8
29	H	80.6	Confident	85.9	Confident	169 Å²	169	86.9 Å²	86.9	78%	0.782	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	7.5	-176.8	-58.8	-41.7	0	0	0	114	H27	H27-H29 PolarHBondContact O-N 2.79Å
30	Q	82.7	Confident	86.4	Confident	50 Å²	50	85.2 Å²	85.2	23%	0.234	42%	0.415	C	S	.	.			trans	-93.7	119.5	178.9	-171.7	-176.6	-41.3	0	0	109.6	A23 S24 H27 F32	A23-Q30 WeakPolarHBondContact CA-O 3.37Å; S24-Q30 PolarHBondContact N-O 3.22Å; H27-Q30 HydrophobicContact CB-CB 3.83Å; H27-Q30 PolarHBondContact CD2-OE1 2.85Å; H27-Q30 PolarHBondContact O-N 2.87Å; H27-Q30 VanDerWaalsContact O-N 3.09Å; Q30-F32 VanDerWaalsContact C-N 3.25Å; Q30-F32 HydrophobicContact CG-CD1 3.75Å; Q30-F32 HydrophobicContact CG-CD2 4.46Å; Q30-F32 HydrophobicContact CG-CE1 3.57Å; Q30-F32 HydrophobicContact CG-CE2 4.33Å; Q30-F32 HydrophobicContact CG-CG 4.2Å; Q30-F32 HydrophobicContact CG-CZ 3.88Å; Q30-F32 WeakPolarHBondContact CG-O 3.33Å; Q30-F32 PolarHBondContact NE2-O 3.04Å; Q30-F32 PolarHBondContact O-N 3.25Å
31	Q	85.8	Confident	86.9	Confident	133 Å²	133	81.5 Å²	81.5	62%	0.621	40%	0.4	S	S	*	.	S	Bend	trans	-85.5	8.9	-176.3	-61.4	-63.6	-27.2	0	0	114	E21 E22	E21-Q31 CarbonylContact C-O 3.53Å; E22-Q31 CarbonylContact C-O 3.58Å; E22-Q31 PolarHBondContact N-O 3.44Å; E22-Q31 CarbonylContact O-C 3.58Å; E22-Q31 VanDerWaalsContact O-C 3.25Å
32	F	86	Confident	87.4	Confident	81 Å²	81	77 Å²	77	36%	0.355	39%	0.385	S	S	.	.			trans	-139	156.3	176.4	67.6	-87.7	0	0	0	110.1	V19 K20 E22 Q30	V19-F32 HydrophobicContact CG1-CB 4.08Å; V19-F32 HydrophobicContact CG1-CD2 3.9Å; V19-F32 HydrophobicContact CG1-CG 4.33Å; K20-F32 CarbonylContact O-C 3.43Å; K20-F32 WeakPolarHBondContact O-CA 3.44Å; K20-F32 WeakPolarHBondContact O-CB 3.22Å; E22-F32 CarbonylContact O-C 3.25Å; E22-F32 WeakPolarHBondContact O-CA 3.43Å; E22-F32 PolarHBondContact O-N 3.45Å; Q30-F32 VanDerWaalsContact C-N 3.25Å; Q30-F32 HydrophobicContact CG-CD1 3.75Å; Q30-F32 HydrophobicContact CG-CD2 4.46Å; Q30-F32 HydrophobicContact CG-CE1 3.57Å; Q30-F32 HydrophobicContact CG-CE2 4.33Å; Q30-F32 HydrophobicContact CG-CG 4.2Å; Q30-F32 HydrophobicContact CG-CZ 3.88Å; Q30-F32 WeakPolarHBondContact CG-O 3.33Å; Q30-F32 PolarHBondContact NE2-O 3.04Å; Q30-F32 PolarHBondContact O-N 3.25Å
33	Q	86.9	Confident	87.8	Confident	12 Å²	12	76.2 Å²	76.2	6%	0.056	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	146.3	169.8	56.4	176.5	1.4	0	0	112.8	V19 K20 E22 V35	V19-Q33 WeakPolarHBondContact CA-O 2.98Å; K20-Q33 HydrophobicContact CB-CG 4.33Å; K20-Q33 PolarHBondContact N-O 2.99Å; K20-Q33 PolarHBondContact O-N 2.84Å; E22-Q33 HydrophobicContact CG-CG 3.66Å; E22-Q33 PolarHBondContact O-N 3.18Å; E22-Q33 PolarHBondContact OE1-NE2 2.69Å; Q33-V35 HydrophobicContact CG-CG1 3.92Å
34	V	89.4	Confident	88.5	Confident	60 Å²	60	73.1 Å²	73.1	36%	0.364	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	117.7	172.1	-176.4	0	0	0	0	107.9	T17 D18 V19	T17-V34 HydrophobicContact CG2-CG1 4.19Å; D18-V34 CarbonylContact O-C 3.45Å; D18-V34 WeakPolarHBondContact O-CA 3.32Å; V19-V34 HydrophobicContact CG2-CG2 4.38Å
35	V	92.9	Very high	89.2	Confident	10 Å²	10	77.1 Å²	77.1	6%	0.061	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	150.6	-179	-63.2	0	0	0	0	110.7	T17 D18 K20 Q33 H268	T17-V35 CarbonylContact C-O 3.42Å; T17-V35 WeakPolarHBondContact CA-O 3.18Å; D18-V35 PolarHBondContact N-O 2.97Å; D18-V35 PolarHBondContact O-N 2.82Å; K20-V35 HydrophobicContact CD-CG2 3.67Å; K20-V35 HydrophobicContact CG-CG2 3.82Å; Q33-V35 HydrophobicContact CG-CG1 3.92Å; V35-H268 CarbonylContact C-O 3.5Å; V35-H268 WeakPolarHBondContact CA-O 3.27Å
36	A	95.5	Very high	90	Very high	9 Å²	9	77.5 Å²	77.5	7%	0.074	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	140.1	168.5	0	0	0	0	0	109.5	F15 F234 I264 H268 L269	F15-A36 HydrophobicContact CB-CB 3.82Å; F15-A36 HydrophobicContact CD2-CB 4.07Å; F15-A36 HydrophobicContact CG-CB 4.34Å; A36-F234 HydrophobicContact CB-CE2 3.89Å; A36-I264 HydrophobicContact CB-CD1 4.37Å; A36-H268 HydrophobicContact CB-CB 3.89Å; A36-H268 PolarHBondContact N-O 3.46Å; A36-L269 HydrophobicContact CB-CD2 4.29Å
37	T	95.4	Very high	91	Very high	38 Å²	38	72.9 Å²	72.9	23%	0.233	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	173.9	163.7	71.1	0	0	0	0	109.6	F15 L16 D18 N39 F234	F15-T37 VanDerWaalsContact CB-O 3.25Å; F15-T37 WeakPolarHBondContact CB-O 3.35Å; F15-T37 WeakPolarHBondContact CG-O 3.46Å; L16-T37 PolarHBondContact O-N 2.98Å; L16-T37 PolarHBondContact O-OG1 3.04Å; D18-T37 HydrophobicContact CB-CG2 4.12Å; T37-N39 PolarHBondContact O-N 3.04Å; T37-N39 PolarHBondContact OG1-N 2.79Å; T37-F234 WeakPolarHBondContact O-CD2 3.22Å; T37-F234 WeakPolarHBondContact O-CE2 3.28Å
38	E	95.4	Very high	91.9	Very high	125 Å²	125	72.2 Å²	72.2	58%	0.584	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.1	-6.4	174.6	-58.3	-173.2	-162.2	0	0	112.9	F234 Q235	E38-F234 HydrophobicContact CB-CB 4.33Å; E38-F234 HydrophobicContact CB-CG 4.37Å; E38-F234 HydrophobicContact CG-CB 4.3Å; E38-F234 HydrophobicContact CG-CD1 3.95Å; E38-F234 HydrophobicContact CG-CD2 4.3Å; E38-F234 HydrophobicContact CG-CE1 4.35Å; E38-F234 HydrophobicContact CG-CG 3.93Å; E38-Q235 PolarHBondContact OE1-NE2 3.09Å; E38-Q235 PolarHBondContact OE2-NE2 3.44Å
39	N	96.9	Very high	93	Very high	104 Å²	104	63.4 Å²	63.4	56%	0.556	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.8	124.2	-178.1	-62	-51.8	0	0	0	110.8	F15 L16 T37	F15-N39 CarbonylContact C-O 3.58Å; F15-N39 VanDerWaalsContact CA-O 3.25Å; F15-N39 WeakPolarHBondContact CA-O 3.39Å; F15-N39 WeakPolarHBondContact CB-O 3.48Å; L16-N39 HydrophobicContact CD1-CB 4.06Å; L16-N39 PolarHBondContact N-O 3.16Å; T37-N39 PolarHBondContact O-N 3.04Å; T37-N39 PolarHBondContact OG1-N 2.79Å
40	V	97.3	Very high	93.7	Very high	41 Å²	41	60.7 Å²	60.7	25%	0.248	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	136.6	173.4	-173.6	0	0	0	0	109.4	V14 F15 A44 L45 V232	V14-V40 WeakPolarHBondContact O-CG1 3.45Å; F15-V40 HydrophobicContact CD1-CG2 4.23Å; F15-V40 HydrophobicContact CE1-CG2 4.05Å; V40-A44 HydrophobicContact CG1-CB 4.19Å; V40-L45 HydrophobicContact CB-CD1 4.49Å; V40-L45 HydrophobicContact CB-CD2 4.27Å; V40-L45 HydrophobicContact CB-CG 4.31Å; V40-L45 HydrophobicContact CG1-CD1 4.46Å; V40-L45 HydrophobicContact CG1-CD2 3.73Å; V40-L45 HydrophobicContact CG1-CG 3.78Å; V40-V232 HydrophobicContact CG1-CG1 4.33Å; V40-V232 HydrophobicContact CG2-CG1 4.32Å
41	N	96.8	Very high	94.2	Very high	24 Å²	24	62 Å²	62	13%	0.128	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-66.2	127.8	177.2	-171.1	-28.2	0	0	0	109.4	C13 V14 L16 V43 A44 L45	C13-N41 VanDerWaalsContact O-CB 3.31Å; C13-N41 WeakPolarHBondContact O-CB 3.49Å; C13-N41 PolarHBondContact O-ND2 3.37Å; V14-N41 WeakPolarHBondContact O-CB 3.39Å; V14-N41 PolarHBondContact O-N 3.42Å; L16-N41 HydrophobicContact CD2-CB 4.4Å; N41-V43 PolarHBondContact O-N 3.2Å; N41-V43 VanDerWaalsContact O-N 3.11Å; N41-V43 PolarHBondContact OD1-N 2.99Å; N41-V43 VanDerWaalsContact OD1-N 3.11Å; N41-A44 HydrophobicContact CB-CB 4.35Å; N41-A44 WeakPolarHBondContact O-CA 3.28Å; N41-A44 WeakPolarHBondContact O-CB 3.37Å; N41-A44 PolarHBondContact O-N 3.08Å; N41-L45 PolarHBondContact O-N 3.05Å
42	P	96.8	Very high	94.7	Very high	66 Å²	66	56.5 Å²	56.5	43%	0.429	31%	0.309	S	S	.	.	H	α-helix	trans	-51.5	-35.9	177.3	-29.3	36	0	0	0	113.6	A44 L45 E46	P42-A44 VanDerWaalsContact C-N 3.25Å; P42-A44 PolarHBondContact O-N 2.81Å; P42-L45 PolarHBondContact O-N 2.76Å; P42-L45 VanDerWaalsContact O-N 3.15Å; P42-E46 WeakPolarHBondContact O-CB 3.33Å; P42-E46 WeakPolarHBondContact O-CG 3.26Å; P42-E46 PolarHBondContact O-N 3.49Å
43	V	95.1	Very high	95.2	Very high	62 Å²	62	57.1 Å²	57.1	38%	0.376	31%	0.312	S	S	.	.	H	α-helix	trans	-60.8	-35	176.3	-179.6	0	0	0	0	111.9	P12 N41 A47 T260 I262	P12-V43 HydrophobicContact CG-CG1 4.39Å; N41-V43 PolarHBondContact O-N 3.2Å; N41-V43 VanDerWaalsContact O-N 3.11Å; N41-V43 PolarHBondContact OD1-N 2.99Å; N41-V43 VanDerWaalsContact OD1-N 3.11Å; V43-A47 VanDerWaalsContact O-CB 3.28Å; V43-A47 WeakPolarHBondContact O-CB 3.26Å; V43-A47 PolarHBondContact O-N 3.26Å; V43-A47 VanDerWaalsContact O-N 3.12Å; V43-T260 HydrophobicContact CG1-CG2 4.39Å; V43-I262 HydrophobicContact CG1-CD1 4.11Å
44	A	96.9	Very high	95.6	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-72.8	-36.6	177.3	0	0	0	0	0	112.3	V14 V40 N41 P42 N48 V49 I262	V14-A44 HydrophobicContact CG2-CB 4.11Å; V40-A44 HydrophobicContact CG1-CB 4.19Å; N41-A44 HydrophobicContact CB-CB 4.35Å; N41-A44 WeakPolarHBondContact O-CA 3.28Å; N41-A44 WeakPolarHBondContact O-CB 3.37Å; N41-A44 PolarHBondContact O-N 3.08Å; P42-A44 VanDerWaalsContact C-N 3.25Å; P42-A44 PolarHBondContact O-N 2.81Å; A44-N48 PolarHBondContact O-N 3.33Å; A44-V49 HydrophobicContact CB-CB 4.28Å; A44-V49 HydrophobicContact CB-CG1 4.1Å; A44-V49 WeakPolarHBondContact O-CB 3.44Å; A44-V49 WeakPolarHBondContact O-CG1 3.47Å; A44-V49 PolarHBondContact O-N 3.32Å; A44-V49 VanDerWaalsContact O-N 3.11Å; A44-I262 HydrophobicContact CB-CD1 4.01Å; A44-I262 HydrophobicContact CB-CG1 4.08Å; A44-I262 HydrophobicContact CB-CG2 3.93Å
45	L	96.6	Very high	96	Very high	102 Å²	102	54.1 Å²	54.1	53%	0.534	30%	0.295	S	S	.	.	H	α-helix	trans	-67.8	-46.5	175.3	-64.1	175.3	0	0	0	111.2	V40 N41 P42 A47 N48	V40-L45 HydrophobicContact CB-CD1 4.49Å; V40-L45 HydrophobicContact CB-CD2 4.27Å; V40-L45 HydrophobicContact CB-CG 4.31Å; V40-L45 HydrophobicContact CG1-CD1 4.46Å; V40-L45 HydrophobicContact CG1-CD2 3.73Å; V40-L45 HydrophobicContact CG1-CG 3.78Å; N41-L45 PolarHBondContact O-N 3.05Å; P42-L45 PolarHBondContact O-N 2.76Å; P42-L45 VanDerWaalsContact O-N 3.15Å; L45-A47 PolarHBondContact O-N 2.75Å; L45-N48 PolarHBondContact O-N 3.33Å
46	E	97.3	Very high	96.1	Very high	156 Å²	156	54.3 Å²	54.3	73%	0.729	30%	0.295	S	S	*	.	H	α-helix	trans	-59.1	-36.7	176.7	-72.9	170.7	-168.3	0	0	111.9	P42 N48	P42-E46 WeakPolarHBondContact O-CB 3.33Å; P42-E46 WeakPolarHBondContact O-CG 3.26Å; P42-E46 PolarHBondContact O-N 3.49Å; E46-N48 PolarHBondContact O-N 3Å
47	A	96.1	Very high	96.2	Very high	7 Å²	7	55.6 Å²	55.6	6%	0.058	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-1.2	176.2	0	0	0	0	0	114.3	V43 L45 C256 T260	V43-A47 VanDerWaalsContact O-CB 3.28Å; V43-A47 WeakPolarHBondContact O-CB 3.26Å; V43-A47 PolarHBondContact O-N 3.26Å; V43-A47 VanDerWaalsContact O-N 3.12Å; L45-A47 PolarHBondContact O-N 2.75Å; A47-C256 HydrophobicContact CB-CB 3.9Å; A47-C256 WeakPolarHBondContact O-CB 3.42Å; A47-T260 HydrophobicContact CB-CG2 3.88Å
48	N	96.4	Very high	96.2	Very high	81 Å²	81	54.4 Å²	54.4	43%	0.433	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	53.6	-176.9	-171	20.7	0	0	0	113	A44 L45 E46 D50 C51	A44-N48 PolarHBondContact O-N 3.33Å; L45-N48 PolarHBondContact O-N 3.33Å; E46-N48 PolarHBondContact O-N 3Å; N48-D50 PolarHBondContact O-N 3.17Å; N48-D50 VanDerWaalsContact O-N 3.13Å; N48-C51 PolarHBondContact ND2-SG 3.21Å; N48-C51 PolarHBondContact O-N 2.68Å
49	V	96.6	Very high	96.2	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.012	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-56	-28.5	-175.2	66.7	0	0	0	0	114.3	V14 A44 C51 A52 V232 W254 I262	V14-V49 HydrophobicContact CG2-CG2 4.3Å; A44-V49 HydrophobicContact CB-CB 4.28Å; A44-V49 HydrophobicContact CB-CG1 4.1Å; A44-V49 WeakPolarHBondContact O-CB 3.44Å; A44-V49 WeakPolarHBondContact O-CG1 3.47Å; A44-V49 PolarHBondContact O-N 3.32Å; A44-V49 VanDerWaalsContact O-N 3.11Å; V49-C51 PolarHBondContact O-N 2.98Å; V49-A52 WeakPolarHBondContact O-CB 3.4Å; V49-A52 PolarHBondContact O-N 3.1Å; V49-V232 HydrophobicContact CG1-CB 4.34Å; V49-V232 HydrophobicContact CG1-CG1 4.29Å; V49-V232 HydrophobicContact CG1-CG2 3.88Å; V49-V232 HydrophobicContact CG2-CG2 4.06Å; V49-W254 HydrophobicContact CG2-CB 3.77Å; V49-W254 HydrophobicContact CG2-CD2 4.03Å; V49-W254 HydrophobicContact CG2-CG 3.68Å; V49-I262 HydrophobicContact CG2-CB 4.37Å; V49-I262 HydrophobicContact CG2-CG2 4.38Å
50	D	94.8	Very high	96.2	Very high	112 Å²	112	45.4 Å²	45.4	60%	0.599	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-66	-21.9	179.2	-66.9	-42.9	0	0	0	113.1	N48	N48-D50 PolarHBondContact O-N 3.17Å; N48-D50 VanDerWaalsContact O-N 3.13Å
51	C	94	Very high	96.2	Very high	76 Å²	76	45.6 Å²	45.6	51%	0.514	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	-98.7	5.2	175.6	-62.2	0	0	0	0	112.9	N48 V49	N48-C51 PolarHBondContact ND2-SG 3.21Å; N48-C51 PolarHBondContact O-N 2.68Å; V49-C51 PolarHBondContact O-N 2.98Å
52	A	95.6	Very high	96.2	Very high	18 Å²	18	45.4 Å²	45.4	15%	0.149	25%	0.252	C	S	.	.	S	Bend	trans	-83.7	154.5	-173.7	0	0	0	0	0	112.6	V49 W254 H255 C256	V49-A52 WeakPolarHBondContact O-CB 3.4Å; V49-A52 PolarHBondContact O-N 3.1Å; A52-W254 HydrophobicContact CB-CB 3.84Å; A52-W254 HydrophobicContact CB-CG 4.43Å; A52-H255 WeakPolarHBondContact CB-O 2.99Å; A52-C256 HydrophobicContact CB-CB 4.38Å
53	F	95.6	Very high	96.2	Very high	94 Å²	94	42.3 Å²	42.3	41%	0.412	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	123.8	174.4	-179.5	-105.7	0	0	0	110.6	L4 T55 P225 W254 H255	L4-F53 HydrophobicContact CD1-CD1 3.32Å; L4-F53 HydrophobicContact CD1-CE1 3.37Å; L4-F53 HydrophobicContact CD1-CG 4.36Å; L4-F53 HydrophobicContact CD1-CZ 4.45Å; L4-F53 HydrophobicContact CD2-CD1 4.36Å; L4-F53 HydrophobicContact CG-CD1 4.47Å; F53-T55 HydrophobicContact CD1-CG2 3.58Å; F53-T55 HydrophobicContact CE1-CG2 3.26Å; F53-T55 HydrophobicContact CZ-CG2 4.22Å; F53-P225 HydrophobicContact CE2-CB 4.43Å; F53-P225 HydrophobicContact CZ-CB 3.89Å; F53-W254 WeakPolarHBondContact O-CA 3.2Å; F53-H255 HydrophobicContact CB-CB 4.48Å; F53-H255 PolarHBondContact N-O 2.7Å; F53-H255 VanDerWaalsContact N-O 3.15Å; F53-H255 PolarHBondContact O-CD2 3.29Å; F53-H255 PolarHBondContact O-N 3.14Å
54	A	96.9	Very high	96.3	Very high	6 Å²	6	39.6 Å²	39.6	5%	0.05	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	131.5	-176.4	0	0	0	0	0	112.2	V226 P229 I252	A54-V226 HydrophobicContact CB-CB 4.32Å; A54-V226 PolarHBondContact O-N 3.39Å; A54-P229 HydrophobicContact CB-CB 3.86Å; A54-P229 HydrophobicContact CB-CG 3.77Å; A54-I252 HydrophobicContact CB-CG2 3.83Å
55	T	96.7	Very high	96.3	Very high	3 Å²	3	39.6 Å²	39.6	2%	0.018	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	156.7	176.6	63.3	0	0	0	0	111.8	F53 K57 I224 I252 V253 H255	F53-T55 HydrophobicContact CD1-CG2 3.58Å; F53-T55 HydrophobicContact CE1-CG2 3.26Å; F53-T55 HydrophobicContact CZ-CG2 4.22Å; T55-K57 PolarHBondContact O-N 2.68Å; T55-I224 CarbonylContact C-O 3.49Å; T55-I224 WeakPolarHBondContact CA-O 3.48Å; T55-I224 WeakPolarHBondContact CB-O 3.37Å; T55-I252 WeakPolarHBondContact O-CA 3.49Å; T55-V253 PolarHBondContact N-O 2.81Å; T55-V253 PolarHBondContact O-N 3.02Å; T55-V253 PolarHBondContact OG1-O 2.87Å; T55-H255 PolarHBondContact OG1-CD2 3.37Å; T55-H255 PolarHBondContact OG1-NE2 3.04Å
56	E	96.2	Very high	96.3	Very high	14 Å²	14	35.4 Å²	35.4	7%	0.065	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	131.5	175.9	-66.1	-169.4	-151.1	0	0	109.1	L58 I224 V226 V249 R279	E56-L58 HydrophobicContact CB-CD2 4.03Å; E56-L58 PolarHBondContact O-N 2.9Å; E56-I224 HydrophobicContact CB-CB 4.32Å; E56-I224 HydrophobicContact CB-CG2 4.03Å; E56-I224 HydrophobicContact CG-CG2 3.77Å; E56-I224 PolarHBondContact N-O 2.91Å; E56-I224 WeakPolarHBondContact OE1-CG2 3.19Å; E56-V226 HydrophobicContact CB-CG2 4.47Å; E56-V226 HydrophobicContact CG-CG2 3.83Å; E56-V249 HydrophobicContact CG-CG1 3.93Å; E56-V249 WeakPolarHBondContact OE2-CG1 3.5Å; E56-R279 WeakPolarHBondContact OE1-CG 3.34Å
57	K	96.7	Very high	96.2	Very high	36 Å²	36	31.7 Å²	31.7	16%	0.157	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	122.6	162.8	-170.3	-170	176.7	-64.5	0	106.9	T55 E250 G251 V253 K263	T55-K57 PolarHBondContact O-N 2.68Å; K57-E250 HydrophobicContact CB-CB 4.35Å; K57-E250 HydrophobicContact CD-CG 4.06Å; K57-E250 IonicContact NZ-OE1 2.82Å; K57-E250 PolarHBondContact NZ-OE1 2.8Å; K57-E250 IonicContact NZ-OE2 3.24Å; K57-E250 PolarHBondContact NZ-OE2 3.01Å; K57-E250 VanDerWaalsContact O-CB 3.22Å; K57-E250 WeakPolarHBondContact O-CB 3.45Å; K57-G251 VanDerWaalsContact CB-C 3.44Å; K57-G251 WeakPolarHBondContact CB-O 3.33Å; K57-G251 PolarHBondContact N-O 3.46Å; K57-V253 HydrophobicContact CB-CG2 3.88Å; K57-V253 HydrophobicContact CG-CG2 3.98Å; K57-K263 HydrophobicContact CD-CD 4.37Å
58	L	96.4	Very high	96.2	Very high	13 Å²	13	33.4 Å²	33.4	7%	0.068	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-97	133.4	177.6	-60.1	-173.9	0	0	0	111	E56 G60 E195 I197 Y206 V219 I224 E250 L280	E56-L58 HydrophobicContact CB-CD2 4.03Å; E56-L58 PolarHBondContact O-N 2.9Å; L58-G60 PolarHBondContact O-N 3.39Å; L58-E195 HydrophobicContact CB-CB 4.3Å; L58-E195 HydrophobicContact CB-CG 3.93Å; L58-I197 HydrophobicContact CB-CG2 4.43Å; L58-Y206 VanDerWaalsContact CA-OH 3.23Å; L58-Y206 WeakPolarHBondContact CA-OH 3.41Å; L58-Y206 HydrophobicContact CD2-CE1 4.49Å; L58-V219 HydrophobicContact CD1-CB 3.63Å; L58-V219 HydrophobicContact CD1-CG1 3.45Å; L58-V219 VanDerWaalsContact CD1-CG1 3.45Å; L58-V219 HydrophobicContact CD1-CG2 3.84Å; L58-I224 HydrophobicContact CD1-CG1 4.42Å; L58-E250 VanDerWaalsContact O-OE2 3.13Å; L58-L280 HydrophobicContact CD1-CD2 4.5Å; L58-L280 HydrophobicContact CD2-CD2 3.95Å
59	D	95.3	Very high	96.1	Very high	27 Å²	27	36.7 Å²	36.7	14%	0.144	20%	0.201	C	C	.	.			trans	-81.1	89.3	173.4	-165.6	-4.8	0	0	0	110.4	N202 P205 Y206 E250 W273	D59-N202 VanDerWaalsContact OD1-CB 3.3Å; D59-N202 WeakPolarHBondContact OD1-CB 3.28Å; D59-N202 PolarHBondContact OD1-ND2 2.85Å; D59-P205 HydrophobicContact CB-CG 4Å; D59-Y206 PolarHBondContact N-OH 3.25Å; D59-E250 WeakPolarHBondContact CA-OE2 3.39Å; D59-E250 HydrophobicContact CB-CG 4.47Å; D59-E250 WeakPolarHBondContact CB-OE2 3.3Å; D59-E250 PolarHBondContact N-OE2 2.78Å; D59-W273 HydrophobicContact CB-CH2 3.39Å; D59-W273 HydrophobicContact CB-CZ2 4.36Å; D59-W273 HydrophobicContact CB-CZ3 3.57Å; D59-W273 VanDerWaalsContact OD2-CZ3 3.3Å; D59-W273 WeakPolarHBondContact OD2-CZ3 3.13Å
60	G	96.4	Very high	96	Very high	14 Å²	14	39.5 Å²	39.5	14%	0.144	23%	0.23	C	C	.	.	S	Bend	trans	-147.2	-157.7	178.3	0	0	0	0	0	113.1	L58 E195 L196 N202	L58-G60 PolarHBondContact O-N 3.39Å; G60-E195 WeakPolarHBondContact CA-OE1 3.29Å; G60-L196 CarbonylContact C-O 3.47Å; G60-L196 WeakPolarHBondContact CA-O 3.4Å; G60-N202 VanDerWaalsContact C-ND2 3.32Å; G60-N202 WeakPolarHBondContact CA-ND2 3.39Å; G60-N202 PolarHBondContact N-ND2 3.36Å; G60-N202 PolarHBondContact O-ND2 2.89Å
61	T	96.8	Very high	96.1	Very high	45 Å²	45	40.2 Å²	40.2	28%	0.276	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	125.5	169.6	57.7	0	0	0	0	112.5	C63 H155 E195 L196 V201	T61-C63 PolarHBondContact O-SG 3.36Å; T61-H155 PolarHBondContact OG1-CE1 3.36Å; T61-H155 PolarHBondContact OG1-NE2 3.45Å; T61-E195 WeakPolarHBondContact CA-OE1 3.43Å; T61-E195 PolarHBondContact N-OE1 3.21Å; T61-L196 PolarHBondContact N-O 2.84Å; T61-L196 WeakPolarHBondContact O-CB 3.3Å; T61-L196 PolarHBondContact O-N 3.22Å; T61-V201 HydrophobicContact CG2-CG1 4.2Å
62	C	97	Very high	96.2	Very high	20 Å²	20	39.7 Å²	39.7	14%	0.135	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	137.3	-175.2	-168.2	0	0	0	0	112.1	R77 L194 E195	C62-R77 HydrophobicContact CB-CB 4.15Å; C62-R77 WeakPolarHBondContact O-CB 3.14Å; C62-R77 PolarHBondContact O-N 3.42Å; C62-R77 VanDerWaalsContact O-N 3.09Å; C62-L194 CarbonylContact C-O 3.51Å; C62-E195 PolarHBondContact N-OE1 2.84Å
63	C	97.2	Very high	96.3	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	164.5	-178	-58.8	0	0	0	0	110.7	T61 L74 W75 H155 T193 L194 L218	T61-C63 PolarHBondContact O-SG 3.36Å; C63-L74 HydrophobicContact CB-CD1 3.74Å; C63-L74 HydrophobicContact CB-CG 4.43Å; C63-W75 CarbonylContact C-O 3.4Å; C63-W75 VanDerWaalsContact CA-O 3.22Å; C63-W75 WeakPolarHBondContact CA-O 3.23Å; C63-H155 PolarHBondContact SG-CD2 2.98Å; C63-T193 CarbonylContact O-C 3.49Å; C63-T193 WeakPolarHBondContact O-CA 3.44Å; C63-T193 WeakPolarHBondContact O-CB 3.46Å; C63-L194 HydrophobicContact CB-CB 4.44Å; C63-L194 PolarHBondContact N-O 2.72Å; C63-L194 PolarHBondContact O-N 2.84Å; C63-L218 HydrophobicContact CB-CD2 4.43Å
64	Y	97.1	Very high	96.4	Very high	6 Å²	6	36.6 Å²	36.6	2%	0.024	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	149.4	176.9	177	-118	0	0	0	109.9	A66 L74 W75 H122 W142 E191 Q192 T193	Y64-A66 HydrophobicContact CD1-CB 3.91Å; Y64-A66 HydrophobicContact CE1-CB 3.28Å; Y64-L74 CarbonylContact O-C 3.57Å; Y64-W75 HydrophobicContact CD1-CB 4.48Å; Y64-W75 HydrophobicContact CD1-CG 4.48Å; Y64-W75 PolarHBondContact N-O 3.34Å; Y64-W75 WeakPolarHBondContact O-CA 3.41Å; Y64-W75 WeakPolarHBondContact O-CB 3.26Å; Y64-W75 PolarHBondContact O-N 3.48Å; Y64-H122 AromaticContact CZ-CE1 3.87Å; Y64-H122 PolarHBondContact OH-CE1 2.84Å; Y64-W142 HydrophobicContact CD1-CD2 4.41Å; Y64-W142 HydrophobicContact CD1-CG 4.31Å; Y64-W142 HydrophobicContact CG-CD2 4.33Å; Y64-E191 VanDerWaalsContact CE2-CA 3.49Å; Y64-E191 HydrophobicContact CE2-CB 4.39Å; Y64-Q192 WeakPolarHBondContact CA-O 3.23Å; Y64-Q192 WeakPolarHBondContact CD2-O 3.12Å; Y64-T193 HydrophobicContact CD2-CG2 3.95Å
65	V	96.8	Very high	96.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	124.5	174.9	177.9	0	0	0	0	110	Y73 L74 L186 L189 E191 Q192 L194	V65-Y73 WeakPolarHBondContact CA-O 3.19Å; V65-L74 HydrophobicContact CG2-CD1 3.94Å; V65-L186 HydrophobicContact CG1-CB 4.45Å; V65-L186 HydrophobicContact CG1-CD2 4.31Å; V65-L186 WeakPolarHBondContact CG1-O 3.36Å; V65-L186 HydrophobicContact CG2-CD2 4.33Å; V65-L189 HydrophobicContact CB-CB 4.18Å; V65-L189 WeakPolarHBondContact CB-O 3.15Å; V65-L189 HydrophobicContact CG1-CB 4.27Å; V65-L189 HydrophobicContact CG2-CB 3.93Å; V65-E191 PolarHBondContact O-N 2.88Å; V65-Q192 PolarHBondContact N-O 3.33Å; V65-L194 HydrophobicContact CG2-CD1 3.73Å
66	A	96	Very high	96.5	Very high	13 Å²	13	36.5 Å²	36.5	11%	0.107	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	165.7	178.8	0	0	0	0	0	112	Y64 Y68 Y73 W75	Y64-A66 HydrophobicContact CD1-CB 3.91Å; Y64-A66 HydrophobicContact CE1-CB 3.28Å; A66-Y68 PolarHBondContact O-N 3.22Å; A66-Y73 PolarHBondContact N-O 3.29Å; A66-Y73 VanDerWaalsContact N-O 3.13Å; A66-Y73 PolarHBondContact O-N 2.63Å; A66-W75 PolarHBondContact O-NE1 3.05Å; A66-W75 VanDerWaalsContact O-NE1 3.09Å
67	V	96.5	Very high	96.6	Very high	78 Å²	78	38.1 Å²	38.1	47%	0.473	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68	131.1	178.9	-179.1	0	0	0	0	110.6	Q71 F72	V67-Q71 CarbonylContact C-O 3.47Å; V67-Q71 VanDerWaalsContact CA-O 3.28Å; V67-Q71 WeakPolarHBondContact CA-O 3.48Å; V67-F72 HydrophobicContact CG2-CD1 3.84Å; V67-F72 HydrophobicContact CG2-CE1 3.61Å; V67-F72 HydrophobicContact CG2-CZ 4.44Å
68	Y	96	Very high	96.5	Very high	43 Å²	43	38.3 Å²	38.3	17%	0.169	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	126.8	170.5	-177.4	-114.2	0	0	0	108.2	A66 G70 Q71 Y73 W75 P144	A66-Y68 PolarHBondContact O-N 3.22Å; Y68-G70 PolarHBondContact O-N 3.35Å; Y68-G70 VanDerWaalsContact O-N 3.15Å; Y68-Q71 PolarHBondContact N-O 3.49Å; Y68-Q71 PolarHBondContact O-N 3.01Å; Y68-Q71 VanDerWaalsContact O-O 3.06Å; Y68-Y73 HydrophobicContact CD1-CD1 4.38Å; Y68-Y73 HydrophobicContact CD1-CD2 4.18Å; Y68-Y73 HydrophobicContact CD1-CE1 4.49Å; Y68-Y73 HydrophobicContact CD1-CE2 4.28Å; Y68-Y73 HydrophobicContact CD1-CG 4.23Å; Y68-W75 AromaticContact CD2-CH2 3.84Å; Y68-W75 HydrophobicContact CD2-CH2 3.84Å; Y68-W75 AromaticContact CD2-CZ2 3.79Å; Y68-W75 HydrophobicContact CD2-CZ2 3.79Å; Y68-W75 HydrophobicContact CG-CZ2 4.05Å; Y68-P144 HydrophobicContact CD1-CB 3.95Å; Y68-P144 HydrophobicContact CD1-CG 4.24Å; Y68-P144 HydrophobicContact CD2-CB 4.3Å; Y68-P144 HydrophobicContact CD2-CG 4.18Å; Y68-P144 HydrophobicContact CE1-CB 4.18Å; Y68-P144 HydrophobicContact CE1-CG 4.01Å; Y68-P144 HydrophobicContact CE2-CG 3.95Å; Y68-P144 HydrophobicContact CG-CB 4.01Å; Y68-P144 HydrophobicContact CG-CG 4.32Å
69	Q	94	Very high	96.5	Very high	151 Å²	151	40 Å²	40	71%	0.706	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	37.4	-179.8	-60.4	179.5	-13.4	0	0	113.8	Q71	Q69-Q71 VanDerWaalsContact C-N 3.32Å; Q69-Q71 PolarHBondContact O-N 3.48Å
70	G	94.5	Very high	96.5	Very high	60 Å²	60	40.6 Å²	40.6	62%	0.619	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.6	3.1	178.3	0	0	0	0	0	115.5	Y68	Y68-G70 PolarHBondContact O-N 3.35Å; Y68-G70 VanDerWaalsContact O-N 3.15Å
71	Q	95.4	Very high	96.4	Very high	128 Å²	128	44.6 Å²	44.6	60%	0.598	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-126	156.4	179.4	-63.9	-61.4	-30.4	0	0	111.3	V67 Y68 Q69 Y73	V67-Q71 CarbonylContact C-O 3.47Å; V67-Q71 VanDerWaalsContact CA-O 3.28Å; V67-Q71 WeakPolarHBondContact CA-O 3.48Å; Y68-Q71 PolarHBondContact N-O 3.49Å; Y68-Q71 PolarHBondContact O-N 3.01Å; Y68-Q71 VanDerWaalsContact O-O 3.06Å; Q69-Q71 VanDerWaalsContact C-N 3.32Å; Q69-Q71 PolarHBondContact O-N 3.48Å; Q71-Y73 HydrophobicContact CB-CD2 4.21Å; Q71-Y73 HydrophobicContact CB-CE2 3.95Å; Q71-Y73 PolarHBondContact O-N 3.25Å
72	F	97.1	Very high	96.3	Very high	64 Å²	64	42.8 Å²	42.8	28%	0.281	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	126.6	174.8	-64.4	-69.6	0	0	0	110.8	V67 L186 A187 Q190	V67-F72 HydrophobicContact CG2-CD1 3.84Å; V67-F72 HydrophobicContact CG2-CE1 3.61Å; V67-F72 HydrophobicContact CG2-CZ 4.44Å; F72-L186 HydrophobicContact CB-CB 3.71Å; F72-L186 WeakPolarHBondContact O-CD1 3.34Å; F72-A187 HydrophobicContact CD2-CB 3.8Å; F72-A187 HydrophobicContact CE2-CB 3.52Å; F72-A187 HydrophobicContact CZ-CB 4.07Å; F72-Q190 HydrophobicContact CD1-CB 4.36Å; F72-Q190 HydrophobicContact CD1-CG 4.04Å; F72-Q190 HydrophobicContact CE1-CB 4.06Å; F72-Q190 HydrophobicContact CE1-CG 3.61Å
73	Y	97.4	Very high	96.2	Very high	47 Å²	47	43.9 Å²	43.9	18%	0.184	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	150.9	179.6	-92.3	-102.6	0	0	0	111.6	V65 A66 Y68 Q71 Y161	V65-Y73 WeakPolarHBondContact CA-O 3.19Å; A66-Y73 PolarHBondContact N-O 3.29Å; A66-Y73 VanDerWaalsContact N-O 3.13Å; A66-Y73 PolarHBondContact O-N 2.63Å; Y68-Y73 HydrophobicContact CD1-CD1 4.38Å; Y68-Y73 HydrophobicContact CD1-CD2 4.18Å; Y68-Y73 HydrophobicContact CD1-CE1 4.49Å; Y68-Y73 HydrophobicContact CD1-CE2 4.28Å; Y68-Y73 HydrophobicContact CD1-CG 4.23Å; Q71-Y73 HydrophobicContact CB-CD2 4.21Å; Q71-Y73 HydrophobicContact CB-CE2 3.95Å; Q71-Y73 PolarHBondContact O-N 3.25Å; Y73-Y161 HydrophobicContact CD1-CD1 4.38Å; Y73-Y161 AromaticContact CD1-CE1 3.75Å; Y73-Y161 HydrophobicContact CD1-CE1 3.75Å; Y73-Y161 AromaticContact CD1-CE2 3.97Å; Y73-Y161 HydrophobicContact CD1-CE2 3.97Å; Y73-Y161 AromaticContact CD1-CZ 3.48Å; Y73-Y161 VanDerWaalsContact CD1-CZ 3.48Å; Y73-Y161 WeakPolarHBondContact CD1-OH 3.37Å; Y73-Y161 HydrophobicContact CE1-CD1 4.37Å; Y73-Y161 HydrophobicContact CE1-CD2 4.06Å; Y73-Y161 HydrophobicContact CE1-CE1 4.1Å; Y73-Y161 AromaticContact CE1-CE2 3.73Å; Y73-Y161 HydrophobicContact CE1-CE2 3.73Å; Y73-Y161 HydrophobicContact CE1-CG 4.36Å; Y73-Y161 AromaticContact CE1-CZ 3.74Å; Y73-Y161 HydrophobicContact CG-CE1 4.07Å
74	L	98.1	Very high	96.1	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	138.7	161	-172.8	68.8	0	0	0	108.6	C63 Y64 V65 V145 H155 V158 V159 Y161 L218	C63-L74 HydrophobicContact CB-CD1 3.74Å; C63-L74 HydrophobicContact CB-CG 4.43Å; Y64-L74 CarbonylContact O-C 3.57Å; V65-L74 HydrophobicContact CG2-CD1 3.94Å; L74-V145 HydrophobicContact CB-CB 4.31Å; L74-V145 HydrophobicContact CB-CG2 4.31Å; L74-V145 HydrophobicContact CD2-CG2 4.26Å; L74-V145 HydrophobicContact CG-CG2 4.13Å; L74-V145 VanDerWaalsContact O-CB 3.32Å; L74-V145 WeakPolarHBondContact O-CB 3.38Å; L74-V145 WeakPolarHBondContact O-CG2 3.5Å; L74-V145 PolarHBondContact O-N 3.11Å; L74-H155 HydrophobicContact CD2-CB 3.92Å; L74-H155 WeakPolarHBondContact CD2-O 3.32Å; L74-V158 HydrophobicContact CD2-CG2 4.27Å; L74-V159 HydrophobicContact CB-CG1 4Å; L74-V159 HydrophobicContact CD2-CG1 3.93Å; L74-V159 HydrophobicContact CG-CG1 4.49Å; L74-Y161 PolarHBondContact N-OH 3.5Å; L74-L218 HydrophobicContact CD1-CD1 3.79Å; L74-L218 HydrophobicContact CD1-CD2 4.26Å; L74-L218 HydrophobicContact CD2-CD1 4.32Å; L74-L218 HydrophobicContact CD2-CD2 4.25Å
75	W	98.3	Very high	96	Very high	7 Å²	7	60.1 Å²	60.1	3%	0.027	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	130.7	177.1	-64.3	70.1	0	0	0	109.1	C63 Y64 A66 Y68 S117 I119 W142 V143 P144	C63-W75 CarbonylContact C-O 3.4Å; C63-W75 VanDerWaalsContact CA-O 3.22Å; C63-W75 WeakPolarHBondContact CA-O 3.23Å; Y64-W75 HydrophobicContact CD1-CB 4.48Å; Y64-W75 HydrophobicContact CD1-CG 4.48Å; Y64-W75 PolarHBondContact N-O 3.34Å; Y64-W75 WeakPolarHBondContact O-CA 3.41Å; Y64-W75 WeakPolarHBondContact O-CB 3.26Å; Y64-W75 PolarHBondContact O-N 3.48Å; A66-W75 PolarHBondContact O-NE1 3.05Å; A66-W75 VanDerWaalsContact O-NE1 3.09Å; Y68-W75 AromaticContact CD2-CH2 3.84Å; Y68-W75 HydrophobicContact CD2-CH2 3.84Å; Y68-W75 AromaticContact CD2-CZ2 3.79Å; Y68-W75 HydrophobicContact CD2-CZ2 3.79Å; Y68-W75 HydrophobicContact CG-CZ2 4.05Å; W75-S117 VanDerWaalsContact CZ3-O 3.29Å; W75-S117 WeakPolarHBondContact CZ3-O 3.45Å; W75-I119 HydrophobicContact CE3-CD1 4.07Å; W75-I119 HydrophobicContact CE3-CG1 4.11Å; W75-I119 HydrophobicContact CH2-CD1 3.89Å; W75-I119 HydrophobicContact CH2-CG1 4.28Å; W75-I119 HydrophobicContact CH2-CG2 4.28Å; W75-I119 HydrophobicContact CZ2-CD1 4.36Å; W75-I119 HydrophobicContact CZ3-CD1 3.72Å; W75-I119 HydrophobicContact CZ3-CG1 3.69Å; W75-I119 HydrophobicContact CZ3-CG2 4.2Å; W75-W142 HydrophobicContact CB-CB 4.06Å; W75-W142 HydrophobicContact CD2-CB 4.4Å; W75-W142 HydrophobicContact CE3-CB 3.75Å; W75-V143 CarbonylContact C-O 3.49Å; W75-V143 WeakPolarHBondContact CA-O 3.05Å; W75-P144 HydrophobicContact CD2-CB 4.18Å; W75-P144 HydrophobicContact CE3-CB 4.25Å; W75-P144 VanDerWaalsContact CE3-N 3.3Å; W75-P144 HydrophobicContact CH2-CB 4.39Å; W75-P144 HydrophobicContact CH2-CG 4.41Å; W75-P144 HydrophobicContact CZ2-CB 4.34Å; W75-P144 HydrophobicContact CZ3-CB 4.36Å; W75-P144 VanDerWaalsContact CZ3-CD 3.47Å; W75-P144 HydrophobicContact CZ3-CG 4.28Å
76	A	97.8	Very high	95.8	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	145.8	174.9	0	0	0	0	0	110.2	L78 W142 V143 V145 Y152	A76-L78 PolarHBondContact O-N 3.4Å; A76-W142 WeakPolarHBondContact O-CA 3.26Å; A76-V143 HydrophobicContact CB-CG2 4.43Å; A76-V143 PolarHBondContact N-O 2.98Å; A76-V143 PolarHBondContact O-N 3.13Å; A76-V145 HydrophobicContact CB-CG2 3.86Å; A76-Y152 HydrophobicContact CB-CD1 3.37Å; A76-Y152 HydrophobicContact CB-CD2 4.36Å; A76-Y152 HydrophobicContact CB-CE1 3.33Å; A76-Y152 HydrophobicContact CB-CE2 4.34Å; A76-Y152 HydrophobicContact CB-CG 3.93Å
77	R	96.7	Very high	95.7	Very high	48 Å²	48	61.7 Å²	61.7	18%	0.181	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	124.4	174.5	-173.3	71.6	-175.3	-144.1	-19.7	111	V7 C62 D79 P140 G141 W142	V7-R77 PolarHBondContact O-NH1 3.03Å; C62-R77 HydrophobicContact CB-CB 4.15Å; C62-R77 WeakPolarHBondContact O-CB 3.14Å; C62-R77 PolarHBondContact O-N 3.42Å; C62-R77 VanDerWaalsContact O-N 3.09Å; R77-D79 IonicContact CZ-OD1 2.98Å; R77-D79 VanDerWaalsContact CZ-OD1 3.24Å; R77-D79 IonicContact NE-OD1 3.74Å; R77-D79 PolarHBondContact NE-OD1 2.87Å; R77-D79 IonicContact NH2-OD1 2.75Å; R77-D79 PolarHBondContact NH2-OD1 3.27Å; R77-D79 IonicContact NH2-OD2 3.77Å; R77-P140 VanDerWaalsContact NH2-CG 3.3Å; R77-G141 WeakPolarHBondContact CD-O 3.5Å; R77-W142 HydrophobicContact CB-CE3 4.15Å; R77-W142 HydrophobicContact CB-CZ3 3.76Å; R77-W142 VanDerWaalsContact CD-CZ3 3.47Å; R77-W142 HydrophobicContact CG-CZ3 4.25Å
78	L	96.1	Very high	95.4	Very high	40 Å²	40	65.9 Å²	65.9	21%	0.209	31%	0.314	C	S	.	.			trans	-134.4	98.7	171.8	-176.7	63.3	0	0	0	109.9	A76 R80 W118 G141 V143	A76-L78 PolarHBondContact O-N 3.4Å; L78-R80 PolarHBondContact O-N 2.98Å; L78-W118 PolarHBondContact O-NE1 3.09Å; L78-G141 CarbonylContact C-O 3.54Å; L78-G141 PolarHBondContact N-O 3.36Å; L78-G141 CarbonylContact O-C 3.18Å; L78-G141 PolarHBondContact O-N 3.23Å; L78-V143 HydrophobicContact CB-CG1 4.11Å; L78-V143 HydrophobicContact CB-CG2 4.02Å; L78-V143 HydrophobicContact CD2-CG1 3.53Å; L78-V143 HydrophobicContact CD2-CG2 4.23Å; L78-V143 HydrophobicContact CG-CG1 4.44Å
79	D	95.5	Very high	95.3	Very high	48 Å²	48	68.8 Å²	68.8	26%	0.257	32%	0.324	S	S	.	.			trans	-74.7	125.3	174.2	-68.5	-6.7	0	0	0	110	R77 K81 I139 P140	R77-D79 IonicContact CZ-OD1 2.98Å; R77-D79 VanDerWaalsContact CZ-OD1 3.24Å; R77-D79 IonicContact NE-OD1 3.74Å; R77-D79 PolarHBondContact NE-OD1 2.87Å; R77-D79 IonicContact NH2-OD1 2.75Å; R77-D79 PolarHBondContact NH2-OD1 3.27Å; R77-D79 IonicContact NH2-OD2 3.77Å; D79-K81 PolarHBondContact O-N 3.49Å; D79-I139 CarbonylContact C-O 3.49Å; D79-I139 WeakPolarHBondContact CA-O 3.48Å; D79-P140 WeakPolarHBondContact OD1-CA 3.39Å
80	R	95.1	Very high	95.2	Very high	40 Å²	40	61.8 Å²	61.8	15%	0.151	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-75.5	114.2	170.6	-174.8	176.8	-175.1	-147.5	-7.2	108.5	L78 V107 F111 K112 V114 W118 I139	L78-R80 PolarHBondContact O-N 2.98Å; R80-V107 PolarHBondContact NH2-O 3.33Å; R80-F111 HydrophobicContact CG-CB 4.06Å; R80-F111 HydrophobicContact CG-CD1 4.1Å; R80-F111 HydrophobicContact CG-CG 4.47Å; R80-K112 PolarHBondContact NE-O 3.33Å; R80-V114 HydrophobicContact CB-CG1 3.85Å; R80-V114 HydrophobicContact CG-CG1 3.79Å; R80-W118 HydrophobicContact CB-CZ2 4.06Å; R80-I139 HydrophobicContact CB-CB 4.17Å; R80-I139 PolarHBondContact N-O 2.85Å; R80-I139 PolarHBondContact O-N 3.2Å
81	K	94.9	Very high	94.9	Very high	98 Å²	98	65 Å²	65	43%	0.426	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-102	155	-175	-66.8	-177	-176.9	179.4	0	111.4	D79 K112	D79-K81 PolarHBondContact O-N 3.49Å; K81-K112 PolarHBondContact O-N 3.49Å
82	P	95	Very high	94.5	Very high	8 Å²	8	66.2 Å²	66.2	5%	0.052	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-63.9	154.1	173.2	28.1	-34.1	0	0	0	110.8	A86 E87 W105 D110 G137	P82-A86 HydrophobicContact CB-CB 4Å; P82-E87 HydrophobicContact CB-CB 4.49Å; P82-E87 HydrophobicContact CG-CB 4.22Å; P82-E87 WeakPolarHBondContact CG-OE2 3.08Å; P82-W105 HydrophobicContact CB-CH2 4.21Å; P82-W105 HydrophobicContact CB-CZ3 3.89Å; P82-W105 HydrophobicContact CG-CH2 4.45Å; P82-D110 CarbonylContact C-O 3.45Å; P82-D110 WeakPolarHBondContact CA-O 3.2Å; P82-G137 WeakPolarHBondContact CD-O 3.33Å
83	N	95.6	Very high	94.1	Very high	42 Å²	42	64.8 Å²	64.8	23%	0.225	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-72.2	170.2	169.2	76.5	42.2	0	0	0	110	Q85 A86 E87 E109 D110	N83-Q85 VanDerWaalsContact C-N 3.29Å; N83-Q85 PolarHBondContact O-N 3.07Å; N83-Q85 WeakPolarHBondContact OD1-CA 3.41Å; N83-Q85 WeakPolarHBondContact OD1-CB 3.33Å; N83-Q85 PolarHBondContact OD1-N 3.44Å; N83-A86 PolarHBondContact O-N 3.36Å; N83-A86 PolarHBondContact OD1-N 3.18Å; N83-E87 VanDerWaalsContact O-CB 3.29Å; N83-E87 WeakPolarHBondContact O-CB 3.2Å; N83-E87 PolarHBondContact O-N 3.33Å; N83-E109 PolarHBondContact ND2-O 3.47Å; N83-D110 PolarHBondContact N-O 2.92Å; N83-D110 WeakPolarHBondContact ND2-CA 3.26Å; N83-D110 PolarHBondContact ND2-O 2.91Å
84	K	94.1	Very high	93.5	Very high	191 Å²	191	65.6 Å²	65.6	83%	0.83	29%	0.288	S	S	*	.	H	α-helix	trans	-61	-35.4	-174.8	-68.5	-176.8	179.2	178.7	0	113.4	K88	K84-K88 PolarHBondContact O-N 3.42Å
85	Q	94.2	Very high	92.7	Very high	156 Å²	156	73 Å²	73	73%	0.729	32%	0.322	S	S	*	.	H	α-helix	trans	-73.4	-45.8	-178.5	-179.2	178.4	-1.2	0	0	110.9	N83 K88 R89	N83-Q85 VanDerWaalsContact C-N 3.29Å; N83-Q85 PolarHBondContact O-N 3.07Å; N83-Q85 WeakPolarHBondContact OD1-CA 3.41Å; N83-Q85 WeakPolarHBondContact OD1-CB 3.33Å; N83-Q85 PolarHBondContact OD1-N 3.44Å; Q85-K88 PolarHBondContact O-N 3.49Å; Q85-R89 PolarHBondContact O-N 3.3Å
86	A	94.2	Very high	92	Very high	1 Å²	1	77.2 Å²	77.2	1%	0.008	35%	0.349	C	S	.	.	H	α-helix	trans	-63.3	-44.3	176.9	0	0	0	0	0	111.6	P82 N83 K88 R89 F90 W105 D110	P82-A86 HydrophobicContact CB-CB 4Å; N83-A86 PolarHBondContact O-N 3.36Å; N83-A86 PolarHBondContact OD1-N 3.18Å; A86-K88 VanDerWaalsContact C-N 3.32Å; A86-K88 PolarHBondContact O-N 3.17Å; A86-R89 PolarHBondContact O-N 3.23Å; A86-R89 VanDerWaalsContact O-N 3.15Å; A86-F90 WeakPolarHBondContact O-CB 3.48Å; A86-F90 PolarHBondContact O-N 3.05Å; A86-W105 HydrophobicContact CB-CZ3 4.15Å; A86-D110 HydrophobicContact CB-CB 3.53Å; A86-D110 VanDerWaalsContact CB-O 3.23Å; A86-D110 WeakPolarHBondContact CB-O 3.34Å; A86-D110 WeakPolarHBondContact CB-OD1 3.42Å
87	E	92.9	Very high	91.2	Very high	46 Å²	46	82.7 Å²	82.7	22%	0.215	37%	0.374	C	S	.	.	H	α-helix	trans	-56.1	-45.3	174.2	179.5	67	-168.5	0	0	111.5	P82 N83 R89 F90 R91	P82-E87 HydrophobicContact CB-CB 4.49Å; P82-E87 HydrophobicContact CG-CB 4.22Å; P82-E87 WeakPolarHBondContact CG-OE2 3.08Å; N83-E87 VanDerWaalsContact O-CB 3.29Å; N83-E87 WeakPolarHBondContact O-CB 3.2Å; N83-E87 PolarHBondContact O-N 3.33Å; E87-R89 PolarHBondContact O-N 3.49Å; E87-F90 PolarHBondContact O-N 3.22Å; E87-R91 WeakPolarHBondContact O-CG 3.28Å; E87-R91 PolarHBondContact O-N 2.98Å; E87-R91 IonicContact OE1-CZ 2.68Å; E87-R91 VanDerWaalsContact OE1-CZ 3.24Å; E87-R91 IonicContact OE1-NE 2.98Å; E87-R91 PolarHBondContact OE1-NE 2.81Å; E87-R91 IonicContact OE1-NH2 3.3Å; E87-R91 PolarHBondContact OE1-NH2 3.43Å
88	K	91.5	Very high	90.2	Very high	166 Å²	166	89.8 Å²	89.8	72%	0.722	41%	0.406	S	S	*	.	H	α-helix	trans	-64	-41.9	177.6	-174	178.5	179.8	179.7	0	111.9	K84 Q85 A86 K92	K84-K88 PolarHBondContact O-N 3.42Å; Q85-K88 PolarHBondContact O-N 3.49Å; A86-K88 VanDerWaalsContact C-N 3.32Å; A86-K88 PolarHBondContact O-N 3.17Å; K88-K92 WeakPolarHBondContact O-CB 3.09Å; K88-K92 PolarHBondContact O-N 3.37Å
89	R	93.9	Very high	89.2	Confident	104 Å²	104	89.9 Å²	89.9	39%	0.392	41%	0.41	S	S	.	.	H	α-helix	trans	-65.1	-43	177.9	-175.2	169.3	55.3	99.8	-5.4	110.9	Q85 A86 E87 K92 H93 F103 S104 D110	Q85-R89 PolarHBondContact O-N 3.3Å; A86-R89 PolarHBondContact O-N 3.23Å; A86-R89 VanDerWaalsContact O-N 3.15Å; E87-R89 PolarHBondContact O-N 3.49Å; R89-K92 PolarHBondContact O-N 3.03Å; R89-H93 PolarHBondContact O-N 3.18Å; R89-F103 HydrophobicContact CB-CZ 4.34Å; R89-F103 HydrophobicContact CG-CE2 3.87Å; R89-F103 HydrophobicContact CG-CZ 3.94Å; R89-F103 VanDerWaalsContact NH1-CZ 3.32Å; R89-S104 PolarHBondContact NH1-O 3.43Å; R89-S104 VanDerWaalsContact NH1-O 3.12Å; R89-D110 IonicContact CZ-OD1 3.93Å; R89-D110 IonicContact CZ-OD2 3.9Å; R89-D110 IonicContact NH2-OD1 2.76Å; R89-D110 PolarHBondContact NH2-OD1 3.28Å; R89-D110 IonicContact NH2-OD2 2.67Å; R89-D110 PolarHBondContact NH2-OD2 3.36Å
90	F	91.3	Very high	88.3	Confident	3 Å²	3	89.9 Å²	89.9	1%	0.013	41%	0.413	C	S	.	.	H	α-helix	trans	-64.3	-48.3	177.9	-176	-121.8	0	0	0	112	A86 E87 K92 H93 Q94 C100 F103 W105 E135	A86-F90 WeakPolarHBondContact O-CB 3.48Å; A86-F90 PolarHBondContact O-N 3.05Å; E87-F90 PolarHBondContact O-N 3.22Å; F90-K92 VanDerWaalsContact C-N 3.33Å; F90-K92 PolarHBondContact O-N 3.15Å; F90-H93 WeakPolarHBondContact O-CB 3.2Å; F90-H93 PolarHBondContact O-N 3Å; F90-H93 VanDerWaalsContact O-N 3.09Å; F90-Q94 HydrophobicContact CD2-CG 4.48Å; F90-Q94 VanDerWaalsContact CE1-CD 3.43Å; F90-Q94 HydrophobicContact CE1-CG 4.21Å; F90-Q94 VanDerWaalsContact CE1-NE2 3.33Å; F90-Q94 HydrophobicContact CE2-CG 4.17Å; F90-Q94 HydrophobicContact CZ-CG 4.03Å; F90-Q94 WeakPolarHBondContact O-CG 3.2Å; F90-Q94 PolarHBondContact O-N 2.73Å; F90-C100 HydrophobicContact CE2-CB 3.86Å; F90-C100 HydrophobicContact CZ-CB 3.83Å; F90-F103 HydrophobicContact CB-CE1 4.3Å; F90-F103 HydrophobicContact CB-CE2 4.32Å; F90-F103 HydrophobicContact CB-CZ 3.97Å; F90-F103 HydrophobicContact CD2-CB 4.34Å; F90-F103 AromaticContact CD2-CD1 3.77Å; F90-F103 HydrophobicContact CD2-CD1 3.77Å; F90-F103 HydrophobicContact CD2-CD2 4.06Å; F90-F103 HydrophobicContact CD2-CE1 4Å; F90-F103 HydrophobicContact CD2-CE2 4.25Å; F90-F103 AromaticContact CD2-CG 3.78Å; F90-F103 HydrophobicContact CD2-CG 3.78Å; F90-F103 HydrophobicContact CD2-CZ 4.21Å; F90-F103 HydrophobicContact CE2-CB 4.36Å; F90-F103 HydrophobicContact CE2-CD1 4.36Å; F90-F103 HydrophobicContact CE2-CG 4.27Å; F90-W105 HydrophobicContact CB-CH2 3.59Å; F90-W105 HydrophobicContact CB-CZ2 4.03Å; F90-W105 HydrophobicContact CB-CZ3 4.42Å; F90-W105 AromaticContact CD1-CH2 3.95Å; F90-W105 HydrophobicContact CD1-CH2 3.95Å; F90-W105 AromaticContact CD1-CZ2 3.89Å; F90-W105 HydrophobicContact CD1-CZ2 3.89Å; F90-W105 AromaticContact CD2-CH2 3.87Å; F90-W105 HydrophobicContact CD2-CH2 3.87Å; F90-W105 AromaticContact CD2-CZ2 3.35Å; F90-W105 HydrophobicContact CD2-CZ2 3.35Å; F90-W105 HydrophobicContact CE1-CZ2 4.14Å; F90-W105 AromaticContact CE2-CZ2 3.65Å; F90-W105 HydrophobicContact CE2-CZ2 3.65Å; F90-W105 AromaticContact CG-CH2 3.53Å; F90-W105 HydrophobicContact CG-CH2 3.53Å; F90-W105 AromaticContact CG-CZ2 3.47Å; F90-W105 HydrophobicContact CG-CZ2 3.47Å; F90-W105 VanDerWaalsContact CG-CZ2 3.47Å; F90-W105 HydrophobicContact CZ-CZ2 4.04Å; F90-E135 WeakPolarHBondContact CZ-O 3.42Å
91	R	87	Confident	87.3	Confident	128 Å²	128	95.2 Å²	95.2	48%	0.483	44%	0.438	S	S	.	.	H	α-helix	trans	-57.8	-44.6	175	-72.7	-178.1	-172.2	-151.4	-0.4	112.3	E87 H93 Q94 H95	E87-R91 WeakPolarHBondContact O-CG 3.28Å; E87-R91 PolarHBondContact O-N 2.98Å; E87-R91 IonicContact OE1-CZ 2.68Å; E87-R91 VanDerWaalsContact OE1-CZ 3.24Å; E87-R91 IonicContact OE1-NE 2.98Å; E87-R91 PolarHBondContact OE1-NE 2.81Å; E87-R91 IonicContact OE1-NH2 3.3Å; E87-R91 PolarHBondContact OE1-NH2 3.43Å; R91-H93 VanDerWaalsContact C-N 3.29Å; R91-H93 PolarHBondContact O-N 3.43Å; R91-Q94 PolarHBondContact O-N 2.83Å; R91-H95 PolarHBondContact O-CD2 2.84Å; R91-H95 PolarHBondContact O-N 2.84Å
92	K	88	Confident	86.7	Confident	154 Å²	154	98.2 Å²	98.2	67%	0.67	46%	0.458	S	S	*	.	H	α-helix	trans	-58.3	-43.5	176.3	-173.6	-179.5	178.5	-175.7	0	111.1	K88 R89 F90 H95 T96	K88-K92 WeakPolarHBondContact O-CB 3.09Å; K88-K92 PolarHBondContact O-N 3.37Å; R89-K92 PolarHBondContact O-N 3.03Å; F90-K92 VanDerWaalsContact C-N 3.33Å; F90-K92 PolarHBondContact O-N 3.15Å; K92-H95 PolarHBondContact O-N 3.32Å; K92-T96 PolarHBondContact O-N 2.64Å; K92-T96 PolarHBondContact O-OG1 2.96Å; K92-T96 VanDerWaalsContact O-OG1 3.06Å
93	H	87.9	Confident	86.3	Confident	34 Å²	34	99 Å²	99	16%	0.157	46%	0.461	C	S	.	.	H	α-helix	trans	-61.6	-46.7	176.3	-174.6	84.9	0	0	0	112.2	R89 F90 R91 H95 T96 H97 S99 K101 F103	R89-H93 PolarHBondContact O-N 3.18Å; F90-H93 WeakPolarHBondContact O-CB 3.2Å; F90-H93 PolarHBondContact O-N 3Å; F90-H93 VanDerWaalsContact O-N 3.09Å; R91-H93 VanDerWaalsContact C-N 3.29Å; R91-H93 PolarHBondContact O-N 3.43Å; H93-H95 VanDerWaalsContact C-N 3.32Å; H93-H95 PolarHBondContact O-N 3.34Å; H93-T96 PolarHBondContact O-N 2.85Å; H93-H97 AromaticContact CE1-CE1 3.68Å; H93-H97 AromaticContact CE1-CG 3.86Å; H93-H97 AromaticContact CE1-ND1 3.32Å; H93-H97 PolarHBondContact CE1-ND1 2.91Å; H93-H97 VanDerWaalsContact CE1-ND1 3.32Å; H93-H97 AromaticContact CG-ND1 3.76Å; H93-H97 AromaticContact ND1-CE1 3.55Å; H93-H97 AromaticContact ND1-ND1 3.22Å; H93-H97 PolarHBondContact ND1-ND1 2.81Å; H93-H97 AromaticContact NE2-ND1 3.87Å; H93-H97 PolarHBondContact O-N 2.82Å; H93-H97 PolarHBondContact O-ND1 3.06Å; H93-S99 PolarHBondContact CD2-O 2.95Å; H93-S99 VanDerWaalsContact CD2-O 3.31Å; H93-K101 PolarHBondContact NE2-O 2.97Å; H93-F103 HydrophobicContact CB-CD2 3.57Å; H93-F103 HydrophobicContact CB-CE2 3.92Å; H93-F103 AromaticContact CD2-CD2 3.92Å; H93-F103 AromaticContact CG-CD2 3.58Å
94	Q	85.3	Confident	85.8	Confident	63 Å²	63	101.5 Å²	101.5	29%	0.294	48%	0.482	S	S	.	.	H	α-helix	trans	-59.3	-42.5	177.8	-71	-179.7	-53.4	0	0	111.8	F90 R91 K98	F90-Q94 HydrophobicContact CD2-CG 4.48Å; F90-Q94 VanDerWaalsContact CE1-CD 3.43Å; F90-Q94 HydrophobicContact CE1-CG 4.21Å; F90-Q94 VanDerWaalsContact CE1-NE2 3.33Å; F90-Q94 HydrophobicContact CE2-CG 4.17Å; F90-Q94 HydrophobicContact CZ-CG 4.03Å; F90-Q94 WeakPolarHBondContact O-CG 3.2Å; F90-Q94 PolarHBondContact O-N 2.73Å; R91-Q94 PolarHBondContact O-N 2.83Å; Q94-K98 WeakPolarHBondContact O-CA 3.48Å; Q94-K98 PolarHBondContact O-N 3.42Å
95	H	82	Confident	85.6	Confident	156 Å²	156	94.6 Å²	94.6	72%	0.722	45%	0.45	S	S	*	.	H	α-helix	trans	-65	-42.4	176.1	-74.4	-64.2	0	0	0	112.7	R91 K92 H93	R91-H95 PolarHBondContact O-CD2 2.84Å; R91-H95 PolarHBondContact O-N 2.84Å; K92-H95 PolarHBondContact O-N 3.32Å; H93-H95 VanDerWaalsContact C-N 3.32Å; H93-H95 PolarHBondContact O-N 3.34Å
96	T	84	Confident	85.4	Confident	95 Å²	95	90 Å²	90	58%	0.583	43%	0.431	S	S	*	.	H	α-helix	trans	-71.5	-44.4	-177.8	-59.4	0	0	0	0	112.6	K92 H93	K92-T96 PolarHBondContact O-N 2.64Å; K92-T96 PolarHBondContact O-OG1 2.96Å; K92-T96 VanDerWaalsContact O-OG1 3.06Å; H93-T96 PolarHBondContact O-N 2.85Å
97	H	79.4	Confident	84.8	Confident	116 Å²	116	91.2 Å²	91.2	54%	0.537	44%	0.438	S	S	.	.	H	α-helix	trans	-101.4	-5.1	-170.8	-61.1	91.8	0	0	0	113.5	H93 S99	H93-H97 AromaticContact CE1-CE1 3.68Å; H93-H97 AromaticContact CE1-CG 3.86Å; H93-H97 AromaticContact CE1-ND1 3.32Å; H93-H97 PolarHBondContact CE1-ND1 2.91Å; H93-H97 VanDerWaalsContact CE1-ND1 3.32Å; H93-H97 AromaticContact CG-ND1 3.76Å; H93-H97 AromaticContact ND1-CE1 3.55Å; H93-H97 AromaticContact ND1-ND1 3.22Å; H93-H97 PolarHBondContact ND1-ND1 2.81Å; H93-H97 AromaticContact NE2-ND1 3.87Å; H93-H97 PolarHBondContact O-N 2.82Å; H93-H97 PolarHBondContact O-ND1 3.06Å; H97-S99 PolarHBondContact O-N 3.15Å
98	K	76.4	Confident	84.4	Confident	197 Å²	197	96.6 Å²	96.6	86%	0.857	46%	0.463	S	S	*	.	S	Bend	trans	48.4	28.5	-170.9	-61.3	-173.9	178	-176.6	0	112.8	Q94	Q94-K98 WeakPolarHBondContact O-CA 3.48Å; Q94-K98 PolarHBondContact O-N 3.42Å
99	S	74.3	Confident	84.4	Confident	42 Å²	42	95.3 Å²	95.3	29%	0.294	46%	0.46	S	S	.	.	S	Bend	trans	-154.7	148.5	-175.5	-165.3	0	0	0	0	109.6	H93 H97 K101	H93-S99 PolarHBondContact CD2-O 2.95Å; H93-S99 VanDerWaalsContact CD2-O 3.31Å; H97-S99 PolarHBondContact O-N 3.15Å; S99-K101 VanDerWaalsContact C-N 3.34Å; S99-K101 WeakPolarHBondContact OG-CB 3.34Å; S99-K101 WeakPolarHBondContact OG-CG 3.45Å; S99-K101 PolarHBondContact OG-N 3.46Å; S99-K101 VanDerWaalsContact OG-N 3.12Å
100	C	77	Confident	84.4	Confident	47 Å²	47	91 Å²	91	32%	0.318	44%	0.444	S	S	.	.			trans	-90.2	-3.9	166	63.6	0	0	0	0	112.2	F90 F103	F90-C100 HydrophobicContact CE2-CB 3.86Å; F90-C100 HydrophobicContact CZ-CB 3.83Å; C100-F103 PolarHBondContact O-N 2.93Å
101	K	75.1	Confident	84.6	Confident	153 Å²	153	91.3 Å²	91.3	67%	0.665	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	145.5	176.7	-67.3	-178	179.9	-177.7	0	109.6	H93 S99 F103	H93-K101 PolarHBondContact NE2-O 2.97Å; S99-K101 VanDerWaalsContact C-N 3.34Å; S99-K101 WeakPolarHBondContact OG-CB 3.34Å; S99-K101 WeakPolarHBondContact OG-CG 3.45Å; S99-K101 PolarHBondContact OG-N 3.46Å; S99-K101 VanDerWaalsContact OG-N 3.12Å; K101-F103 PolarHBondContact O-N 3.29Å; K101-F103 VanDerWaalsContact O-N 3.08Å
102	D	81.3	Confident	85	Confident	161 Å²	161	90.9 Å²	90.9	86%	0.861	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.2	7.4	176.9	-44.3	-44.9	0	0	0	115.8	S104	D102-S104 PolarHBondContact O-N 2.97Å
103	F	86.5	Confident	85.3	Confident	25 Å²	25	92.4 Å²	92.4	11%	0.11	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-73.3	117.6	169.8	-170.6	-92.7	0	0	0	110.6	R89 F90 H93 C100 K101 W105	R89-F103 HydrophobicContact CB-CZ 4.34Å; R89-F103 HydrophobicContact CG-CE2 3.87Å; R89-F103 HydrophobicContact CG-CZ 3.94Å; R89-F103 VanDerWaalsContact NH1-CZ 3.32Å; F90-F103 HydrophobicContact CB-CE1 4.3Å; F90-F103 HydrophobicContact CB-CE2 4.32Å; F90-F103 HydrophobicContact CB-CZ 3.97Å; F90-F103 HydrophobicContact CD2-CB 4.34Å; F90-F103 AromaticContact CD2-CD1 3.77Å; F90-F103 HydrophobicContact CD2-CD1 3.77Å; F90-F103 HydrophobicContact CD2-CD2 4.06Å; F90-F103 HydrophobicContact CD2-CE1 4Å; F90-F103 HydrophobicContact CD2-CE2 4.25Å; F90-F103 AromaticContact CD2-CG 3.78Å; F90-F103 HydrophobicContact CD2-CG 3.78Å; F90-F103 HydrophobicContact CD2-CZ 4.21Å; F90-F103 HydrophobicContact CE2-CB 4.36Å; F90-F103 HydrophobicContact CE2-CD1 4.36Å; F90-F103 HydrophobicContact CE2-CG 4.27Å; H93-F103 HydrophobicContact CB-CD2 3.57Å; H93-F103 HydrophobicContact CB-CE2 3.92Å; H93-F103 AromaticContact CD2-CD2 3.92Å; H93-F103 AromaticContact CG-CD2 3.58Å; C100-F103 PolarHBondContact O-N 2.93Å; K101-F103 PolarHBondContact O-N 3.29Å; K101-F103 VanDerWaalsContact O-N 3.08Å; F103-W105 AromaticContact CD1-CD1 3.8Å; F103-W105 AromaticContact CD1-CD2 3.7Å; F103-W105 HydrophobicContact CD1-CD2 3.7Å; F103-W105 AromaticContact CD1-CE2 3.47Å; F103-W105 VanDerWaalsContact CD1-CE2 3.47Å; F103-W105 HydrophobicContact CD1-CE3 4.31Å; F103-W105 AromaticContact CD1-CG 3.93Å; F103-W105 HydrophobicContact CD1-CG 3.93Å; F103-W105 AromaticContact CD1-CZ2 3.95Å; F103-W105 HydrophobicContact CD1-CZ2 3.95Å; F103-W105 AromaticContact CD1-NE1 3.53Å; F103-W105 AromaticContact CE1-CD2 3.51Å; F103-W105 HydrophobicContact CE1-CD2 3.51Å; F103-W105 AromaticContact CE1-CE2 3.6Å; F103-W105 AromaticContact CE1-CE3 3.65Å; F103-W105 HydrophobicContact CE1-CE3 3.65Å; F103-W105 HydrophobicContact CE1-CG 4.07Å; F103-W105 AromaticContact CE1-CH2 4Å; F103-W105 HydrophobicContact CE1-CH2 4Å; F103-W105 AromaticContact CE1-CZ2 3.87Å; F103-W105 HydrophobicContact CE1-CZ2 3.87Å; F103-W105 AromaticContact CE1-CZ3 3.89Å; F103-W105 HydrophobicContact CE1-CZ3 3.89Å
104	S	86.6	Confident	85.6	Confident	94 Å²	94	92.9 Å²	92.9	66%	0.657	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-86.6	116	175.8	-167	0	0	0	0	111.1	R89 D102	R89-S104 PolarHBondContact NH1-O 3.43Å; R89-S104 VanDerWaalsContact NH1-O 3.12Å; D102-S104 PolarHBondContact O-N 2.97Å
105	W	89.3	Confident	86	Confident	45 Å²	45	93.1 Å²	93.1	17%	0.17	47%	0.472	C	S	.	.	P	Polyproline II helix	trans	-89	133.8	171.4	-66.6	99.9	0	0	0	110.6	P82 A86 F90 F103 D110 F111 P133	P82-W105 HydrophobicContact CB-CH2 4.21Å; P82-W105 HydrophobicContact CB-CZ3 3.89Å; P82-W105 HydrophobicContact CG-CH2 4.45Å; A86-W105 HydrophobicContact CB-CZ3 4.15Å; F90-W105 HydrophobicContact CB-CH2 3.59Å; F90-W105 HydrophobicContact CB-CZ2 4.03Å; F90-W105 HydrophobicContact CB-CZ3 4.42Å; F90-W105 AromaticContact CD1-CH2 3.95Å; F90-W105 HydrophobicContact CD1-CH2 3.95Å; F90-W105 AromaticContact CD1-CZ2 3.89Å; F90-W105 HydrophobicContact CD1-CZ2 3.89Å; F90-W105 AromaticContact CD2-CH2 3.87Å; F90-W105 HydrophobicContact CD2-CH2 3.87Å; F90-W105 AromaticContact CD2-CZ2 3.35Å; F90-W105 HydrophobicContact CD2-CZ2 3.35Å; F90-W105 HydrophobicContact CE1-CZ2 4.14Å; F90-W105 AromaticContact CE2-CZ2 3.65Å; F90-W105 HydrophobicContact CE2-CZ2 3.65Å; F90-W105 AromaticContact CG-CH2 3.53Å; F90-W105 HydrophobicContact CG-CH2 3.53Å; F90-W105 AromaticContact CG-CZ2 3.47Å; F90-W105 HydrophobicContact CG-CZ2 3.47Å; F90-W105 VanDerWaalsContact CG-CZ2 3.47Å; F90-W105 HydrophobicContact CZ-CZ2 4.04Å; F103-W105 AromaticContact CD1-CD1 3.8Å; F103-W105 AromaticContact CD1-CD2 3.7Å; F103-W105 HydrophobicContact CD1-CD2 3.7Å; F103-W105 AromaticContact CD1-CE2 3.47Å; F103-W105 VanDerWaalsContact CD1-CE2 3.47Å; F103-W105 HydrophobicContact CD1-CE3 4.31Å; F103-W105 AromaticContact CD1-CG 3.93Å; F103-W105 HydrophobicContact CD1-CG 3.93Å; F103-W105 AromaticContact CD1-CZ2 3.95Å; F103-W105 HydrophobicContact CD1-CZ2 3.95Å; F103-W105 AromaticContact CD1-NE1 3.53Å; F103-W105 AromaticContact CE1-CD2 3.51Å; F103-W105 HydrophobicContact CE1-CD2 3.51Å; F103-W105 AromaticContact CE1-CE2 3.6Å; F103-W105 AromaticContact CE1-CE3 3.65Å; F103-W105 HydrophobicContact CE1-CE3 3.65Å; F103-W105 HydrophobicContact CE1-CG 4.07Å; F103-W105 AromaticContact CE1-CH2 4Å; F103-W105 HydrophobicContact CE1-CH2 4Å; F103-W105 AromaticContact CE1-CZ2 3.87Å; F103-W105 HydrophobicContact CE1-CZ2 3.87Å; F103-W105 AromaticContact CE1-CZ3 3.89Å; F103-W105 HydrophobicContact CE1-CZ3 3.89Å; W105-D110 HydrophobicContact CE3-CB 3.96Å; W105-D110 HydrophobicContact CZ3-CB 4.39Å; W105-F111 HydrophobicContact CB-CE2 4.25Å; W105-F111 HydrophobicContact CD2-CE2 4.11Å; W105-F111 HydrophobicContact CD2-CZ 4.01Å; W105-F111 AromaticContact CE3-CE2 3.67Å; W105-F111 HydrophobicContact CE3-CE2 3.67Å; W105-F111 AromaticContact CE3-CZ 3.74Å; W105-F111 HydrophobicContact CE3-CZ 3.74Å; W105-F111 HydrophobicContact CG-CE2 4.39Å; W105-F111 HydrophobicContact CG-CZ 4.48Å; W105-F111 HydrophobicContact CZ3-CE2 4.37Å; W105-F111 HydrophobicContact CZ3-CZ 4.16Å; W105-P133 HydrophobicContact CB-CG 4.49Å; W105-P133 HydrophobicContact CD2-CG 3.92Å; W105-P133 HydrophobicContact CG-CG 3.68Å; W105-P133 VanDerWaalsContact NE1-CG 3.31Å
106	N	88.8	Confident	86.6	Confident	60 Å²	60	95.4 Å²	95.4	32%	0.321	48%	0.483	S	S	.	.			trans	-93.7	98.3	161.5	-175.7	-16.9	0	0	0	108.1	E108 E109 D110	N106-E108 PolarHBondContact O-N 3.34Å; N106-E108 VanDerWaalsContact O-N 3.13Å; N106-E108 PolarHBondContact OD1-N 3.13Å; N106-E109 HydrophobicContact CB-CB 4.35Å; N106-E109 WeakPolarHBondContact ND2-CG 3.44Å; N106-E109 PolarHBondContact ND2-OE2 3.33Å; N106-E109 PolarHBondContact O-N 3.45Å; N106-E109 PolarHBondContact OD1-N 2.78Å; N106-D110 PolarHBondContact N-OD2 3.23Å; N106-D110 WeakPolarHBondContact O-CB 3.39Å; N106-D110 PolarHBondContact O-N 3.2Å
107	V	83.3	Confident	87.1	Confident	27 Å²	27	92.3 Å²	92.3	16%	0.164	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-27.4	-172.7	176.4	0	0	0	0	113.2	R80	R80-V107 PolarHBondContact NH2-O 3.33Å
108	E	84.7	Confident	88	Confident	158 Å²	158	88.2 Å²	88.2	74%	0.738	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-45.1	179.9	-63.9	-176.9	175.6	0	0	111.6	N106	N106-E108 PolarHBondContact O-N 3.34Å; N106-E108 VanDerWaalsContact O-N 3.13Å; N106-E108 PolarHBondContact OD1-N 3.13Å
109	E	90.2	Very high	88.9	Confident	139 Å²	139	81.5 Å²	81.5	65%	0.65	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-38	-173.7	-65	178.1	168.9	0	0	113.1	N83 N106 F111	N83-E109 PolarHBondContact ND2-O 3.47Å; N106-E109 HydrophobicContact CB-CB 4.35Å; N106-E109 WeakPolarHBondContact ND2-CG 3.44Å; N106-E109 PolarHBondContact ND2-OE2 3.33Å; N106-E109 PolarHBondContact O-N 3.45Å; N106-E109 PolarHBondContact OD1-N 2.78Å; E109-F111 VanDerWaalsContact C-N 3.3Å; E109-F111 PolarHBondContact O-N 2.9Å
110	D	94.6	Very high	89.9	Confident	13 Å²	13	81.4 Å²	81.4	7%	0.07	42%	0.416	C	S	.	.	S	Bend	trans	-77.2	-12.9	-168.7	-76.2	-35.6	0	0	0	113.7	P82 N83 A86 R89 W105 N106	P82-D110 CarbonylContact C-O 3.45Å; P82-D110 WeakPolarHBondContact CA-O 3.2Å; N83-D110 PolarHBondContact N-O 2.92Å; N83-D110 WeakPolarHBondContact ND2-CA 3.26Å; N83-D110 PolarHBondContact ND2-O 2.91Å; A86-D110 HydrophobicContact CB-CB 3.53Å; A86-D110 VanDerWaalsContact CB-O 3.23Å; A86-D110 WeakPolarHBondContact CB-O 3.34Å; A86-D110 WeakPolarHBondContact CB-OD1 3.42Å; R89-D110 IonicContact CZ-OD1 3.93Å; R89-D110 IonicContact CZ-OD2 3.9Å; R89-D110 IonicContact NH2-OD1 2.76Å; R89-D110 PolarHBondContact NH2-OD1 3.28Å; R89-D110 IonicContact NH2-OD2 2.67Å; R89-D110 PolarHBondContact NH2-OD2 3.36Å; W105-D110 HydrophobicContact CE3-CB 3.96Å; W105-D110 HydrophobicContact CZ3-CB 4.39Å; N106-D110 PolarHBondContact N-OD2 3.23Å; N106-D110 WeakPolarHBondContact O-CB 3.39Å; N106-D110 PolarHBondContact O-N 3.2Å
111	F	95.2	Very high	90.8	Very high	10 Å²	10	79.2 Å²	79.2	4%	0.044	40%	0.402	C	S	.	.	B	Isolated β-bridge	trans	-116.3	149.4	-169.6	-71.8	-95.7	0	0	0	113.1	R80 W105 E109 P133 G137 I139	R80-F111 HydrophobicContact CG-CB 4.06Å; R80-F111 HydrophobicContact CG-CD1 4.1Å; R80-F111 HydrophobicContact CG-CG 4.47Å; W105-F111 HydrophobicContact CB-CE2 4.25Å; W105-F111 HydrophobicContact CD2-CE2 4.11Å; W105-F111 HydrophobicContact CD2-CZ 4.01Å; W105-F111 AromaticContact CE3-CE2 3.67Å; W105-F111 HydrophobicContact CE3-CE2 3.67Å; W105-F111 AromaticContact CE3-CZ 3.74Å; W105-F111 HydrophobicContact CE3-CZ 3.74Å; W105-F111 HydrophobicContact CG-CE2 4.39Å; W105-F111 HydrophobicContact CG-CZ 4.48Å; W105-F111 HydrophobicContact CZ3-CE2 4.37Å; W105-F111 HydrophobicContact CZ3-CZ 4.16Å; E109-F111 VanDerWaalsContact C-N 3.3Å; E109-F111 PolarHBondContact O-N 2.9Å; F111-P133 HydrophobicContact CE1-CB 4.24Å; F111-P133 HydrophobicContact CZ-CB 3.88Å; F111-P133 HydrophobicContact CZ-CG 3.83Å; F111-G137 VanDerWaalsContact CE1-O 3.28Å; F111-G137 WeakPolarHBondContact CE1-O 3.34Å; F111-I139 HydrophobicContact CD1-CD1 3.97Å; F111-I139 HydrophobicContact CD1-CG1 4.47Å; F111-I139 HydrophobicContact CE1-CD1 3.73Å; F111-I139 HydrophobicContact CE1-CG1 3.92Å; F111-I139 HydrophobicContact CE2-CD1 4.47Å; F111-I139 HydrophobicContact CG-CD1 4.45Å; F111-I139 HydrophobicContact CZ-CD1 4.02Å; F111-I139 HydrophobicContact CZ-CG1 4.37Å
112	K	95.2	Very high	91.5	Very high	119 Å²	119	77.9 Å²	77.9	52%	0.517	40%	0.397	S	S	.	.			trans	-63	149.1	172.4	-63.3	-178.3	-177.3	179.5	0	110.5	R80 K81	R80-K112 PolarHBondContact NE-O 3.33Å; K81-K112 PolarHBondContact O-N 3.49Å
113	M	93.8	Very high	91.8	Very high	186 Å²	186	75.6 Å²	75.6	92%	0.916	38%	0.377	S	S	*	.			trans	-64.6	144.8	170.7	-62.7	-168.4	-59.8	0	0	110.2
114	V	94.5	Very high	92	Very high	44 Å²	44	75 Å²	75	27%	0.267	38%	0.375	S	S	.	.			trans	-122.8	157.5	172.9	-68.9	0	0	0	0	108.5	R80 W118	R80-V114 HydrophobicContact CB-CG1 3.85Å; R80-V114 HydrophobicContact CG-CG1 3.79Å; V114-W118 HydrophobicContact CB-CB 3.81Å; V114-W118 HydrophobicContact CB-CD2 4.24Å; V114-W118 HydrophobicContact CB-CG 3.76Å; V114-W118 HydrophobicContact CG1-CD2 4.42Å; V114-W118 HydrophobicContact CG1-CG 4.18Å; V114-W118 HydrophobicContact CG2-CB 3.77Å; V114-W118 HydrophobicContact CG2-CD2 3.82Å; V114-W118 HydrophobicContact CG2-CE3 3.97Å; V114-W118 HydrophobicContact CG2-CG 3.75Å
115	P	94.4	Very high	92.2	Very high	69 Å²	69	77.7 Å²	77.7	45%	0.448	38%	0.375	S	S	.	.			trans	-57.9	153.4	174.2	-23	34.3	0	0	0	112	S117 W118 V143	P115-S117 PolarHBondContact O-N 2.67Å; P115-W118 WeakPolarHBondContact O-CB 3.42Å; P115-W118 PolarHBondContact O-N 2.95Å; P115-V143 HydrophobicContact CG-CG1 4.3Å
116	E	94.1	Very high	92.3	Very high	204 Å²	204	80.1 Å²	80.1	95%	0.953	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-29.4	176.8	-67.2	-177.3	171.2	0	0	113	W118	E116-W118 PolarHBondContact O-N 2.84Å
117	S	95.5	Very high	92.2	Very high	30 Å²	30	80.2 Å²	80.2	21%	0.21	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-2.4	176.1	58	0	0	0	0	113.8	W75 P115 P144	W75-S117 VanDerWaalsContact CZ3-O 3.29Å; W75-S117 WeakPolarHBondContact CZ3-O 3.45Å; P115-S117 PolarHBondContact O-N 2.67Å; S117-P144 WeakPolarHBondContact OG-CD 3.15Å
118	W	96.5	Very high	92.3	Very high	29 Å²	29	86.4 Å²	86.4	11%	0.11	43%	0.425	C	S	.	.			trans	-68.9	134.3	177.5	-179.6	92.2	0	0	0	111.1	L78 R80 V114 P115 E116 P120 P131 I139 W142 V143	L78-W118 PolarHBondContact O-NE1 3.09Å; R80-W118 HydrophobicContact CB-CZ2 4.06Å; V114-W118 HydrophobicContact CB-CB 3.81Å; V114-W118 HydrophobicContact CB-CD2 4.24Å; V114-W118 HydrophobicContact CB-CG 3.76Å; V114-W118 HydrophobicContact CG1-CD2 4.42Å; V114-W118 HydrophobicContact CG1-CG 4.18Å; V114-W118 HydrophobicContact CG2-CB 3.77Å; V114-W118 HydrophobicContact CG2-CD2 3.82Å; V114-W118 HydrophobicContact CG2-CE3 3.97Å; V114-W118 HydrophobicContact CG2-CG 3.75Å; P115-W118 WeakPolarHBondContact O-CB 3.42Å; P115-W118 PolarHBondContact O-N 2.95Å; E116-W118 PolarHBondContact O-N 2.84Å; W118-P120 HydrophobicContact CH2-CB 3.8Å; W118-P120 HydrophobicContact CZ3-CB 4.09Å; W118-P120 HydrophobicContact CZ3-CG 4.42Å; W118-P131 HydrophobicContact CH2-CG 4.46Å; W118-P131 HydrophobicContact CZ3-CG 4.49Å; W118-I139 HydrophobicContact CH2-CG2 3.75Å; W118-I139 HydrophobicContact CZ2-CG2 4.1Å; W118-W142 VanDerWaalsContact CA-O 3.31Å; W118-W142 WeakPolarHBondContact CA-O 3.25Å; W118-V143 HydrophobicContact CB-CG1 3.92Å; W118-V143 HydrophobicContact CG-CG1 4.25Å
119	I	95.8	Very high	92.3	Very high	56 Å²	56	82 Å²	82	29%	0.287	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	142.9	174.3	64.3	176.2	0	0	0	110.6	W75 G141 W142	W75-I119 HydrophobicContact CE3-CD1 4.07Å; W75-I119 HydrophobicContact CE3-CG1 4.11Å; W75-I119 HydrophobicContact CH2-CD1 3.89Å; W75-I119 HydrophobicContact CH2-CG1 4.28Å; W75-I119 HydrophobicContact CH2-CG2 4.28Å; W75-I119 HydrophobicContact CZ2-CD1 4.36Å; W75-I119 HydrophobicContact CZ3-CD1 3.72Å; W75-I119 HydrophobicContact CZ3-CG1 3.69Å; W75-I119 HydrophobicContact CZ3-CG2 4.2Å; I119-G141 CarbonylContact O-C 3.48Å; I119-G141 WeakPolarHBondContact O-CA 3.25Å; I119-W142 HydrophobicContact CD1-CB 4.45Å; I119-W142 HydrophobicContact CG1-CB 3.88Å; I119-W142 HydrophobicContact CG1-CG 4.49Å; I119-W142 PolarHBondContact N-O 2.89Å; I119-W142 PolarHBondContact O-N 3.2Å
120	P	95.8	Very high	92.2	Very high	41 Å²	41	80.3 Å²	80.3	27%	0.266	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	147.1	172.1	28.7	-33.4	0	0	0	110.2	W118 V124 P131	W118-P120 HydrophobicContact CH2-CB 3.8Å; W118-P120 HydrophobicContact CZ3-CB 4.09Å; W118-P120 HydrophobicContact CZ3-CG 4.42Å; P120-V124 HydrophobicContact CB-CB 4.32Å; P120-V124 HydrophobicContact CB-CG1 4.42Å; P120-P131 HydrophobicContact CB-CB 4.08Å; P120-P131 HydrophobicContact CB-CG 4.47Å
121	A	95.2	Very high	92.1	Very high	1 Å²	1	80.6 Å²	80.6	1%	0.008	42%	0.417	C	S	.	.			trans	-66.6	148.7	174	0	0	0	0	0	111	Q8 R123 V124 P140 W142	Q8-A121 HydrophobicContact CB-CB 4.4Å; Q8-A121 WeakPolarHBondContact O-CB 3.1Å; A121-R123 PolarHBondContact O-N 2.95Å; A121-V124 HydrophobicContact CB-CG2 4.04Å; A121-V124 VanDerWaalsContact O-CB 3.27Å; A121-V124 WeakPolarHBondContact O-CB 3.13Å; A121-V124 VanDerWaalsContact O-CG2 3.3Å; A121-V124 WeakPolarHBondContact O-CG2 3.47Å; A121-V124 PolarHBondContact O-N 3.13Å; A121-P140 HydrophobicContact CB-CB 3.76Å; A121-P140 PolarHBondContact N-O 3.21Å; A121-W142 HydrophobicContact CB-CZ2 4.39Å; A121-W142 VanDerWaalsContact CB-NE1 3.33Å
122	H	89.8	Confident	91.9	Very high	124 Å²	124	83 Å²	83	57%	0.574	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-30.7	-166.1	-81.2	82.2	0	0	0	114.7	Q8 Y64	Q8-H122 HydrophobicContact CG-CB 4.25Å; Y64-H122 AromaticContact CZ-CE1 3.87Å; Y64-H122 PolarHBondContact OH-CE1 2.84Å
123	R	87.4	Confident	91.7	Very high	114 Å²	114	78.2 Å²	78.2	43%	0.43	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	4.1	-179.4	-66.9	-172.5	177.3	-172.9	0.5	113.2	Q8 Q9 A121 K125 G259	Q8-R123 HydrophobicContact CB-CB 3.82Å; Q8-R123 HydrophobicContact CB-CG 3.87Å; Q8-R123 HydrophobicContact CG-CG 4.41Å; Q9-R123 HydrophobicContact CG-CB 3.84Å; Q9-R123 PolarHBondContact NE2-O 3.38Å; A121-R123 PolarHBondContact O-N 2.95Å; R123-K125 PolarHBondContact O-N 3.03Å; R123-G259 PolarHBondContact NH1-O 3.21Å
124	V	91.4	Very high	91.5	Very high	11 Å²	11	71.2 Å²	71.2	7%	0.067	38%	0.377	C	S	.	.			trans	-62.7	130.5	174.4	171.6	0	0	0	0	109.6	P120 A121 H126 P131 I139 P140	P120-V124 HydrophobicContact CB-CB 4.32Å; P120-V124 HydrophobicContact CB-CG1 4.42Å; A121-V124 HydrophobicContact CB-CG2 4.04Å; A121-V124 VanDerWaalsContact O-CB 3.27Å; A121-V124 WeakPolarHBondContact O-CB 3.13Å; A121-V124 VanDerWaalsContact O-CG2 3.3Å; A121-V124 WeakPolarHBondContact O-CG2 3.47Å; A121-V124 PolarHBondContact O-N 3.13Å; V124-H126 PolarHBondContact O-CE1 3.37Å; V124-H126 PolarHBondContact O-ND1 3.29Å; V124-P131 HydrophobicContact CG1-CB 3.61Å; V124-I139 HydrophobicContact CG1-CG2 3.98Å; V124-P140 HydrophobicContact CG2-CB 3.59Å; V124-P140 HydrophobicContact CG2-CG 4.1Å; V124-P140 WeakPolarHBondContact CG2-O 3.39Å
125	K	90.6	Very high	91.1	Very high	151 Å²	151	74.9 Å²	74.9	66%	0.657	39%	0.391	S	S	*	.			trans	-68.2	148.7	176.2	-67.6	-178.9	-179.5	178.6	0	109.5	R123 P131 I132	R123-K125 PolarHBondContact O-N 3.03Å; K125-P131 WeakPolarHBondContact O-CA 3.45Å; K125-I132 HydrophobicContact CB-CD1 3.69Å; K125-I132 HydrophobicContact CB-CG1 3.53Å; K125-I132 HydrophobicContact CD-CD1 4.42Å; K125-I132 WeakPolarHBondContact O-CG1 3.24Å; K125-I132 PolarHBondContact O-N 2.88Å
126	H	90.9	Very high	90.6	Very high	97 Å²	97	74.8 Å²	74.8	45%	0.449	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	146.5	177.5	-70.5	69.4	0	0	0	110.6	V124 H130	V124-H126 PolarHBondContact O-CE1 3.37Å; V124-H126 PolarHBondContact O-ND1 3.29Å; H126-H130 CarbonylContact C-O 3.5Å; H126-H130 WeakPolarHBondContact CA-O 3.36Å
127	S	88	Confident	90.4	Very high	62 Å²	62	65.1 Å²	65.1	43%	0.434	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	127.5	170.9	-175.3	0	0	0	0	108.3	G129 H130	S127-G129 PolarHBondContact O-N 2.9Å; S127-G129 VanDerWaalsContact O-N 3.15Å; S127-H130 PolarHBondContact N-O 3.06Å; S127-H130 PolarHBondContact O-N 2.58Å
128	N	85.4	Confident	90.3	Very high	156 Å²	156	65.7 Å²	65.7	83%	0.834	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	37.6	-175	-59.3	-25.9	0	0	0	113.6	H130	N128-H130 VanDerWaalsContact C-N 3.26Å; N128-H130 PolarHBondContact O-CD2 2.93Å; N128-H130 VanDerWaalsContact O-CD2 3.25Å; N128-H130 PolarHBondContact O-N 3.01Å
129	G	84.6	Confident	90.2	Very high	66 Å²	66	64.3 Å²	64.3	68%	0.68	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	80	-4.2	-178.8	0	0	0	0	0	115.5	S127	S127-G129 PolarHBondContact O-N 2.9Å; S127-G129 VanDerWaalsContact O-N 3.15Å
130	H	87.4	Confident	90.2	Very high	104 Å²	104	61.9 Å²	61.9	48%	0.481	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	140.5	178.7	-62.4	-79	0	0	0	111.9	H126 S127 N128	H126-H130 CarbonylContact C-O 3.5Å; H126-H130 WeakPolarHBondContact CA-O 3.36Å; S127-H130 PolarHBondContact N-O 3.06Å; S127-H130 PolarHBondContact O-N 2.58Å; N128-H130 VanDerWaalsContact C-N 3.26Å; N128-H130 PolarHBondContact O-CD2 2.93Å; N128-H130 VanDerWaalsContact O-CD2 3.25Å; N128-H130 PolarHBondContact O-N 3.01Å
131	P	92.3	Very high	90.2	Very high	18 Å²	18	60 Å²	60	12%	0.117	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	135.2	176	28.4	-34.2	0	0	0	110.4	W118 P120 V124 K125 I139	W118-P131 HydrophobicContact CH2-CG 4.46Å; W118-P131 HydrophobicContact CZ3-CG 4.49Å; P120-P131 HydrophobicContact CB-CB 4.08Å; P120-P131 HydrophobicContact CB-CG 4.47Å; V124-P131 HydrophobicContact CG1-CB 3.61Å; K125-P131 WeakPolarHBondContact O-CA 3.45Å; P131-I139 HydrophobicContact CB-CG2 3.84Å; P131-I139 HydrophobicContact CG-CG2 4.31Å
132	I	91.1	Very high	90.3	Very high	60 Å²	60	59.9 Å²	59.9	31%	0.308	31%	0.308	S	S	.	.			trans	-105	148.3	177.7	63.5	166.9	0	0	0	111.1	K125	K125-I132 HydrophobicContact CB-CD1 3.69Å; K125-I132 HydrophobicContact CB-CG1 3.53Å; K125-I132 HydrophobicContact CD-CD1 4.42Å; K125-I132 WeakPolarHBondContact O-CG1 3.24Å; K125-I132 PolarHBondContact O-N 2.88Å
133	P	91.8	Very high	90.7	Very high	20 Å²	20	54.2 Å²	54.2	13%	0.13	28%	0.283	C	S	.	.			trans	-67.4	157.5	179	29	-37.5	0	0	0	113	W105 F111 G137 H138 I139	W105-P133 HydrophobicContact CB-CG 4.49Å; W105-P133 HydrophobicContact CD2-CG 3.92Å; W105-P133 HydrophobicContact CG-CG 3.68Å; W105-P133 VanDerWaalsContact NE1-CG 3.31Å; F111-P133 HydrophobicContact CE1-CB 4.24Å; F111-P133 HydrophobicContact CZ-CB 3.88Å; F111-P133 HydrophobicContact CZ-CG 3.83Å; P133-G137 VanDerWaalsContact CB-C 3.46Å; P133-H138 CarbonylContact C-O 3.52Å; P133-H138 VanDerWaalsContact CA-O 3.29Å; P133-H138 WeakPolarHBondContact CA-O 3.43Å; P133-I139 HydrophobicContact CB-CG1 3.95Å
134	D	89.9	Confident	91.2	Very high	39 Å²	39	49 Å²	49	21%	0.209	26%	0.263	C	S	.	.			trans	-72	-179.4	168	71.1	12.4	0	0	0	112.1	H136 G137 H138	D134-H136 PolarHBondContact O-N 3.37Å; D134-H136 VanDerWaalsContact OD1-CA 3.32Å; D134-H136 WeakPolarHBondContact OD1-CA 3.28Å; D134-H136 WeakPolarHBondContact OD1-CB 3.13Å; D134-H136 PolarHBondContact OD1-N 3.31Å; D134-G137 PolarHBondContact O-N 3.2Å; D134-G137 PolarHBondContact OD1-N 3.13Å; D134-G137 VanDerWaalsContact OD1-N 3.16Å; D134-H138 PolarHBondContact N-O 2.94Å; D134-H138 PolarHBondContact OD1-N 2.96Å
135	E	85.8	Confident	91.5	Very high	121 Å²	121	48.5 Å²	48.5	57%	0.565	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-13.1	178.8	65.3	-174.4	177.6	0	0	114.4	F90	F90-E135 WeakPolarHBondContact CZ-O 3.42Å
136	H	84.1	Confident	91.6	Very high	67 Å²	67	44.6 Å²	44.6	31%	0.31	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.7	5.9	175.8	-54.2	-70.1	0	0	0	112.9	K10 D134 H138	K10-H136 WeakPolarHBondContact CD-CD2 3.37Å; K10-H136 PolarHBondContact NZ-CD2 3.47Å; K10-H136 PolarHBondContact NZ-CE1 3.21Å; K10-H136 PolarHBondContact NZ-NE2 3.11Å; D134-H136 PolarHBondContact O-N 3.37Å; D134-H136 VanDerWaalsContact OD1-CA 3.32Å; D134-H136 WeakPolarHBondContact OD1-CA 3.28Å; D134-H136 WeakPolarHBondContact OD1-CB 3.13Å; D134-H136 PolarHBondContact OD1-N 3.31Å; H136-H138 VanDerWaalsContact C-N 3.33Å
137	G	89.4	Confident	91.4	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.25	C	S	.	.	S	Bend	trans	80.5	9.3	-179.7	0	0	0	0	0	113.8	P82 F111 P133 D134	P82-G137 WeakPolarHBondContact CD-O 3.33Å; F111-G137 VanDerWaalsContact CE1-O 3.28Å; F111-G137 WeakPolarHBondContact CE1-O 3.34Å; P133-G137 VanDerWaalsContact CB-C 3.46Å; D134-G137 PolarHBondContact O-N 3.2Å; D134-G137 PolarHBondContact OD1-N 3.13Å; D134-G137 VanDerWaalsContact OD1-N 3.16Å
138	H	92.4	Very high	91.4	Very high	43 Å²	43	48.1 Å²	48.1	20%	0.199	26%	0.263	C	S	.	.			trans	-99.2	145.5	-178.8	-68	-177.5	0	0	0	111.7	P133 D134 H136 P140	P133-H138 CarbonylContact C-O 3.52Å; P133-H138 VanDerWaalsContact CA-O 3.29Å; P133-H138 WeakPolarHBondContact CA-O 3.43Å; D134-H138 PolarHBondContact N-O 2.94Å; D134-H138 PolarHBondContact OD1-N 2.96Å; H136-H138 VanDerWaalsContact C-N 3.33Å; H138-P140 WeakPolarHBondContact O-CD 3.48Å
139	I	95	Very high	91.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	24%	0.237	C	C	.	.	B	Isolated β-bridge	trans	-110.2	101.8	169.8	-54.7	167.8	0	0	0	108.5	D79 R80 F111 W118 V124 P131 P133	D79-I139 CarbonylContact C-O 3.49Å; D79-I139 WeakPolarHBondContact CA-O 3.48Å; R80-I139 HydrophobicContact CB-CB 4.17Å; R80-I139 PolarHBondContact N-O 2.85Å; R80-I139 PolarHBondContact O-N 3.2Å; F111-I139 HydrophobicContact CD1-CD1 3.97Å; F111-I139 HydrophobicContact CD1-CG1 4.47Å; F111-I139 HydrophobicContact CE1-CD1 3.73Å; F111-I139 HydrophobicContact CE1-CG1 3.92Å; F111-I139 HydrophobicContact CE2-CD1 4.47Å; F111-I139 HydrophobicContact CG-CD1 4.45Å; F111-I139 HydrophobicContact CZ-CD1 4.02Å; F111-I139 HydrophobicContact CZ-CG1 4.37Å; W118-I139 HydrophobicContact CH2-CG2 3.75Å; W118-I139 HydrophobicContact CZ2-CG2 4.1Å; V124-I139 HydrophobicContact CG1-CG2 3.98Å; P131-I139 HydrophobicContact CB-CG2 3.84Å; P131-I139 HydrophobicContact CG-CG2 4.31Å; P133-I139 HydrophobicContact CB-CG1 3.95Å
140	P	95.6	Very high	92	Very high	5 Å²	5	49 Å²	49	3%	0.032	24%	0.243	C	C	.	.			trans	-44.9	134	168.5	-37.9	42.1	0	0	0	114.6	R77 D79 A121 V124 H138	R77-P140 VanDerWaalsContact NH2-CG 3.3Å; D79-P140 WeakPolarHBondContact OD1-CA 3.39Å; A121-P140 HydrophobicContact CB-CB 3.76Å; A121-P140 PolarHBondContact N-O 3.21Å; V124-P140 HydrophobicContact CG2-CB 3.59Å; V124-P140 HydrophobicContact CG2-CG 4.1Å; V124-P140 WeakPolarHBondContact CG2-O 3.39Å; H138-P140 WeakPolarHBondContact O-CD 3.48Å
141	G	96.4	Very high	92.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.7	-177.3	173.7	0	0	0	0	0	114.5	R77 L78 I119	R77-G141 WeakPolarHBondContact CD-O 3.5Å; L78-G141 CarbonylContact C-O 3.54Å; L78-G141 PolarHBondContact N-O 3.36Å; L78-G141 CarbonylContact O-C 3.18Å; L78-G141 PolarHBondContact O-N 3.23Å; I119-G141 CarbonylContact O-C 3.48Å; I119-G141 WeakPolarHBondContact O-CA 3.25Å
142	W	97.5	Very high	92.4	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	145.9	-167.8	-53.2	109.8	0	0	0	110.3	V7 Y64 W75 A76 R77 W118 I119 A121 T193	V7-W142 WeakPolarHBondContact O-CZ2 3.41Å; Y64-W142 HydrophobicContact CD1-CD2 4.41Å; Y64-W142 HydrophobicContact CD1-CG 4.31Å; Y64-W142 HydrophobicContact CG-CD2 4.33Å; W75-W142 HydrophobicContact CB-CB 4.06Å; W75-W142 HydrophobicContact CD2-CB 4.4Å; W75-W142 HydrophobicContact CE3-CB 3.75Å; A76-W142 WeakPolarHBondContact O-CA 3.26Å; R77-W142 HydrophobicContact CB-CE3 4.15Å; R77-W142 HydrophobicContact CB-CZ3 3.76Å; R77-W142 VanDerWaalsContact CD-CZ3 3.47Å; R77-W142 HydrophobicContact CG-CZ3 4.25Å; W118-W142 VanDerWaalsContact CA-O 3.31Å; W118-W142 WeakPolarHBondContact CA-O 3.25Å; I119-W142 HydrophobicContact CD1-CB 4.45Å; I119-W142 HydrophobicContact CG1-CB 3.88Å; I119-W142 HydrophobicContact CG1-CG 4.49Å; I119-W142 PolarHBondContact N-O 2.89Å; I119-W142 PolarHBondContact O-N 3.2Å; A121-W142 HydrophobicContact CB-CZ2 4.39Å; A121-W142 VanDerWaalsContact CB-NE1 3.33Å; W142-T193 HydrophobicContact CH2-CG2 3.98Å; W142-T193 HydrophobicContact CZ2-CG2 4.08Å
143	V	97.5	Very high	92.6	Very high	5 Å²	5	49.4 Å²	49.4	3%	0.03	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	142.7	168.5	-68.9	0	0	0	0	110.4	W75 A76 L78 P115 W118 Y152	W75-V143 CarbonylContact C-O 3.49Å; W75-V143 WeakPolarHBondContact CA-O 3.05Å; A76-V143 HydrophobicContact CB-CG2 4.43Å; A76-V143 PolarHBondContact N-O 2.98Å; A76-V143 PolarHBondContact O-N 3.13Å; L78-V143 HydrophobicContact CB-CG1 4.11Å; L78-V143 HydrophobicContact CB-CG2 4.02Å; L78-V143 HydrophobicContact CD2-CG1 3.53Å; L78-V143 HydrophobicContact CD2-CG2 4.23Å; L78-V143 HydrophobicContact CG-CG1 4.44Å; P115-V143 HydrophobicContact CG-CG1 4.3Å; W118-V143 HydrophobicContact CB-CG1 3.92Å; W118-V143 HydrophobicContact CG-CG1 4.25Å; V143-Y152 HydrophobicContact CG2-CD2 4.45Å; V143-Y152 HydrophobicContact CG2-CE2 3.45Å; V143-Y152 VanDerWaalsContact CG2-CE2 3.45Å; V143-Y152 VanDerWaalsContact CG2-OH 3.25Å; V143-Y152 WeakPolarHBondContact CG2-OH 3.15Å
144	P	97.8	Very high	92.9	Very high	4 Å²	4	53.5 Å²	53.5	3%	0.026	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	138.5	-178.3	29.5	-33.7	0	0	0	110.1	Y68 W75 S117 Q146	Y68-P144 HydrophobicContact CD1-CB 3.95Å; Y68-P144 HydrophobicContact CD1-CG 4.24Å; Y68-P144 HydrophobicContact CD2-CB 4.3Å; Y68-P144 HydrophobicContact CD2-CG 4.18Å; Y68-P144 HydrophobicContact CE1-CB 4.18Å; Y68-P144 HydrophobicContact CE1-CG 4.01Å; Y68-P144 HydrophobicContact CE2-CG 3.95Å; Y68-P144 HydrophobicContact CG-CB 4.01Å; Y68-P144 HydrophobicContact CG-CG 4.32Å; W75-P144 HydrophobicContact CD2-CB 4.18Å; W75-P144 HydrophobicContact CE3-CB 4.25Å; W75-P144 VanDerWaalsContact CE3-N 3.3Å; W75-P144 HydrophobicContact CH2-CB 4.39Å; W75-P144 HydrophobicContact CH2-CG 4.41Å; W75-P144 HydrophobicContact CZ2-CB 4.34Å; W75-P144 HydrophobicContact CZ3-CB 4.36Å; W75-P144 VanDerWaalsContact CZ3-CD 3.47Å; W75-P144 HydrophobicContact CZ3-CG 4.28Å; S117-P144 WeakPolarHBondContact OG-CD 3.15Å; P144-Q146 PolarHBondContact O-N 3.36Å
145	V	97.4	Very high	93.3	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	25%	0.253	C	S	.	.			trans	-81.5	103.5	177.2	176.1	0	0	0	0	108	L74 A76 H155 Y161	L74-V145 HydrophobicContact CB-CB 4.31Å; L74-V145 HydrophobicContact CB-CG2 4.31Å; L74-V145 HydrophobicContact CD2-CG2 4.26Å; L74-V145 HydrophobicContact CG-CG2 4.13Å; L74-V145 VanDerWaalsContact O-CB 3.32Å; L74-V145 WeakPolarHBondContact O-CB 3.38Å; L74-V145 WeakPolarHBondContact O-CG2 3.5Å; L74-V145 PolarHBondContact O-N 3.11Å; A76-V145 HydrophobicContact CB-CG2 3.86Å; V145-H155 HydrophobicContact CB-CB 4.33Å; V145-H155 HydrophobicContact CG1-CB 3.66Å; V145-H155 HydrophobicContact CG2-CB 3.7Å; V145-Y161 WeakPolarHBondContact O-CE2 3.44Å; V145-Y161 PolarHBondContact O-OH 2.78Å
146	Q	92.6	Very high	93.7	Very high	70 Å²	70	47.6 Å²	47.6	33%	0.327	23%	0.233	S	C	.	.			trans	-100.6	140	176.5	-64.3	178.6	-22.4	0	0	110.1	P144 S148 N149	P144-Q146 PolarHBondContact O-N 3.36Å; Q146-S148 PolarHBondContact O-N 3.38Å; Q146-S148 VanDerWaalsContact O-N 3.11Å; Q146-N149 WeakPolarHBondContact O-CB 3.37Å; Q146-N149 PolarHBondContact O-N 3.01Å
147	K	87.4	Confident	94.3	Very high	131 Å²	131	46.2 Å²	46.2	57%	0.57	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-32.2	-179.7	-72.7	-176.6	175.5	178.9	0	113.2	N149	K147-N149 VanDerWaalsContact C-N 3.31Å; K147-N149 PolarHBondContact O-N 3.22Å
148	S	88.1	Confident	94.6	Very high	101 Å²	101	46.2 Å²	46.2	71%	0.706	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-16.5	178.8	55.7	0	0	0	0	114	Q146 K150	Q146-S148 PolarHBondContact O-N 3.38Å; Q146-S148 VanDerWaalsContact O-N 3.11Å; S148-K150 PolarHBondContact O-N 3.04Å
149	N	89.8	Confident	94.8	Very high	54 Å²	54	44.7 Å²	44.7	29%	0.289	22%	0.224	S	C	.	.			trans	-86.3	100.3	-175.9	-169.8	-18.7	0	0	0	111.5	Q146 K147 Q151 Y152	Q146-N149 WeakPolarHBondContact O-CB 3.37Å; Q146-N149 PolarHBondContact O-N 3.01Å; K147-N149 VanDerWaalsContact C-N 3.31Å; K147-N149 PolarHBondContact O-N 3.22Å; N149-Q151 PolarHBondContact O-N 2.76Å; N149-Q151 VanDerWaalsContact O-N 3.12Å; N149-Q151 WeakPolarHBondContact OD1-CB 3.27Å; N149-Q151 PolarHBondContact OD1-N 2.87Å; N149-Y152 HydrophobicContact CB-CD2 4.36Å; N149-Y152 VanDerWaalsContact ND2-CD2 3.33Å; N149-Y152 WeakPolarHBondContact ND2-CD2 3.17Å; N149-Y152 WeakPolarHBondContact ND2-CE2 3.49Å; N149-Y152 PolarHBondContact O-N 3.45Å
150	K	92.4	Very high	94.7	Very high	187 Å²	187	45.5 Å²	45.5	81%	0.813	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-58.7	-24.4	178.6	-65.5	-172.9	179.4	-178.4	0	114.2	S148 Y152 C153	S148-K150 PolarHBondContact O-N 3.04Å; K150-Y152 PolarHBondContact O-N 3.47Å; K150-C153 PolarHBondContact O-SG 3.04Å; K150-C153 VanDerWaalsContact O-SG 3.4Å
151	Q	93.6	Very high	94.6	Very high	131 Å²	131	46.9 Å²	46.9	61%	0.612	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-63.8	-31.4	176.9	-174.5	-179.5	-16.4	0	0	111.8	N149	N149-Q151 PolarHBondContact O-N 2.76Å; N149-Q151 VanDerWaalsContact O-N 3.12Å; N149-Q151 WeakPolarHBondContact OD1-CB 3.27Å; N149-Q151 PolarHBondContact OD1-N 2.87Å
152	Y	96.2	Very high	94.4	Very high	13 Å²	13	54.8 Å²	54.8	5%	0.051	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-114.3	26.7	-175.3	-54.7	-59.5	0	0	0	112.2	A76 V143 N149 K150 W154 H155 S156	A76-Y152 HydrophobicContact CB-CD1 3.37Å; A76-Y152 HydrophobicContact CB-CD2 4.36Å; A76-Y152 HydrophobicContact CB-CE1 3.33Å; A76-Y152 HydrophobicContact CB-CE2 4.34Å; A76-Y152 HydrophobicContact CB-CG 3.93Å; V143-Y152 HydrophobicContact CG2-CD2 4.45Å; V143-Y152 HydrophobicContact CG2-CE2 3.45Å; V143-Y152 VanDerWaalsContact CG2-CE2 3.45Å; V143-Y152 VanDerWaalsContact CG2-OH 3.25Å; V143-Y152 WeakPolarHBondContact CG2-OH 3.15Å; N149-Y152 HydrophobicContact CB-CD2 4.36Å; N149-Y152 VanDerWaalsContact ND2-CD2 3.33Å; N149-Y152 WeakPolarHBondContact ND2-CD2 3.17Å; N149-Y152 WeakPolarHBondContact ND2-CE2 3.49Å; N149-Y152 PolarHBondContact O-N 3.45Å; K150-Y152 PolarHBondContact O-N 3.47Å; Y152-W154 PolarHBondContact O-N 3.36Å; Y152-H155 WeakPolarHBondContact O-CA 3.34Å; Y152-H155 WeakPolarHBondContact O-CB 3.45Å; Y152-H155 PolarHBondContact O-N 2.81Å; Y152-S156 PolarHBondContact O-N 3.46Å
153	C	95.3	Very high	94.1	Very high	46 Å²	46	58.3 Å²	58.3	31%	0.311	29%	0.289	S	S	.	.	H	α-helix	trans	-56.2	-37.1	-178.5	56.8	0	0	0	0	113.1	K150 S156 S157	K150-C153 PolarHBondContact O-SG 3.04Å; K150-C153 VanDerWaalsContact O-SG 3.4Å; C153-S156 PolarHBondContact O-N 2.98Å; C153-S157 PolarHBondContact O-N 2.85Å
154	W	96.6	Very high	93.9	Very high	107 Å²	107	59.4 Å²	59.4	41%	0.405	30%	0.302	S	S	.	.	H	α-helix	trans	-75.4	-23.4	176.6	-43.7	139.2	0	0	0	113.8	Y152 S157 L196 N200 H216	Y152-W154 PolarHBondContact O-N 3.36Å; W154-S157 PolarHBondContact O-OG 2.92Å; W154-L196 HydrophobicContact CB-CD2 4.16Å; W154-N200 HydrophobicContact CD2-CB 3.96Å; W154-N200 HydrophobicContact CG-CB 4.14Å; W154-N200 HydrophobicContact CZ2-CB 4.05Å; W154-H216 AromaticContact CE3-CE1 3.99Å
155	H	97.8	Very high	93.8	Very high	15 Å²	15	59.7 Å²	59.7	7%	0.069	30%	0.303	C	S	.	.	H	α-helix	trans	-75.4	-37.5	170.6	-61.7	58.8	0	0	0	109.3	T61 C63 L74 V145 Y152 S157 V158 L196	T61-H155 PolarHBondContact OG1-CE1 3.36Å; T61-H155 PolarHBondContact OG1-NE2 3.45Å; C63-H155 PolarHBondContact SG-CD2 2.98Å; L74-H155 HydrophobicContact CD2-CB 3.92Å; L74-H155 WeakPolarHBondContact CD2-O 3.32Å; V145-H155 HydrophobicContact CB-CB 4.33Å; V145-H155 HydrophobicContact CG1-CB 3.66Å; V145-H155 HydrophobicContact CG2-CB 3.7Å; Y152-H155 WeakPolarHBondContact O-CA 3.34Å; Y152-H155 WeakPolarHBondContact O-CB 3.45Å; Y152-H155 PolarHBondContact O-N 2.81Å; H155-S157 VanDerWaalsContact C-N 3.27Å; H155-S157 PolarHBondContact O-N 3Å; H155-V158 WeakPolarHBondContact O-CG2 3.19Å; H155-L196 HydrophobicContact CB-CD2 4.3Å; H155-L196 WeakPolarHBondContact ND1-CD2 3.15Å
156	S	96.2	Very high	93.7	Very high	20 Å²	20	59.7 Å²	59.7	14%	0.14	30%	0.303	C	S	.	.	H	α-helix	trans	-69.8	-22	177.5	-169.9	0	0	0	0	113.1	Y152 C153 V158	Y152-S156 PolarHBondContact O-N 3.46Å; C153-S156 PolarHBondContact O-N 2.98Å; S156-V158 VanDerWaalsContact C-N 3.3Å; S156-V158 PolarHBondContact O-N 2.89Å
157	S	95.2	Very high	93.9	Very high	38 Å²	38	56.3 Å²	56.3	27%	0.266	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-17.4	-179.2	63	0	0	0	0	113.8	C153 W154 H155 H216	C153-S157 PolarHBondContact O-N 2.85Å; W154-S157 PolarHBondContact O-OG 2.92Å; H155-S157 VanDerWaalsContact C-N 3.27Å; H155-S157 PolarHBondContact O-N 3Å; S157-H216 PolarHBondContact OG-ND1 3.31Å
158	V	96.4	Very high	94.4	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.006	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	5.9	-178.4	-60.8	0	0	0	0	113.3	L74 H155 S156 A166 L167 L196 H216 L218 L302	L74-V158 HydrophobicContact CD2-CG2 4.27Å; H155-V158 WeakPolarHBondContact O-CG2 3.19Å; S156-V158 VanDerWaalsContact C-N 3.3Å; S156-V158 PolarHBondContact O-N 2.89Å; V158-A166 CarbonylContact O-C 3.38Å; V158-A166 VanDerWaalsContact O-CA 3.23Å; V158-A166 WeakPolarHBondContact O-CA 3.46Å; V158-L167 HydrophobicContact CB-CB 4.45Å; V158-L167 PolarHBondContact O-N 2.95Å; V158-L196 HydrophobicContact CB-CD1 4.44Å; V158-L196 HydrophobicContact CG1-CD1 3.81Å; V158-L196 HydrophobicContact CG2-CD1 3.75Å; V158-H216 VanDerWaalsContact CG1-C 3.43Å; V158-H216 HydrophobicContact CG1-CB 3.36Å; V158-H216 WeakPolarHBondContact CG1-O 3.36Å; V158-L218 HydrophobicContact CB-CG 4.42Å; V158-L218 HydrophobicContact CG2-CD1 4.24Å; V158-L218 HydrophobicContact CG2-CD2 3.87Å; V158-L218 HydrophobicContact CG2-CG 3.76Å; V158-L302 HydrophobicContact CG1-CD1 4.23Å
159	V	95.6	Very high	94.9	Very high	10 Å²	10	45.3 Å²	45.3	6%	0.061	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	139.3	179.8	-65.8	0	0	0	0	110.9	L74 Y161 V165 A166 L186	L74-V159 HydrophobicContact CB-CG1 4Å; L74-V159 HydrophobicContact CD2-CG1 3.93Å; L74-V159 HydrophobicContact CG-CG1 4.49Å; V159-Y161 HydrophobicContact CB-CE1 4.23Å; V159-Y161 HydrophobicContact CG2-CD2 4.49Å; V159-Y161 HydrophobicContact CG2-CE1 3.99Å; V159-Y161 HydrophobicContact CG2-CE2 3.89Å; V159-V165 WeakPolarHBondContact CA-O 3.26Å; V159-A166 HydrophobicContact CG1-CB 3.93Å; V159-L186 HydrophobicContact CG1-CD2 4.19Å
160	D	94	Very high	95.1	Very high	17 Å²	17	44.8 Å²	44.8	9%	0.091	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	108.1	165.6	-170.7	-38.7	0	0	0	108	E162 L163 G164 V165 S299 L303	D160-E162 WeakPolarHBondContact OD1-CB 3.49Å; D160-E162 PolarHBondContact OD1-N 2.81Å; D160-L163 HydrophobicContact CB-CB 4.2Å; D160-L163 PolarHBondContact OD1-N 2.9Å; D160-G164 CarbonylContact O-C 3.51Å; D160-G164 WeakPolarHBondContact O-CA 3.3Å; D160-G164 PolarHBondContact O-N 2.9Å; D160-V165 HydrophobicContact CB-CG2 4.19Å; D160-V165 PolarHBondContact N-O 3.43Å; D160-V165 PolarHBondContact O-N 2.88Å; D160-S299 WeakPolarHBondContact OD2-CB 3.37Å; D160-L303 HydrophobicContact CB-CD1 3.64Å
161	Y	93.3	Very high	95.3	Very high	35 Å²	35	36.4 Å²	36.4	14%	0.137	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-22.6	-179	-65.5	-52.8	0	0	0	113.5	Y73 L74 V145 V159 L186	Y73-Y161 HydrophobicContact CD1-CD1 4.38Å; Y73-Y161 AromaticContact CD1-CE1 3.75Å; Y73-Y161 HydrophobicContact CD1-CE1 3.75Å; Y73-Y161 AromaticContact CD1-CE2 3.97Å; Y73-Y161 HydrophobicContact CD1-CE2 3.97Å; Y73-Y161 AromaticContact CD1-CZ 3.48Å; Y73-Y161 VanDerWaalsContact CD1-CZ 3.48Å; Y73-Y161 WeakPolarHBondContact CD1-OH 3.37Å; Y73-Y161 HydrophobicContact CE1-CD1 4.37Å; Y73-Y161 HydrophobicContact CE1-CD2 4.06Å; Y73-Y161 HydrophobicContact CE1-CE1 4.1Å; Y73-Y161 AromaticContact CE1-CE2 3.73Å; Y73-Y161 HydrophobicContact CE1-CE2 3.73Å; Y73-Y161 HydrophobicContact CE1-CG 4.36Å; Y73-Y161 AromaticContact CE1-CZ 3.74Å; Y73-Y161 HydrophobicContact CG-CE1 4.07Å; L74-Y161 PolarHBondContact N-OH 3.5Å; V145-Y161 WeakPolarHBondContact O-CE2 3.44Å; V145-Y161 PolarHBondContact O-OH 2.78Å; V159-Y161 HydrophobicContact CB-CE1 4.23Å; V159-Y161 HydrophobicContact CG2-CD2 4.49Å; V159-Y161 HydrophobicContact CG2-CE1 3.99Å; V159-Y161 HydrophobicContact CG2-CE2 3.89Å; Y161-L186 HydrophobicContact CD1-CD1 3.78Å; Y161-L186 HydrophobicContact CE1-CD1 3.92Å
162	E	91.4	Very high	95.2	Very high	165 Å²	165	30.4 Å²	30.4	77%	0.771	16%	0.16	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-41.2	176.5	-58.3	-57.3	144	0	0	109.9	D160 G164	D160-E162 WeakPolarHBondContact OD1-CB 3.49Å; D160-E162 PolarHBondContact OD1-N 2.81Å; E162-G164 VanDerWaalsContact C-N 3.34Å
163	L	91.6	Very high	94.5	Very high	74 Å²	74	34.8 Å²	34.8	39%	0.387	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-12.7	175	-61.4	-177.7	0	0	0	113	D160 V165 Y296	D160-L163 HydrophobicContact CB-CB 4.2Å; D160-L163 PolarHBondContact OD1-N 2.9Å; L163-V165 VanDerWaalsContact C-N 3.33Å; L163-V165 HydrophobicContact CB-CG2 3.86Å; L163-V165 PolarHBondContact O-N 3.43Å; L163-Y296 HydrophobicContact CD1-CD1 3.64Å; L163-Y296 HydrophobicContact CD1-CE1 3.99Å
164	G	93.4	Very high	93.7	Very high	29 Å²	29	39.2 Å²	39.2	30%	0.299	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.4	31.7	-179.4	0	0	0	0	0	113.8	D160 E162 P185 L186	D160-G164 CarbonylContact O-C 3.51Å; D160-G164 WeakPolarHBondContact O-CA 3.3Å; D160-G164 PolarHBondContact O-N 2.9Å; E162-G164 VanDerWaalsContact C-N 3.34Å; G164-P185 CarbonylContact O-C 3.51Å; G164-P185 WeakPolarHBondContact O-CA 3.44Å; G164-L186 PolarHBondContact O-N 3.3Å
165	V	94.7	Very high	93.1	Very high	9 Å²	9	37.3 Å²	37.3	6%	0.055	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	159.3	-174.8	-63.3	0	0	0	0	112.7	V159 D160 L163 L184 Y296 L303	V159-V165 WeakPolarHBondContact CA-O 3.26Å; D160-V165 HydrophobicContact CB-CG2 4.19Å; D160-V165 PolarHBondContact N-O 3.43Å; D160-V165 PolarHBondContact O-N 2.88Å; L163-V165 VanDerWaalsContact C-N 3.33Å; L163-V165 HydrophobicContact CB-CG2 3.86Å; L163-V165 PolarHBondContact O-N 3.43Å; V165-L184 CarbonylContact C-O 3.33Å; V165-L184 VanDerWaalsContact CA-O 3.25Å; V165-L184 WeakPolarHBondContact CA-O 3.42Å; V165-Y296 HydrophobicContact CG2-CE1 4.1Å; V165-L303 HydrophobicContact CG2-CD1 3.66Å
166	A	96.1	Very high	92.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	146	172.3	0	0	0	0	0	111.8	V158 V159 V168 A183 L184 L186 L189 L218	V158-A166 CarbonylContact O-C 3.38Å; V158-A166 VanDerWaalsContact O-CA 3.23Å; V158-A166 WeakPolarHBondContact O-CA 3.46Å; V159-A166 HydrophobicContact CG1-CB 3.93Å; A166-V168 HydrophobicContact CB-CG2 4.37Å; A166-A183 WeakPolarHBondContact O-CA 3.47Å; A166-L184 PolarHBondContact N-O 2.99Å; A166-L184 PolarHBondContact O-N 3.37Å; A166-L186 HydrophobicContact CB-CD2 3.87Å; A166-L189 HydrophobicContact CB-CD1 3.95Å; A166-L218 HydrophobicContact CB-CD1 3.91Å
167	L	97.3	Very high	91.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	116.6	172.4	-172.4	68.4	0	0	0	109.7	V158 I181 H216 L218 L289 L302 L303 F306	V158-L167 HydrophobicContact CB-CB 4.45Å; V158-L167 PolarHBondContact O-N 2.95Å; L167-I181 HydrophobicContact CD1-CG2 3.67Å; L167-I181 HydrophobicContact CG-CG2 4.25Å; L167-H216 WeakPolarHBondContact CD2-O 3.39Å; L167-L218 PolarHBondContact O-N 2.98Å; L167-L289 HydrophobicContact CD1-CD2 4.21Å; L167-L302 HydrophobicContact CD2-CB 4.05Å; L167-L302 HydrophobicContact CD2-CD1 4.36Å; L167-L303 HydrophobicContact CB-CD2 4.34Å; L167-L303 HydrophobicContact CD1-CD2 4.13Å; L167-F306 HydrophobicContact CD1-CD2 4.18Å; L167-F306 HydrophobicContact CD1-CG 4.46Å; L167-F306 HydrophobicContact CD2-CD2 3.63Å; L167-F306 HydrophobicContact CD2-CE2 3.49Å; L167-F306 VanDerWaalsContact CD2-CE2 3.49Å; L167-F306 HydrophobicContact CD2-CZ 4.38Å
168	V	97.5	Very high	91.7	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	138.6	-169.7	174.3	0	0	0	0	110.5	A166 K170 I181 T182 L184 L189 L218 P220	A166-V168 HydrophobicContact CB-CG2 4.37Å; V168-K170 HydrophobicContact CG1-CB 4.34Å; V168-I181 WeakPolarHBondContact O-CA 3.38Å; V168-T182 HydrophobicContact CB-CG2 4.36Å; V168-T182 PolarHBondContact N-O 2.9Å; V168-T182 PolarHBondContact O-N 2.71Å; V168-L184 HydrophobicContact CB-CD1 4.14Å; V168-L184 HydrophobicContact CB-CG 4.31Å; V168-L184 HydrophobicContact CG1-CD1 4.01Å; V168-L184 HydrophobicContact CG2-CB 4.23Å; V168-L184 HydrophobicContact CG2-CD1 4.12Å; V168-L184 HydrophobicContact CG2-CG 4.27Å; V168-L189 HydrophobicContact CG2-CD1 3.92Å; V168-L218 CarbonylContact C-O 3.46Å; V168-L218 VanDerWaalsContact CA-O 3.24Å; V168-L218 WeakPolarHBondContact CA-O 3.42Å; V168-L218 HydrophobicContact CG2-CB 4.37Å; V168-P220 HydrophobicContact CG1-CG 4.1Å
169	L	97.8	Very high	91.7	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	125.4	166.2	176.6	77.5	0	0	0	108.6	L179 E180 I181 I197 C217 L218 V219 L280 L317	L169-L179 HydrophobicContact CD1-CB 3.88Å; L169-L179 HydrophobicContact CD1-CD1 4.36Å; L169-E180 WeakPolarHBondContact CA-O 3.17Å; L169-I181 HydrophobicContact CD1-CG1 3.68Å; L169-I197 HydrophobicContact CD2-CD1 3.94Å; L169-C217 HydrophobicContact CB-CB 3.82Å; L169-L218 PolarHBondContact N-O 3.31Å; L169-V219 HydrophobicContact CB-CG2 3.97Å; L169-V219 HydrophobicContact CD2-CG2 3.97Å; L169-V219 HydrophobicContact CG-CG2 4.35Å; L169-L280 HydrophobicContact CD2-CD2 4.35Å; L169-L317 HydrophobicContact CD1-CD1 3.74Å; L169-L317 HydrophobicContact CD2-CD1 4.39Å; L169-L317 HydrophobicContact CD2-CD2 3.77Å
170	K	95.6	Very high	91.8	Very high	43 Å²	43	41.7 Å²	41.7	19%	0.187	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	167.6	-178.3	63	176.3	-170.1	-170.3	0	110.5	V168 E180 T182	V168-K170 HydrophobicContact CG1-CB 4.34Å; K170-E180 WeakPolarHBondContact CE-OE1 3.37Å; K170-E180 HydrophobicContact CG-CB 4.32Å; K170-E180 PolarHBondContact N-O 2.88Å; K170-E180 IonicContact NZ-OE1 3.33Å; K170-E180 PolarHBondContact NZ-OE1 3.45Å; K170-E180 PolarHBondContact O-N 3.36Å; K170-T182 HydrophobicContact CD-CG2 4.06Å; K170-T182 HydrophobicContact CG-CG2 4.39Å
171	P	95	Very high	92	Very high	11 Å²	11	41 Å²	41	7%	0.071	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	145.9	167.2	-19	31.2	0	0	0	111.6	S223 I224	P171-S223 WeakPolarHBondContact CG-O 3.42Å; P171-I224 HydrophobicContact CG-CD1 4.14Å
172	G	91.5	Very high	92.1	Very high	4 Å²	4	39.6 Å²	39.6	4%	0.041	22%	0.22	C	C	.	.			trans	-68.5	147.6	173.4	0	0	0	0	0	111.4	D174 L178	G172-D174 VanDerWaalsContact C-N 3.28Å; G172-D174 PolarHBondContact O-N 3.25Å; G172-L178 PolarHBondContact N-O 2.89Å
173	C	81.4	Confident	92.3	Very high	106 Å²	106	32.2 Å²	32.2	72%	0.716	19%	0.187	S	C	*	.	S	Bend	trans	-65.4	-29.8	-177.3	-65.3	0	0	0	0	114.1
174	D	79.6	Confident	92.4	Very high	138 Å²	138	30.4 Å²	30.4	74%	0.738	18%	0.177	S	C	*	.	S	Bend	trans	-101.8	-16.5	-170.8	-52.9	-44.1	0	0	0	113	G172 R288	G172-D174 VanDerWaalsContact C-N 3.28Å; G172-D174 PolarHBondContact O-N 3.25Å; D174-R288 IonicContact OD2-NH2 3.1Å
175	D	84.1	Confident	92.5	Very high	68 Å²	68	31.6 Å²	31.6	36%	0.364	18%	0.18	S	C	.	.			trans	-152.2	112	-172.2	178.7	1.6	0	0	0	110	D177 L178	D175-D177 PolarHBondContact O-N 2.93Å; D175-D177 WeakPolarHBondContact OD1-CB 3.49Å; D175-D177 PolarHBondContact OD1-N 2.65Å; D175-L178 HydrophobicContact CB-CB 3.9Å; D175-L178 WeakPolarHBondContact O-CB 3.36Å; D175-L178 PolarHBondContact O-N 2.96Å
176	D	77.5	Confident	92.6	Very high	106 Å²	106	31.2 Å²	31.2	57%	0.567	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-16.5	-179.8	-75.9	-21.3	0	0	0	113.4	R283	D176-R283 PolarHBondContact O-NH2 3.15Å
177	D	86.6	Confident	92.6	Very high	46 Å²	46	33.1 Å²	33.1	25%	0.246	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-29.7	171.5	-84.9	-51.7	0	0	0	112.4	D175 R227 R279 R283	D175-D177 PolarHBondContact O-N 2.93Å; D175-D177 WeakPolarHBondContact OD1-CB 3.49Å; D175-D177 PolarHBondContact OD1-N 2.65Å; D177-R227 IonicContact OD1-CZ 4Å; D177-R227 IonicContact OD1-NE 2.69Å; D177-R227 IonicContact OD1-NH1 2.78Å; D177-R227 PolarHBondContact OD1-NH1 3.21Å; D177-R227 IonicContact OD1-NH2 3.12Å; D177-R227 PolarHBondContact OD1-NH2 3.36Å; D177-R227 IonicContact OD2-CZ 3.66Å; D177-R227 IonicContact OD2-NH1 2.65Å; D177-R227 PolarHBondContact OD2-NH1 3.18Å; D177-R227 IonicContact OD2-NH2 2.7Å; D177-R227 PolarHBondContact OD2-NH2 3.02Å; D177-R279 IonicContact OD1-NH2 3.86Å; D177-R279 PolarHBondContact OD1-NH2 2.71Å; D177-R283 PolarHBondContact O-NE 2.83Å; D177-R283 PolarHBondContact O-NH2 2.87Å; D177-R283 VanDerWaalsContact O-NH2 3.08Å
178	L	95.3	Very high	92.5	Very high	8 Å²	8	37.5 Å²	37.5	4%	0.042	22%	0.217	C	C	.	.	S	Bend	trans	-75.2	132.9	179.4	-174.7	65.3	0	0	0	110.8	G172 D175 P284 V286	G172-L178 PolarHBondContact N-O 2.89Å; D175-L178 HydrophobicContact CB-CB 3.9Å; D175-L178 WeakPolarHBondContact O-CB 3.36Å; D175-L178 PolarHBondContact O-N 2.96Å; L178-P284 HydrophobicContact CD1-CB 4.07Å; L178-P284 HydrophobicContact CD1-CG 4.37Å; L178-V286 HydrophobicContact CD1-CB 4.36Å; L178-V286 HydrophobicContact CD1-CG1 4.31Å; L178-V286 HydrophobicContact CD2-CB 4.35Å; L178-V286 HydrophobicContact CD2-CG1 3.73Å; L178-V286 HydrophobicContact CG-CG1 4.04Å
179	L	97.3	Very high	92.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	145.4	168	-65.3	175	0	0	0	110.4	L169 I224 L280 R283 P284 A285 V286 L317	L169-L179 HydrophobicContact CD1-CB 3.88Å; L169-L179 HydrophobicContact CD1-CD1 4.36Å; L179-I224 HydrophobicContact CD2-CD1 3.94Å; L179-L280 HydrophobicContact CD1-CD1 3.85Å; L179-L280 HydrophobicContact CD1-CG 4.31Å; L179-L280 HydrophobicContact CD2-CD1 4.32Å; L179-R283 HydrophobicContact CD1-CB 3.74Å; L179-R283 VanDerWaalsContact CD2-CZ 3.46Å; L179-R283 HydrophobicContact CG-CB 4.06Å; L179-P284 PolarHBondContact N-O 3.5Å; L179-A285 HydrophobicContact CB-CB 4.37Å; L179-A285 CarbonylContact O-C 3.58Å; L179-A285 VanDerWaalsContact O-CA 3.24Å; L179-A285 WeakPolarHBondContact O-CA 3.36Å; L179-V286 PolarHBondContact O-N 3Å; L179-L317 HydrophobicContact CD1-CB 4.28Å; L179-L317 HydrophobicContact CD1-CD1 4.49Å; L179-L317 HydrophobicContact CD1-CD2 3.87Å; L179-L317 HydrophobicContact CD1-CG 4.43Å
180	E	97.1	Very high	92.2	Very high	15 Å²	15	40.8 Å²	40.8	7%	0.07	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	120.3	177.3	-175.5	-179.4	121.4	0	0	109.6	L169 K170 T182 V286 R288	L169-E180 WeakPolarHBondContact CA-O 3.17Å; K170-E180 WeakPolarHBondContact CE-OE1 3.37Å; K170-E180 HydrophobicContact CG-CB 4.32Å; K170-E180 PolarHBondContact N-O 2.88Å; K170-E180 IonicContact NZ-OE1 3.33Å; K170-E180 PolarHBondContact NZ-OE1 3.45Å; K170-E180 PolarHBondContact O-N 3.36Å; E180-T182 WeakPolarHBondContact OE1-CB 3.28Å; E180-V286 WeakPolarHBondContact CA-O 3.37Å; E180-V286 HydrophobicContact CB-CG1 4.26Å; E180-V286 HydrophobicContact CG-CG1 4.28Å; E180-R288 HydrophobicContact CG-CB 4.07Å; E180-R288 HydrophobicContact CG-CG 4.35Å
181	I	97.2	Very high	92	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	119.9	164.1	-60.9	172.6	0	0	0	107.3	L167 V168 L169 V286 V287 R288 F306 L317 V320	L167-I181 HydrophobicContact CD1-CG2 3.67Å; L167-I181 HydrophobicContact CG-CG2 4.25Å; V168-I181 WeakPolarHBondContact O-CA 3.38Å; L169-I181 HydrophobicContact CD1-CG1 3.68Å; I181-V286 PolarHBondContact N-O 3.03Å; I181-V287 HydrophobicContact CB-CG2 4.34Å; I181-V287 WeakPolarHBondContact O-CA 3.23Å; I181-R288 PolarHBondContact O-N 3.12Å; I181-F306 HydrophobicContact CB-CE1 4.46Å; I181-F306 HydrophobicContact CD1-CE1 3.75Å; I181-F306 HydrophobicContact CD1-CZ 4.08Å; I181-F306 HydrophobicContact CG2-CD1 4.03Å; I181-F306 HydrophobicContact CG2-CE1 3.77Å; I181-F306 HydrophobicContact CG2-CZ 4.11Å; I181-L317 HydrophobicContact CD1-CD1 4.04Å; I181-L317 HydrophobicContact CG1-CD1 4.41Å; I181-V320 HydrophobicContact CD1-CG1 4.13Å; I181-V320 HydrophobicContact CD1-CG2 4.17Å
182	T	95.9	Very high	91.9	Very high	7 Å²	7	45.6 Å²	45.6	4%	0.043	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	165.2	-174.2	-170.3	0	0	0	0	111.7	V168 K170 E180 L184 R288	V168-T182 HydrophobicContact CB-CG2 4.36Å; V168-T182 PolarHBondContact N-O 2.9Å; V168-T182 PolarHBondContact O-N 2.71Å; K170-T182 HydrophobicContact CD-CG2 4.06Å; K170-T182 HydrophobicContact CG-CG2 4.39Å; E180-T182 WeakPolarHBondContact OE1-CB 3.28Å; T182-L184 HydrophobicContact CG2-CD2 4.1Å; T182-L184 HydrophobicContact CG2-CG 3.97Å; T182-R288 WeakPolarHBondContact CA-O 3.48Å; T182-R288 VanDerWaalsContact CB-O 3.22Å; T182-R288 WeakPolarHBondContact CB-O 3.19Å; T182-R288 PolarHBondContact OG1-O 3.06Å
183	A	95.3	Very high	92.1	Very high	10 Å²	10	45.6 Å²	45.6	8%	0.083	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	126	168.3	0	0	0	0	0	109.1	A166 L289 Y296 L303	A166-A183 WeakPolarHBondContact O-CA 3.47Å; A183-L289 HydrophobicContact CB-CD2 4.26Å; A183-Y296 HydrophobicContact CB-CE2 3.74Å; A183-L303 HydrophobicContact CB-CD2 3.84Å
184	L	94.5	Very high	92.9	Very high	36 Å²	36	40.6 Å²	40.6	19%	0.188	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	141.3	175.9	-65.5	-176.9	0	0	0	111	V165 A166 V168 T182 L186 L189	V165-L184 CarbonylContact C-O 3.33Å; V165-L184 VanDerWaalsContact CA-O 3.25Å; V165-L184 WeakPolarHBondContact CA-O 3.42Å; A166-L184 PolarHBondContact N-O 2.99Å; A166-L184 PolarHBondContact O-N 3.37Å; V168-L184 HydrophobicContact CB-CD1 4.14Å; V168-L184 HydrophobicContact CB-CG 4.31Å; V168-L184 HydrophobicContact CG1-CD1 4.01Å; V168-L184 HydrophobicContact CG2-CB 4.23Å; V168-L184 HydrophobicContact CG2-CD1 4.12Å; V168-L184 HydrophobicContact CG2-CG 4.27Å; T182-L184 HydrophobicContact CG2-CD2 4.1Å; T182-L184 HydrophobicContact CG2-CG 3.97Å; L184-L186 PolarHBondContact O-N 3.05Å; L184-L189 HydrophobicContact CD1-CD2 4.1Å
185	P	95.4	Very high	93.8	Very high	53 Å²	53	35 Å²	35	34%	0.344	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.5	135.3	167.8	-24.1	33.5	0	0	0	111.5	G164 A187 D188	G164-P185 CarbonylContact O-C 3.51Å; G164-P185 WeakPolarHBondContact O-CA 3.44Å; P185-A187 PolarHBondContact O-N 3.39Å; P185-D188 WeakPolarHBondContact CD-OD2 3.43Å; P185-D188 WeakPolarHBondContact O-CB 3.43Å; P185-D188 PolarHBondContact O-N 3.33Å
186	L	96.4	Very high	94.4	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-30.6	174.4	-75.3	169	0	0	0	111.6	V65 F72 V159 Y161 G164 A166 L184 D188 L189 Q190	V65-L186 HydrophobicContact CG1-CB 4.45Å; V65-L186 HydrophobicContact CG1-CD2 4.31Å; V65-L186 WeakPolarHBondContact CG1-O 3.36Å; V65-L186 HydrophobicContact CG2-CD2 4.33Å; F72-L186 HydrophobicContact CB-CB 3.71Å; F72-L186 WeakPolarHBondContact O-CD1 3.34Å; V159-L186 HydrophobicContact CG1-CD2 4.19Å; Y161-L186 HydrophobicContact CD1-CD1 3.78Å; Y161-L186 HydrophobicContact CE1-CD1 3.92Å; G164-L186 PolarHBondContact O-N 3.3Å; A166-L186 HydrophobicContact CB-CD2 3.87Å; L184-L186 PolarHBondContact O-N 3.05Å; L186-D188 VanDerWaalsContact C-N 3.28Å; L186-D188 PolarHBondContact O-N 3.43Å; L186-L189 CarbonylContact O-C 3.5Å; L186-L189 PolarHBondContact O-N 3.35Å; L186-L189 VanDerWaalsContact O-N 3.11Å; L186-Q190 PolarHBondContact O-N 2.95Å
187	A	96	Very high	95.4	Very high	40 Å²	40	26.7 Å²	26.7	33%	0.331	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-37.6	173.9	0	0	0	0	0	112.6	F72 P185 L189 Q190	F72-A187 HydrophobicContact CD2-CB 3.8Å; F72-A187 HydrophobicContact CE2-CB 3.52Å; F72-A187 HydrophobicContact CZ-CB 4.07Å; P185-A187 PolarHBondContact O-N 3.39Å; A187-L189 PolarHBondContact O-N 2.72Å; A187-Q190 VanDerWaalsContact O-CB 3.26Å; A187-Q190 WeakPolarHBondContact O-CB 3.03Å; A187-Q190 PolarHBondContact O-N 3.28Å
188	D	95	Very high	95.9	Very high	93 Å²	93	24.5 Å²	24.5	50%	0.497	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-24.8	179.1	-65.8	-12.2	0	0	0	111.6	P185 L186 Q192	P185-D188 WeakPolarHBondContact CD-OD2 3.43Å; P185-D188 WeakPolarHBondContact O-CB 3.43Å; P185-D188 PolarHBondContact O-N 3.33Å; L186-D188 VanDerWaalsContact C-N 3.28Å; L186-D188 PolarHBondContact O-N 3.43Å; D188-Q192 PolarHBondContact O-NE2 3.38Å
189	L	95.1	Very high	96	Very high	4 Å²	4	24.9 Å²	24.9	2%	0.021	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-1.8	177.3	-57.9	-179.9	0	0	0	113.2	V65 A166 V168 L184 L186 A187 E191 Q192 L194	V65-L189 HydrophobicContact CB-CB 4.18Å; V65-L189 WeakPolarHBondContact CB-O 3.15Å; V65-L189 HydrophobicContact CG1-CB 4.27Å; V65-L189 HydrophobicContact CG2-CB 3.93Å; A166-L189 HydrophobicContact CB-CD1 3.95Å; V168-L189 HydrophobicContact CG2-CD1 3.92Å; L184-L189 HydrophobicContact CD1-CD2 4.1Å; L186-L189 CarbonylContact O-C 3.5Å; L186-L189 PolarHBondContact O-N 3.35Å; L186-L189 VanDerWaalsContact O-N 3.11Å; A187-L189 PolarHBondContact O-N 2.72Å; L189-E191 PolarHBondContact O-N 2.99Å; L189-Q192 WeakPolarHBondContact O-CB 3.22Å; L189-Q192 WeakPolarHBondContact O-CG 3.15Å; L189-Q192 PolarHBondContact O-N 2.89Å; L189-L194 HydrophobicContact CD1-CD2 4.08Å; L189-L194 HydrophobicContact CD2-CD2 4.18Å
190	Q	94.5	Very high	96	Very high	66 Å²	66	27.9 Å²	27.9	31%	0.308	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	133.5	-176.1	-165.9	-159.6	-38.9	0	0	112	R3 F72 L186 A187 Q192	R3-Q190 PolarHBondContact NH1-O 2.69Å; F72-Q190 HydrophobicContact CD1-CB 4.36Å; F72-Q190 HydrophobicContact CD1-CG 4.04Å; F72-Q190 HydrophobicContact CE1-CB 4.06Å; F72-Q190 HydrophobicContact CE1-CG 3.61Å; L186-Q190 PolarHBondContact O-N 2.95Å; A187-Q190 VanDerWaalsContact O-CB 3.26Å; A187-Q190 WeakPolarHBondContact O-CB 3.03Å; A187-Q190 PolarHBondContact O-N 3.28Å; Q190-Q192 PolarHBondContact O-N 2.98Å
191	E	91.7	Very high	96	Very high	107 Å²	107	27.5 Å²	27.5	50%	0.5	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.2	9.1	-178	-45.8	-171.4	149.2	0	0	114.8	Y64 V65 L189	Y64-E191 VanDerWaalsContact CE2-CA 3.49Å; Y64-E191 HydrophobicContact CE2-CB 4.39Å; V65-E191 PolarHBondContact O-N 2.88Å; L189-E191 PolarHBondContact O-N 2.99Å
192	Q	93.3	Very high	95.8	Very high	47 Å²	47	31.3 Å²	31.3	22%	0.22	17%	0.171	C	C	.	.			trans	-88.6	143.9	173.2	-55.2	-171	44	0	0	110.6	Y64 V65 D188 L189 Q190 L194	Y64-Q192 WeakPolarHBondContact CA-O 3.23Å; Y64-Q192 WeakPolarHBondContact CD2-O 3.12Å; V65-Q192 PolarHBondContact N-O 3.33Å; D188-Q192 PolarHBondContact O-NE2 3.38Å; L189-Q192 WeakPolarHBondContact O-CB 3.22Å; L189-Q192 WeakPolarHBondContact O-CG 3.15Å; L189-Q192 PolarHBondContact O-N 2.89Å; Q190-Q192 PolarHBondContact O-N 2.98Å; Q192-L194 HydrophobicContact CB-CD1 4.46Å
193	T	95.6	Very high	95.7	Very high	5 Å²	5	34.6 Å²	34.6	3%	0.031	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	139	164	48.7	0	0	0	0	109.5	S6 V7 C63 Y64 W142 H221	S6-T193 WeakPolarHBondContact CA-OG1 3.43Å; S6-T193 VanDerWaalsContact OG-CG2 3.24Å; S6-T193 WeakPolarHBondContact OG-CG2 3.45Å; V7-T193 HydrophobicContact CB-CG2 4.35Å; V7-T193 PolarHBondContact N-OG1 3.12Å; C63-T193 CarbonylContact O-C 3.49Å; C63-T193 WeakPolarHBondContact O-CA 3.44Å; C63-T193 WeakPolarHBondContact O-CB 3.46Å; Y64-T193 HydrophobicContact CD2-CG2 3.95Å; W142-T193 HydrophobicContact CH2-CG2 3.98Å; W142-T193 HydrophobicContact CZ2-CG2 4.08Å; T193-H221 WeakPolarHBondContact O-CB 3.49Å; T193-H221 PolarHBondContact O-N 2.88Å; T193-H221 PolarHBondContact O-ND1 3.35Å
194	L	97.3	Very high	95.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	156.8	-179	-52.8	98	0	0	0	109.8	C62 C63 V65 L189 Q192 L218 V219 P220 H221	C62-L194 CarbonylContact C-O 3.51Å; C63-L194 HydrophobicContact CB-CB 4.44Å; C63-L194 PolarHBondContact N-O 2.72Å; C63-L194 PolarHBondContact O-N 2.84Å; V65-L194 HydrophobicContact CG2-CD1 3.73Å; L189-L194 HydrophobicContact CD1-CD2 4.08Å; L189-L194 HydrophobicContact CD2-CD2 4.18Å; Q192-L194 HydrophobicContact CB-CD1 4.46Å; L194-L218 HydrophobicContact CB-CB 4.2Å; L194-L218 HydrophobicContact CB-CD2 4.45Å; L194-L218 HydrophobicContact CD2-CB 3.77Å; L194-L218 HydrophobicContact CD2-CD1 4.24Å; L194-V219 CarbonylContact C-O 3.5Å; L194-V219 VanDerWaalsContact CA-O 3.28Å; L194-V219 WeakPolarHBondContact CA-O 3.24Å; L194-P220 HydrophobicContact CD2-CB 4.4Å; L194-P220 HydrophobicContact CD2-CG 4.02Å; L194-H221 VanDerWaalsContact C-ND1 3.33Å; L194-H221 WeakPolarHBondContact CA-ND1 3.39Å; L194-H221 PolarHBondContact N-ND1 3.25Å; L194-H221 PolarHBondContact O-CE1 3.2Å
195	E	97.8	Very high	95.7	Very high	20 Å²	20	35.1 Å²	35.1	9%	0.093	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123	169.4	-162.3	73.8	-112.4	0	0	108	L58 G60 T61 C62 I197 L218 V219 H221	L58-E195 HydrophobicContact CB-CB 4.3Å; L58-E195 HydrophobicContact CB-CG 3.93Å; G60-E195 WeakPolarHBondContact CA-OE1 3.29Å; T61-E195 WeakPolarHBondContact CA-OE1 3.43Å; T61-E195 PolarHBondContact N-OE1 3.21Å; C62-E195 PolarHBondContact N-OE1 2.84Å; E195-I197 HydrophobicContact CG-CG2 4.13Å; E195-L218 CarbonylContact O-C 3.53Å; E195-V219 PolarHBondContact N-O 2.94Å; E195-V219 PolarHBondContact O-N 2.68Å; E195-H221 IonicContact OE2-CE1 3.18Å; E195-H221 IonicContact OE2-NE2 3.41Å; E195-H221 PolarHBondContact OE2-NE2 3.41Å
196	L	98.6	Very high	95.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	123.8	167.3	176.4	72.9	0	0	0	108.3	G60 T61 W154 H155 V158 V201 H216 L218	G60-L196 CarbonylContact C-O 3.47Å; G60-L196 WeakPolarHBondContact CA-O 3.4Å; T61-L196 PolarHBondContact N-O 2.84Å; T61-L196 WeakPolarHBondContact O-CB 3.3Å; T61-L196 PolarHBondContact O-N 3.22Å; W154-L196 HydrophobicContact CB-CD2 4.16Å; H155-L196 HydrophobicContact CB-CD2 4.3Å; H155-L196 WeakPolarHBondContact ND1-CD2 3.15Å; V158-L196 HydrophobicContact CB-CD1 4.44Å; V158-L196 HydrophobicContact CG1-CD1 3.81Å; V158-L196 HydrophobicContact CG2-CD1 3.75Å; L196-V201 HydrophobicContact CD2-CG2 4.12Å; L196-V201 HydrophobicContact CG-CG2 4.15Å; L196-H216 HydrophobicContact CD1-CB 4.25Å; L196-L218 HydrophobicContact CB-CD2 4.09Å; L196-L218 HydrophobicContact CD1-CD2 3.95Å
197	I	98.4	Very high	95.6	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	159	172.5	64.7	169.9	0	0	0	110	L58 L169 E195 Y206 L208 H216 C217 V219 L280	L58-I197 HydrophobicContact CB-CG2 4.43Å; L169-I197 HydrophobicContact CD2-CD1 3.94Å; E195-I197 HydrophobicContact CG-CG2 4.13Å; I197-Y206 HydrophobicContact CB-CD2 4.12Å; I197-Y206 HydrophobicContact CB-CE2 4.11Å; I197-Y206 HydrophobicContact CD1-CD2 4.08Å; I197-Y206 HydrophobicContact CD1-CE2 4.36Å; I197-Y206 HydrophobicContact CG2-CD2 4.29Å; I197-Y206 HydrophobicContact CG2-CE2 3.77Å; I197-L208 HydrophobicContact CD1-CD1 3.83Å; I197-L208 HydrophobicContact CG1-CD1 3.94Å; I197-H216 CarbonylContact O-C 3.53Å; I197-H216 VanDerWaalsContact O-CA 3.25Å; I197-H216 WeakPolarHBondContact O-CA 3.47Å; I197-C217 PolarHBondContact N-O 3.15Å; I197-C217 PolarHBondContact O-N 3.4Å; I197-V219 HydrophobicContact CD1-CG2 3.7Å; I197-V219 HydrophobicContact CG1-CG2 3.99Å; I197-L280 HydrophobicContact CD1-CD2 3.81Å
198	G	97.1	Very high	95.6	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.01	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.5	-175.5	174.6	0	0	0	0	0	115.3	N200 V201 I215	G198-N200 PolarHBondContact O-N 3.28Å; G198-V201 PolarHBondContact O-N 3.3Å; G198-I215 CarbonylContact C-O 3.59Å; G198-I215 WeakPolarHBondContact CA-O 3.46Å
199	T	97.3	Very high	95.7	Very high	15 Å²	15	29.3 Å²	29.3	9%	0.092	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-33.6	-173.4	-48.4	0	0	0	0	114.2	L208 P214 I215	T199-L208 WeakPolarHBondContact CA-O 3.24Å; T199-L208 WeakPolarHBondContact CB-O 3.46Å; T199-L208 PolarHBondContact OG1-O 2.75Å; T199-P214 HydrophobicContact CG2-CB 4.33Å; T199-P214 WeakPolarHBondContact OG1-CA 3.4Å; T199-I215 PolarHBondContact N-O 2.88Å; T199-I215 PolarHBondContact OG1-N 2.89Å; T199-I215 PolarHBondContact OG1-O 3.34Å
200	N	97.1	Very high	95.6	Very high	64 Å²	64	31.5 Å²	31.5	34%	0.342	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	12.7	-176.2	-55.4	102.7	0	0	0	113.2	W154 G198 H216	W154-N200 HydrophobicContact CD2-CB 3.96Å; W154-N200 HydrophobicContact CG-CB 4.14Å; W154-N200 HydrophobicContact CZ2-CB 4.05Å; G198-N200 PolarHBondContact O-N 3.28Å; N200-H216 PolarHBondContact N-NE2 2.72Å; N200-H216 PolarHBondContact OD1-CE1 3.36Å; N200-H216 PolarHBondContact OD1-NE2 3.27Å
201	V	96.9	Very high	95.5	Very high	7 Å²	7	37.7 Å²	37.7	4%	0.042	22%	0.224	C	C	.	.	S	Bend	trans	-109.3	126.5	-178.7	-175.3	0	0	0	0	109	T61 L196 G198 G203 N204	T61-V201 HydrophobicContact CG2-CG1 4.2Å; L196-V201 HydrophobicContact CD2-CG2 4.12Å; L196-V201 HydrophobicContact CG-CG2 4.15Å; G198-V201 PolarHBondContact O-N 3.3Å; V201-G203 PolarHBondContact O-N 2.94Å; V201-N204 PolarHBondContact O-N 2.87Å
202	N	93.4	Very high	95.5	Very high	81 Å²	81	41.7 Å²	41.7	43%	0.433	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	46.2	34.4	172.8	-59.4	-10.6	0	0	0	115.7	D59 G60	D59-N202 VanDerWaalsContact OD1-CB 3.3Å; D59-N202 WeakPolarHBondContact OD1-CB 3.28Å; D59-N202 PolarHBondContact OD1-ND2 2.85Å; G60-N202 VanDerWaalsContact C-ND2 3.32Å; G60-N202 WeakPolarHBondContact CA-ND2 3.39Å; G60-N202 PolarHBondContact N-ND2 3.36Å; G60-N202 PolarHBondContact O-ND2 2.89Å
203	G	92.9	Very high	95.5	Very high	77 Å²	77	42.9 Å²	42.9	79%	0.794	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.1	11.3	178.4	0	0	0	0	0	115.3	V201	V201-G203 PolarHBondContact O-N 2.94Å
204	N	95.5	Very high	95.5	Very high	32 Å²	32	44 Å²	44	17%	0.171	25%	0.253	C	S	.	.			trans	55.8	56.5	-179.5	-165.5	20.6	0	0	0	114.3	V201 Y206 G207 L208	V201-N204 PolarHBondContact O-N 2.87Å; N204-Y206 PolarHBondContact O-N 3.13Å; N204-G207 PolarHBondContact O-N 2.88Å; N204-G207 VanDerWaalsContact O-N 3.13Å; N204-G207 PolarHBondContact OD1-N 2.91Å; N204-L208 PolarHBondContact ND2-N 3.3Å; N204-L208 PolarHBondContact ND2-O 3.17Å; N204-L208 PolarHBondContact OD1-N 2.81Å
205	P	94.3	Very high	95.5	Very high	25 Å²	25	44.1 Å²	44.1	16%	0.162	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-16	-175.7	24.6	-32.1	0	0	0	113.9	D59 W273 T278	D59-P205 HydrophobicContact CB-CG 4Å; P205-W273 HydrophobicContact CB-CD2 4.37Å; P205-W273 VanDerWaalsContact CB-CE2 3.44Å; P205-W273 HydrophobicContact CB-CH2 4.17Å; P205-W273 HydrophobicContact CB-CZ2 3.41Å; P205-W273 VanDerWaalsContact CB-CZ2 3.41Å; P205-W273 HydrophobicContact CG-CH2 4.44Å; P205-W273 HydrophobicContact CG-CZ2 4.1Å; P205-T278 WeakPolarHBondContact O-CG2 3.29Å
206	Y	95.8	Very high	95.5	Very high	5 Å²	5	43.3 Å²	43.3	2%	0.02	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	2.4	-178.6	-50.5	-65.6	0	0	0	114	L58 D59 I197 N204 L208 W273 L280	L58-Y206 VanDerWaalsContact CA-OH 3.23Å; L58-Y206 WeakPolarHBondContact CA-OH 3.41Å; L58-Y206 HydrophobicContact CD2-CE1 4.49Å; D59-Y206 PolarHBondContact N-OH 3.25Å; I197-Y206 HydrophobicContact CB-CD2 4.12Å; I197-Y206 HydrophobicContact CB-CE2 4.11Å; I197-Y206 HydrophobicContact CD1-CD2 4.08Å; I197-Y206 HydrophobicContact CD1-CE2 4.36Å; I197-Y206 HydrophobicContact CG2-CD2 4.29Å; I197-Y206 HydrophobicContact CG2-CE2 3.77Å; N204-Y206 PolarHBondContact O-N 3.13Å; Y206-L208 VanDerWaalsContact C-N 3.29Å; Y206-L208 PolarHBondContact O-N 2.71Å; Y206-W273 HydrophobicContact CE1-CZ2 4.41Å; Y206-L280 HydrophobicContact CD1-CB 3.84Å; Y206-L280 HydrophobicContact CD1-CD2 3.79Å; Y206-L280 HydrophobicContact CD1-CG 4.36Å; Y206-L280 HydrophobicContact CD2-CD2 4.39Å; Y206-L280 HydrophobicContact CE1-CB 3.99Å; Y206-L280 HydrophobicContact CE1-CD2 3.88Å; Y206-L280 HydrophobicContact CE2-CD2 4.47Å; Y206-L280 HydrophobicContact CG-CD2 4.04Å
207	G	95.1	Very high	95.4	Very high	31 Å²	31	43.4 Å²	43.4	32%	0.32	25%	0.25	S	C	.	.			trans	65.1	28.6	177.3	0	0	0	0	0	114.3	N204 G209	N204-G207 PolarHBondContact O-N 2.88Å; N204-G207 VanDerWaalsContact O-N 3.13Å; N204-G207 PolarHBondContact OD1-N 2.91Å; G207-G209 PolarHBondContact O-N 2.86Å
208	L	95.9	Very high	95.4	Very high	5 Å²	5	43.4 Å²	43.4	3%	0.026	25%	0.25	C	C	.	.			trans	-75.9	125.9	-178.6	-59.9	-178.6	0	0	0	110.7	I197 T199 N204 Y206 I215 L317	I197-L208 HydrophobicContact CD1-CD1 3.83Å; I197-L208 HydrophobicContact CG1-CD1 3.94Å; T199-L208 WeakPolarHBondContact CA-O 3.24Å; T199-L208 WeakPolarHBondContact CB-O 3.46Å; T199-L208 PolarHBondContact OG1-O 2.75Å; N204-L208 PolarHBondContact ND2-N 3.3Å; N204-L208 PolarHBondContact ND2-O 3.17Å; N204-L208 PolarHBondContact OD1-N 2.81Å; Y206-L208 VanDerWaalsContact C-N 3.29Å; Y206-L208 PolarHBondContact O-N 2.71Å; L208-I215 HydrophobicContact CB-CB 4.36Å; L208-I215 HydrophobicContact CB-CG2 4.39Å; L208-L317 HydrophobicContact CD2-CD1 4.25Å; L208-L317 HydrophobicContact CD2-CD2 3.75Å; L208-L317 HydrophobicContact CD2-CG 3.59Å
209	G	95.4	Very high	95.5	Very high	24 Å²	24	43.4 Å²	43.4	25%	0.247	25%	0.25	C	C	.	.	S	Bend	trans	54.8	-159.3	175.4	0	0	0	0	0	114.2	G207 Q213	G207-G209 PolarHBondContact O-N 2.86Å; G209-Q213 WeakPolarHBondContact CA-O 3.15Å
210	S	94.4	Very high	95.4	Very high	49 Å²	49	43.5 Å²	43.5	34%	0.343	25%	0.251	S	S	.	.			trans	-140.4	166.7	177.9	76.9	0	0	0	0	111.4	K212 Q213 P214	S210-K212 PolarHBondContact O-N 3.33Å; S210-K212 PolarHBondContact OG-N 3.26Å; S210-Q213 PolarHBondContact N-O 2.94Å; S210-Q213 CarbonylContact O-C 3.58Å; S210-Q213 PolarHBondContact O-N 3.21Å; S210-Q213 VanDerWaalsContact O-O 3.09Å; S210-Q213 PolarHBondContact OG-N 2.73Å; S210-P214 VanDerWaalsContact O-CA 3.27Å; S210-P214 WeakPolarHBondContact O-CA 3.22Å
211	K	92	Very high	95.3	Very high	197 Å²	197	42.3 Å²	42.3	86%	0.857	24%	0.243	S	C	*	.	S	Bend	trans	-56.6	-26.9	175.9	-69.1	-175.5	179.4	177.8	0	113.6
212	K	91.6	Very high	95.1	Very high	191 Å²	191	42.5 Å²	42.5	83%	0.83	25%	0.247	S	C	*	.	S	Bend	trans	-83	-31.6	177.3	-66.3	-176.3	179.3	-179.6	0	112.3	S210	S210-K212 PolarHBondContact O-N 3.33Å; S210-K212 PolarHBondContact OG-N 3.26Å
213	Q	92.6	Very high	95.2	Very high	71 Å²	71	39.6 Å²	39.6	33%	0.332	23%	0.232	S	C	.	.	S	Bend	trans	-133.7	73.8	-176.9	-76.2	175.6	-28.9	0	0	107.9	G209 S210 F322	G209-Q213 WeakPolarHBondContact CA-O 3.15Å; S210-Q213 PolarHBondContact N-O 2.94Å; S210-Q213 CarbonylContact O-C 3.58Å; S210-Q213 PolarHBondContact O-N 3.21Å; S210-Q213 VanDerWaalsContact O-O 3.09Å; S210-Q213 PolarHBondContact OG-N 2.73Å; Q213-F322 HydrophobicContact CB-CD2 4.09Å; Q213-F322 HydrophobicContact CG-CD2 4.43Å; Q213-F322 PolarHBondContact NE2-O 3.28Å; Q213-F322 PolarHBondContact OE1-O 2.91Å
214	P	95.4	Very high	95.3	Very high	29 Å²	29	36.1 Å²	36.1	19%	0.188	20%	0.196	C	C	.	.			trans	-67.5	145.4	-176.4	27.5	-35	0	0	0	110.2	T199 S210 L302	T199-P214 HydrophobicContact CG2-CB 4.33Å; T199-P214 WeakPolarHBondContact OG1-CA 3.4Å; S210-P214 VanDerWaalsContact O-CA 3.27Å; S210-P214 WeakPolarHBondContact O-CA 3.22Å; P214-L302 WeakPolarHBondContact O-CD2 3.5Å
215	I	97.1	Very high	95.2	Very high	3 Å²	3	36 Å²	36	2%	0.015	20%	0.197	C	C	.	.			trans	-126.5	132.1	173.8	-66.9	178	0	0	0	107.8	G198 T199 L208 F306 V320 F322	G198-I215 CarbonylContact C-O 3.59Å; G198-I215 WeakPolarHBondContact CA-O 3.46Å; T199-I215 PolarHBondContact N-O 2.88Å; T199-I215 PolarHBondContact OG1-N 2.89Å; T199-I215 PolarHBondContact OG1-O 3.34Å; L208-I215 HydrophobicContact CB-CB 4.36Å; L208-I215 HydrophobicContact CB-CG2 4.39Å; I215-F306 HydrophobicContact CD1-CZ 4.18Å; I215-F306 HydrophobicContact CG1-CZ 4.34Å; I215-F306 HydrophobicContact CG2-CE2 4.18Å; I215-F306 HydrophobicContact CG2-CZ 3.82Å; I215-V320 HydrophobicContact CD1-CB 4.45Å; I215-V320 HydrophobicContact CD1-CG1 3.99Å; I215-V320 WeakPolarHBondContact CD1-O 3.33Å; I215-F322 HydrophobicContact CD1-CE2 3.88Å; I215-F322 HydrophobicContact CD1-CZ 4Å; I215-F322 HydrophobicContact CG1-CE2 3.5Å; I215-F322 HydrophobicContact CG1-CZ 3.76Å
216	H	97.9	Very high	95.2	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.009	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	147.2	174.7	-53.5	97.5	0	0	0	109.1	W154 S157 V158 L167 L196 I197 N200 L302	W154-H216 AromaticContact CE3-CE1 3.99Å; S157-H216 PolarHBondContact OG-ND1 3.31Å; V158-H216 VanDerWaalsContact CG1-C 3.43Å; V158-H216 HydrophobicContact CG1-CB 3.36Å; V158-H216 WeakPolarHBondContact CG1-O 3.36Å; L167-H216 WeakPolarHBondContact CD2-O 3.39Å; L196-H216 HydrophobicContact CD1-CB 4.25Å; I197-H216 CarbonylContact O-C 3.53Å; I197-H216 VanDerWaalsContact O-CA 3.25Å; I197-H216 WeakPolarHBondContact O-CA 3.47Å; N200-H216 PolarHBondContact N-NE2 2.72Å; N200-H216 PolarHBondContact OD1-CE1 3.36Å; N200-H216 PolarHBondContact OD1-NE2 3.27Å; H216-L302 HydrophobicContact CB-CD1 3.99Å
217	C	97.9	Very high	94.8	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.014	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	151	176	-64.5	0	0	0	0	110	L169 I197	L169-C217 HydrophobicContact CB-CB 3.82Å; I197-C217 PolarHBondContact N-O 3.15Å; I197-C217 PolarHBondContact O-N 3.4Å
218	L	98.4	Very high	94.5	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	134.1	164.2	-61.9	177.8	0	0	0	109.8	C63 L74 V158 A166 L167 V168 L169 L194 E195 L196	C63-L218 HydrophobicContact CB-CD2 4.43Å; L74-L218 HydrophobicContact CD1-CD1 3.79Å; L74-L218 HydrophobicContact CD1-CD2 4.26Å; L74-L218 HydrophobicContact CD2-CD1 4.32Å; L74-L218 HydrophobicContact CD2-CD2 4.25Å; V158-L218 HydrophobicContact CB-CG 4.42Å; V158-L218 HydrophobicContact CG2-CD1 4.24Å; V158-L218 HydrophobicContact CG2-CD2 3.87Å; V158-L218 HydrophobicContact CG2-CG 3.76Å; A166-L218 HydrophobicContact CB-CD1 3.91Å; L167-L218 PolarHBondContact O-N 2.98Å; V168-L218 CarbonylContact C-O 3.46Å; V168-L218 VanDerWaalsContact CA-O 3.24Å; V168-L218 WeakPolarHBondContact CA-O 3.42Å; V168-L218 HydrophobicContact CG2-CB 4.37Å; L169-L218 PolarHBondContact N-O 3.31Å; L194-L218 HydrophobicContact CB-CB 4.2Å; L194-L218 HydrophobicContact CB-CD2 4.45Å; L194-L218 HydrophobicContact CD2-CB 3.77Å; L194-L218 HydrophobicContact CD2-CD1 4.24Å; E195-L218 CarbonylContact O-C 3.53Å; L196-L218 HydrophobicContact CB-CD2 4.09Å; L196-L218 HydrophobicContact CD1-CD2 3.95Å
219	V	97.9	Very high	94.3	Very high	1 Å²	1	47.5 Å²	47.5	1%	0.006	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	117.6	172	-174.4	0	0	0	0	108.8	L58 L169 L194 E195 I197 H221 S223 I224	L58-V219 HydrophobicContact CD1-CB 3.63Å; L58-V219 HydrophobicContact CD1-CG1 3.45Å; L58-V219 VanDerWaalsContact CD1-CG1 3.45Å; L58-V219 HydrophobicContact CD1-CG2 3.84Å; L169-V219 HydrophobicContact CB-CG2 3.97Å; L169-V219 HydrophobicContact CD2-CG2 3.97Å; L169-V219 HydrophobicContact CG-CG2 4.35Å; L194-V219 CarbonylContact C-O 3.5Å; L194-V219 VanDerWaalsContact CA-O 3.28Å; L194-V219 WeakPolarHBondContact CA-O 3.24Å; E195-V219 PolarHBondContact N-O 2.94Å; E195-V219 PolarHBondContact O-N 2.68Å; I197-V219 HydrophobicContact CD1-CG2 3.7Å; I197-V219 HydrophobicContact CG1-CG2 3.99Å; V219-H221 PolarHBondContact O-N 2.87Å; V219-S223 WeakPolarHBondContact CG1-OG 3.25Å; V219-I224 HydrophobicContact CG1-CD1 4.26Å; V219-I224 HydrophobicContact CG1-CG1 3.85Å
220	P	96.4	Very high	94.3	Very high	17 Å²	17	47.2 Å²	47.2	11%	0.11	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	133.6	176.4	-22.8	33.3	0	0	0	110.6	V168 L194 G222 S223	V168-P220 HydrophobicContact CG1-CG 4.1Å; L194-P220 HydrophobicContact CD2-CB 4.4Å; L194-P220 HydrophobicContact CD2-CG 4.02Å; P220-G222 PolarHBondContact O-N 3.07Å; P220-S223 VanDerWaalsContact O-CB 3.26Å; P220-S223 WeakPolarHBondContact O-CB 3.39Å; P220-S223 PolarHBondContact O-N 2.91Å; P220-S223 PolarHBondContact O-OG 2.96Å
221	H	95.1	Very high	94.3	Very high	39 Å²	39	48.9 Å²	48.9	18%	0.181	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	141	175.9	-77.8	87.9	0	0	0	110.6	V7 T193 L194 E195 V219 S223	V7-H221 HydrophobicContact CG2-CB 4.41Å; V7-H221 WeakPolarHBondContact CG2-CD2 3.17Å; V7-H221 WeakPolarHBondContact CG2-NE2 3.32Å; T193-H221 WeakPolarHBondContact O-CB 3.49Å; T193-H221 PolarHBondContact O-N 2.88Å; T193-H221 PolarHBondContact O-ND1 3.35Å; L194-H221 VanDerWaalsContact C-ND1 3.33Å; L194-H221 WeakPolarHBondContact CA-ND1 3.39Å; L194-H221 PolarHBondContact N-ND1 3.25Å; L194-H221 PolarHBondContact O-CE1 3.2Å; E195-H221 IonicContact OE2-CE1 3.18Å; E195-H221 IonicContact OE2-NE2 3.41Å; E195-H221 PolarHBondContact OE2-NE2 3.41Å; V219-H221 PolarHBondContact O-N 2.87Å; H221-S223 PolarHBondContact O-N 3.3Å
222	G	93	Very high	94.5	Very high	12 Å²	12	40.5 Å²	40.5	12%	0.124	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.5	4.5	-178.7	0	0	0	0	0	114.6	L4 P220 H255	L4-G222 WeakPolarHBondContact CD1-O 3.42Å; P220-G222 PolarHBondContact O-N 3.07Å; G222-H255 WeakPolarHBondContact CA-NE2 3.45Å
223	S	93.7	Very high	94.8	Very high	19 Å²	19	34.5 Å²	34.5	13%	0.133	19%	0.192	C	C	.	.			trans	-83	-27.9	-179.9	63.9	0	0	0	0	114.2	P171 V219 P220 H221 P225	P171-S223 WeakPolarHBondContact CG-O 3.42Å; V219-S223 WeakPolarHBondContact CG1-OG 3.25Å; P220-S223 VanDerWaalsContact O-CB 3.26Å; P220-S223 WeakPolarHBondContact O-CB 3.39Å; P220-S223 PolarHBondContact O-N 2.91Å; P220-S223 PolarHBondContact O-OG 2.96Å; H221-S223 PolarHBondContact O-N 3.3Å; S223-P225 WeakPolarHBondContact O-CD 3.48Å
224	I	95.1	Very high	95	Very high	4 Å²	4	32.8 Å²	32.8	2%	0.021	18%	0.184	C	C	.	.	S	Bend	trans	-100.2	99.8	-175.1	-51.9	-55.8	0	0	0	109.9	T55 E56 L58 P171 L179 V219 L280	T55-I224 CarbonylContact C-O 3.49Å; T55-I224 WeakPolarHBondContact CA-O 3.48Å; T55-I224 WeakPolarHBondContact CB-O 3.37Å; E56-I224 HydrophobicContact CB-CB 4.32Å; E56-I224 HydrophobicContact CB-CG2 4.03Å; E56-I224 HydrophobicContact CG-CG2 3.77Å; E56-I224 PolarHBondContact N-O 2.91Å; E56-I224 WeakPolarHBondContact OE1-CG2 3.19Å; L58-I224 HydrophobicContact CD1-CG1 4.42Å; P171-I224 HydrophobicContact CG-CD1 4.14Å; L179-I224 HydrophobicContact CD2-CD1 3.94Å; V219-I224 HydrophobicContact CG1-CD1 4.26Å; V219-I224 HydrophobicContact CG1-CG1 3.85Å; I224-L280 HydrophobicContact CD1-CD1 4.38Å; I224-L280 HydrophobicContact CG1-CD1 4.27Å; I224-L280 HydrophobicContact CG2-CD1 4.11Å
225	P	94.3	Very high	95.1	Very high	31 Å²	31	35.6 Å²	35.6	20%	0.201	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-69.2	145.3	-178.2	28.1	-34.8	0	0	0	112.2	F53 S223	F53-P225 HydrophobicContact CE2-CB 4.43Å; F53-P225 HydrophobicContact CZ-CB 3.89Å; S223-P225 WeakPolarHBondContact O-CD 3.48Å
226	V	94.3	Very high	95.1	Very high	11 Å²	11	39.7 Å²	39.7	7%	0.067	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-87.7	123.9	162.4	173.1	0	0	0	0	107.8	A54 E56 P229 W240 I252	A54-V226 HydrophobicContact CB-CB 4.32Å; A54-V226 PolarHBondContact O-N 3.39Å; E56-V226 HydrophobicContact CB-CG2 4.47Å; E56-V226 HydrophobicContact CG-CG2 3.83Å; V226-P229 HydrophobicContact CG1-CB 3.96Å; V226-W240 HydrophobicContact CG1-CH2 3.79Å; V226-W240 HydrophobicContact CG1-CZ2 3.68Å; V226-I252 HydrophobicContact CG1-CD1 4.49Å; V226-I252 HydrophobicContact CG2-CG1 4.28Å; V226-I252 HydrophobicContact CG2-CG2 4.48Å
227	R	88	Confident	95.1	Very high	90 Å²	90	39.6 Å²	39.6	34%	0.34	22%	0.215	S	C	.	.	S	Bend	trans	-79.1	130.6	178.5	-68.5	-179.1	171.8	-169	-3.6	110.4	D177	D177-R227 IonicContact OD1-CZ 4Å; D177-R227 IonicContact OD1-NE 2.69Å; D177-R227 IonicContact OD1-NH1 2.78Å; D177-R227 PolarHBondContact OD1-NH1 3.21Å; D177-R227 IonicContact OD1-NH2 3.12Å; D177-R227 PolarHBondContact OD1-NH2 3.36Å; D177-R227 IonicContact OD2-CZ 3.66Å; D177-R227 IonicContact OD2-NH1 2.65Å; D177-R227 PolarHBondContact OD2-NH1 3.18Å; D177-R227 IonicContact OD2-NH2 2.7Å; D177-R227 PolarHBondContact OD2-NH2 3.02Å
228	N	87.9	Confident	95.1	Very high	152 Å²	152	40.5 Å²	40.5	81%	0.813	22%	0.222	S	C	*	.	S	Bend	trans	46.6	57.4	177.6	-55.7	-42.6	0	0	0	112
229	P	91.9	Very high	95	Very high	54 Å²	54	42.9 Å²	42.9	35%	0.351	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-58.1	141	-179.4	29.1	-36.6	0	0	0	109.4	A54 V226	A54-P229 HydrophobicContact CB-CB 3.86Å; A54-P229 HydrophobicContact CB-CG 3.77Å; V226-P229 HydrophobicContact CG1-CB 3.96Å
230	P	94.7	Very high	94.9	Very high	18 Å²	18	43.7 Å²	43.7	12%	0.117	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-63	154.1	174.5	30.6	-37.6	0	0	0	109.9	L236 L237 W240	P230-L236 HydrophobicContact CB-CB 4.45Å; P230-L237 HydrophobicContact CG-CD2 3.49Å; P230-L237 VanDerWaalsContact CG-CD2 3.49Å; P230-L237 HydrophobicContact CG-CG 4Å; P230-W240 HydrophobicContact CB-CB 4.26Å; P230-W240 HydrophobicContact CB-CG 4.39Å; P230-W240 HydrophobicContact CG-CB 3.79Å; P230-W240 HydrophobicContact CG-CD2 4.01Å; P230-W240 HydrophobicContact CG-CE3 4.41Å; P230-W240 HydrophobicContact CG-CG 3.72Å
231	P	95.5	Very high	94.9	Very high	83 Å²	83	43 Å²	43	54%	0.539	24%	0.237	S	C	.	.	P	Polyproline II helix	trans	-53.7	156.8	171.9	-24.4	33.8	0	0	0	112	N233 L236	P231-N233 PolarHBondContact O-N 3.4Å; P231-L236 HydrophobicContact CB-CD1 4.4Å; P231-L236 HydrophobicContact CG-CD1 4.17Å
232	V	96.5	Very high	94.8	Very high	21 Å²	21	46.7 Å²	46.7	13%	0.127	25%	0.254	C	S	.	.	S	Bend	trans	-71.2	78.5	175.5	-179.8	0	0	0	0	110.1	V14 F15 V40 V49 W254	V14-V232 HydrophobicContact CG2-CB 4.45Å; V14-V232 HydrophobicContact CG2-CG1 3.34Å; V14-V232 HydrophobicContact CG2-CG2 4.22Å; F15-V232 HydrophobicContact CE1-CG1 4.48Å; F15-V232 HydrophobicContact CZ-CG1 4.5Å; V40-V232 HydrophobicContact CG1-CG1 4.33Å; V40-V232 HydrophobicContact CG2-CG1 4.32Å; V49-V232 HydrophobicContact CG1-CB 4.34Å; V49-V232 HydrophobicContact CG1-CG1 4.29Å; V49-V232 HydrophobicContact CG1-CG2 3.88Å; V49-V232 HydrophobicContact CG2-CG2 4.06Å; V232-W254 HydrophobicContact CG2-CZ2 4.21Å
233	N	97.3	Very high	94.9	Very high	66 Å²	66	53.5 Å²	53.5	35%	0.353	28%	0.283	S	S	.	.			trans	-139.2	132.8	177.3	174	-81.6	0	0	0	108.3	P231 Q235 L236 L237	P231-N233 PolarHBondContact O-N 3.4Å; N233-Q235 PolarHBondContact O-N 3Å; N233-Q235 PolarHBondContact OD1-N 2.76Å; N233-Q235 VanDerWaalsContact OD1-N 3.15Å; N233-L236 HydrophobicContact CB-CB 4.13Å; N233-L236 HydrophobicContact CB-CD1 4.01Å; N233-L236 HydrophobicContact CB-CG 4.09Å; N233-L236 PolarHBondContact O-N 3.48Å; N233-L236 PolarHBondContact OD1-N 3.03Å; N233-L237 WeakPolarHBondContact O-CB 3.47Å; N233-L237 PolarHBondContact O-N 2.95Å
234	F	97.3	Very high	94.8	Very high	34 Å²	34	55.7 Å²	55.7	15%	0.149	29%	0.293	C	S	.	.	H	α-helix	trans	-59.1	-50	-170.8	-175	-84.7	0	0	0	112.3	F15 A36 T37 E38 S238 L269	F15-F234 HydrophobicContact CD1-CD2 4.47Å; F15-F234 AromaticContact CD2-CD2 3.97Å; F15-F234 HydrophobicContact CD2-CD2 3.97Å; F15-F234 HydrophobicContact CE1-CB 4.02Å; F15-F234 HydrophobicContact CE2-CB 4.38Å; F15-F234 HydrophobicContact CE2-CD2 4.03Å; F15-F234 HydrophobicContact CG-CD2 4.23Å; F15-F234 VanDerWaalsContact CZ-CA 3.45Å; F15-F234 HydrophobicContact CZ-CB 3.9Å; F15-F234 HydrophobicContact CZ-CD2 4.33Å; A36-F234 HydrophobicContact CB-CE2 3.89Å; T37-F234 WeakPolarHBondContact O-CD2 3.22Å; T37-F234 WeakPolarHBondContact O-CE2 3.28Å; E38-F234 HydrophobicContact CB-CB 4.33Å; E38-F234 HydrophobicContact CB-CG 4.37Å; E38-F234 HydrophobicContact CG-CB 4.3Å; E38-F234 HydrophobicContact CG-CD1 3.95Å; E38-F234 HydrophobicContact CG-CD2 4.3Å; E38-F234 HydrophobicContact CG-CE1 4.35Å; E38-F234 HydrophobicContact CG-CG 3.93Å; F234-S238 WeakPolarHBondContact O-CB 3.48Å; F234-S238 PolarHBondContact O-N 2.84Å; F234-L269 HydrophobicContact CD2-CD2 3.88Å; F234-L269 HydrophobicContact CE2-CD2 3.47Å; F234-L269 VanDerWaalsContact CE2-CD2 3.47Å; F234-L269 HydrophobicContact CZ-CD2 3.83Å
235	Q	97.1	Very high	94.6	Very high	88 Å²	88	59.2 Å²	59.2	41%	0.411	32%	0.317	S	S	.	.	H	α-helix	trans	-67	-44.7	-178	-70.5	75.7	14.4	0	0	111.4	E38 N233 L237 S238 S239	E38-Q235 PolarHBondContact OE1-NE2 3.09Å; E38-Q235 PolarHBondContact OE2-NE2 3.44Å; N233-Q235 PolarHBondContact O-N 3Å; N233-Q235 PolarHBondContact OD1-N 2.76Å; N233-Q235 VanDerWaalsContact OD1-N 3.15Å; Q235-L237 PolarHBondContact O-N 3.48Å; Q235-S238 PolarHBondContact O-N 3.31Å; Q235-S239 PolarHBondContact O-N 2.8Å; Q235-S239 PolarHBondContact O-OG 3.15Å
236	L	97.3	Very high	94.5	Very high	89 Å²	89	59.5 Å²	59.5	47%	0.466	32%	0.315	S	S	.	.	H	α-helix	trans	-62.7	-42.6	178.7	-64	-177.6	0	0	0	112.3	P230 P231 N233 W240	P230-L236 HydrophobicContact CB-CB 4.45Å; P231-L236 HydrophobicContact CB-CD1 4.4Å; P231-L236 HydrophobicContact CG-CD1 4.17Å; N233-L236 HydrophobicContact CB-CB 4.13Å; N233-L236 HydrophobicContact CB-CD1 4.01Å; N233-L236 HydrophobicContact CB-CG 4.09Å; N233-L236 PolarHBondContact O-N 3.48Å; N233-L236 PolarHBondContact OD1-N 3.03Å; L236-W240 VanDerWaalsContact O-CB 3.28Å; L236-W240 WeakPolarHBondContact O-CB 3.44Å; L236-W240 PolarHBondContact O-N 3.31Å
237	L	97.6	Very high	94.5	Very high	0 Å²	0	59 Å²	59	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-63.5	-44.1	174.7	-83.3	162	0	0	0	111.2	F15 P230 N233 Q235 W240 F241 I252 W254 I264 L269	F15-L237 HydrophobicContact CE2-CD1 3.76Å; F15-L237 HydrophobicContact CZ-CD1 3.76Å; P230-L237 HydrophobicContact CG-CD2 3.49Å; P230-L237 VanDerWaalsContact CG-CD2 3.49Å; P230-L237 HydrophobicContact CG-CG 4Å; N233-L237 WeakPolarHBondContact O-CB 3.47Å; N233-L237 PolarHBondContact O-N 2.95Å; Q235-L237 PolarHBondContact O-N 3.48Å; L237-W240 PolarHBondContact O-N 2.72Å; L237-F241 HydrophobicContact CD2-CE2 4.25Å; L237-F241 WeakPolarHBondContact O-CD2 3.33Å; L237-F241 PolarHBondContact O-N 3.4Å; L237-I252 HydrophobicContact CD2-CD1 3.9Å; L237-W254 HydrophobicContact CD1-CH2 4.16Å; L237-W254 HydrophobicContact CD2-CH2 4.11Å; L237-W254 HydrophobicContact CD2-CZ2 4.24Å; L237-I264 HydrophobicContact CD2-CG2 4.44Å; L237-L269 HydrophobicContact CB-CD1 4.47Å
238	S	96.9	Very high	94.9	Very high	22 Å²	22	60 Å²	60	15%	0.154	32%	0.316	C	S	.	.	H	α-helix	trans	-59.7	-49.5	178.7	-164.9	0	0	0	0	112	F234 Q235 W240 F241 Q242	F234-S238 WeakPolarHBondContact O-CB 3.48Å; F234-S238 PolarHBondContact O-N 2.84Å; Q235-S238 PolarHBondContact O-N 3.31Å; S238-W240 PolarHBondContact O-N 3.11Å; S238-F241 PolarHBondContact O-N 3.22Å; S238-Q242 WeakPolarHBondContact O-CG 3.2Å; S238-Q242 PolarHBondContact O-N 3.5Å
239	S	96.8	Very high	95.3	Very high	49 Å²	49	53 Å²	53	34%	0.343	28%	0.279	S	S	.	.	H	α-helix	trans	-61.2	-42.8	175.3	-66.6	0	0	0	0	111.7	Q235 F241 Q242 E243	Q235-S239 PolarHBondContact O-N 2.8Å; Q235-S239 PolarHBondContact O-OG 3.15Å; S239-F241 PolarHBondContact O-N 3.5Å; S239-Q242 PolarHBondContact O-N 3.45Å; S239-Q242 VanDerWaalsContact O-N 3.13Å; S239-E243 WeakPolarHBondContact O-CB 3.47Å; S239-E243 PolarHBondContact O-N 3.04Å
240	W	96.7	Very high	95.4	Very high	19 Å²	19	50.6 Å²	50.6	7%	0.072	26%	0.263	C	S	.	.	H	α-helix	trans	-60	-45.1	178.2	-179.2	86.1	0	0	0	112.4	V226 P230 L236 L237 S238 Q242 N244 E246 V249 I252	V226-W240 HydrophobicContact CG1-CH2 3.79Å; V226-W240 HydrophobicContact CG1-CZ2 3.68Å; P230-W240 HydrophobicContact CB-CB 4.26Å; P230-W240 HydrophobicContact CB-CG 4.39Å; P230-W240 HydrophobicContact CG-CB 3.79Å; P230-W240 HydrophobicContact CG-CD2 4.01Å; P230-W240 HydrophobicContact CG-CE3 4.41Å; P230-W240 HydrophobicContact CG-CG 3.72Å; L236-W240 VanDerWaalsContact O-CB 3.28Å; L236-W240 WeakPolarHBondContact O-CB 3.44Å; L236-W240 PolarHBondContact O-N 3.31Å; L237-W240 PolarHBondContact O-N 2.72Å; S238-W240 PolarHBondContact O-N 3.11Å; W240-Q242 PolarHBondContact O-N 3.11Å; W240-N244 HydrophobicContact CG-CB 4.03Å; W240-N244 WeakPolarHBondContact O-CB 3.25Å; W240-N244 PolarHBondContact O-N 3.09Å; W240-N244 VanDerWaalsContact O-N 3.09Å; W240-E246 WeakPolarHBondContact CH2-O 3.14Å; W240-E246 HydrophobicContact CZ2-CB 3.71Å; W240-E246 VanDerWaalsContact CZ2-O 3.26Å; W240-E246 WeakPolarHBondContact CZ2-O 3.4Å; W240-V249 HydrophobicContact CH2-CG2 3.94Å; W240-V249 HydrophobicContact CZ3-CG2 4.03Å; W240-I252 HydrophobicContact CE3-CD1 4.28Å; W240-I252 HydrophobicContact CH2-CD1 4.04Å; W240-I252 HydrophobicContact CH2-CG1 4.29Å; W240-I252 HydrophobicContact CZ3-CD1 3.72Å; W240-I252 HydrophobicContact CZ3-CG1 4.03Å
241	F	96	Very high	95.6	Very high	3 Å²	3	49.7 Å²	49.7	1%	0.013	26%	0.257	C	S	.	.	H	α-helix	trans	-64.2	-24.6	177	-82.8	-65.4	0	0	0	114.3	L237 S238 S239 G247 V249 I252 I264 R266 L269 L271	L237-F241 HydrophobicContact CD2-CE2 4.25Å; L237-F241 WeakPolarHBondContact O-CD2 3.33Å; L237-F241 PolarHBondContact O-N 3.4Å; S238-F241 PolarHBondContact O-N 3.22Å; S239-F241 PolarHBondContact O-N 3.5Å; F241-G247 WeakPolarHBondContact CD1-O 3.44Å; F241-V249 HydrophobicContact CE1-CG2 3.87Å; F241-I252 HydrophobicContact CZ-CD1 4.45Å; F241-I252 HydrophobicContact CZ-CG1 4.1Å; F241-I264 HydrophobicContact CE2-CG1 4.37Å; F241-I264 HydrophobicContact CE2-CG2 3.81Å; F241-I264 HydrophobicContact CZ-CG2 3.83Å; F241-R266 HydrophobicContact CD1-CB 4.11Å; F241-R266 HydrophobicContact CE1-CB 4.31Å; F241-R266 HydrophobicContact CG-CB 4.36Å; F241-R266 PolarHBondContact O-NH2 3.48Å; F241-L269 HydrophobicContact CD2-CD1 3.41Å; F241-L269 VanDerWaalsContact CD2-CD1 3.41Å; F241-L269 HydrophobicContact CE2-CD1 3.74Å; F241-L269 HydrophobicContact CG-CD1 4.47Å; F241-L271 HydrophobicContact CB-CD1 3.44Å; F241-L271 VanDerWaalsContact CB-CD1 3.44Å; F241-L271 HydrophobicContact CG-CD1 4.3Å
242	Q	93.8	Very high	95.7	Very high	115 Å²	115	45.8 Å²	45.8	54%	0.537	23%	0.232	S	C	.	.	H	α-helix	trans	-91.3	-42.8	-177.9	-72.2	179	-19.7	0	0	112.5	S238 S239 W240 L271	S238-Q242 WeakPolarHBondContact O-CG 3.2Å; S238-Q242 PolarHBondContact O-N 3.5Å; S239-Q242 PolarHBondContact O-N 3.45Å; S239-Q242 VanDerWaalsContact O-N 3.13Å; W240-Q242 PolarHBondContact O-N 3.11Å; Q242-L271 HydrophobicContact CG-CD1 3.91Å; Q242-L271 HydrophobicContact CG-CD2 3.77Å
243	E	93.3	Very high	95.7	Very high	156 Å²	156	45.3 Å²	45.3	73%	0.729	23%	0.229	S	C	*	.	H	α-helix	trans	-109.6	-25.2	-163.4	-61	172	-171.1	0	0	112.9	S239	S239-E243 WeakPolarHBondContact O-CB 3.47Å; S239-E243 PolarHBondContact O-N 3.04Å
244	N	93.1	Very high	95.8	Very high	64 Å²	64	42.5 Å²	42.5	34%	0.342	21%	0.213	S	C	.	.			trans	-89.4	139.9	-175.5	-162.5	-64.2	0	0	0	111.8	W240 E246 G247	W240-N244 HydrophobicContact CG-CB 4.03Å; W240-N244 WeakPolarHBondContact O-CB 3.25Å; W240-N244 PolarHBondContact O-N 3.09Å; W240-N244 VanDerWaalsContact O-N 3.09Å; N244-E246 VanDerWaalsContact C-N 3.34Å; N244-E246 PolarHBondContact O-N 3.48Å; N244-E246 VanDerWaalsContact OD1-CB 3.32Å; N244-E246 WeakPolarHBondContact OD1-CB 3.45Å; N244-E246 PolarHBondContact OD1-N 3.27Å; N244-G247 WeakPolarHBondContact O-CA 3.45Å; N244-G247 PolarHBondContact O-N 3.04Å
245	C	90.8	Very high	95.7	Very high	79 Å²	79	41.3 Å²	41.3	53%	0.534	21%	0.208	S	C	.	.	S	Bend	trans	-64.3	-36.5	175.3	56.2	0	0	0	0	112.8	G247 R248	C245-G247 PolarHBondContact O-N 2.99Å; C245-R248 PolarHBondContact O-N 3.35Å
246	E	91.9	Very high	95.6	Very high	36 Å²	36	37.5 Å²	37.5	17%	0.168	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-20.8	171.6	-56.8	-63.4	128.6	0	0	111.4	W240 N244 R248 R279	W240-E246 WeakPolarHBondContact CH2-O 3.14Å; W240-E246 HydrophobicContact CZ2-CB 3.71Å; W240-E246 VanDerWaalsContact CZ2-O 3.26Å; W240-E246 WeakPolarHBondContact CZ2-O 3.4Å; N244-E246 VanDerWaalsContact C-N 3.34Å; N244-E246 PolarHBondContact O-N 3.48Å; N244-E246 VanDerWaalsContact OD1-CB 3.32Å; N244-E246 WeakPolarHBondContact OD1-CB 3.45Å; N244-E246 PolarHBondContact OD1-N 3.27Å; E246-R248 PolarHBondContact O-N 3.04Å; E246-R279 IonicContact OE1-CZ 3.73Å; E246-R279 IonicContact OE1-NE 2.95Å; E246-R279 PolarHBondContact OE1-NE 3.25Å; E246-R279 IonicContact OE1-NH1 2.68Å; E246-R279 IonicContact OE1-NH2 3.24Å; E246-R279 PolarHBondContact OE1-NH2 2.68Å; E246-R279 IonicContact OE2-CZ 2.68Å; E246-R279 IonicContact OE2-NE 3.48Å; E246-R279 PolarHBondContact OE2-NE 3.09Å; E246-R279 IonicContact OE2-NH2 3.31Å; E246-R279 PolarHBondContact OE2-NH2 2.83Å
247	G	94.6	Very high	95.4	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-2.7	176.8	0	0	0	0	0	115.3	F241 N244 C245 V249 R266	F241-G247 WeakPolarHBondContact CD1-O 3.44Å; N244-G247 WeakPolarHBondContact O-CA 3.45Å; N244-G247 PolarHBondContact O-N 3.04Å; C245-G247 PolarHBondContact O-N 2.99Å; G247-V249 PolarHBondContact O-N 2.78Å; G247-R266 PolarHBondContact O-NH1 2.79Å
248	R	95.3	Very high	95.1	Very high	113 Å²	113	43.8 Å²	43.8	43%	0.426	23%	0.225	S	C	.	.			trans	-81.4	50.6	178.3	-60.5	-173.4	-174.3	175	0.6	112.7	C245 E246 P274 E277 T278 R279	C245-R248 PolarHBondContact O-N 3.35Å; E246-R248 PolarHBondContact O-N 3.04Å; R248-P274 HydrophobicContact CB-CB 4.18Å; R248-P274 HydrophobicContact CB-CG 4.34Å; R248-P274 HydrophobicContact CG-CB 4.46Å; R248-E277 WeakPolarHBondContact CD-O 3.39Å; R248-T278 WeakPolarHBondContact O-CA 3.12Å; R248-R279 PolarHBondContact O-N 3.04Å
249	V	96.2	Very high	94.7	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.018	23%	0.228	C	C	.	.	S	Bend	trans	-126.7	163.9	-178	-59.3	0	0	0	0	111.5	E56 W240 F241 G247 G251 R266 R279	E56-V249 HydrophobicContact CG-CG1 3.93Å; E56-V249 WeakPolarHBondContact OE2-CG1 3.5Å; W240-V249 HydrophobicContact CH2-CG2 3.94Å; W240-V249 HydrophobicContact CZ3-CG2 4.03Å; F241-V249 HydrophobicContact CE1-CG2 3.87Å; G247-V249 PolarHBondContact O-N 2.78Å; V249-G251 WeakPolarHBondContact CG2-O 3.34Å; V249-G251 PolarHBondContact O-N 2.93Å; V249-R266 WeakPolarHBondContact O-CD 3.4Å; V249-R266 PolarHBondContact O-NH1 3.48Å; V249-R279 HydrophobicContact CG1-CB 3.56Å; V249-R279 HydrophobicContact CG1-CG 4.26Å
250	E	96	Very high	94.6	Very high	4 Å²	4	43.1 Å²	43.1	2%	0.019	22%	0.222	C	C	.	.	S	Bend	trans	-58.2	-37.9	176.4	-174.9	170.1	-176.8	0	0	113.1	K57 L58 D59 H265 R266 W273	K57-E250 HydrophobicContact CB-CB 4.35Å; K57-E250 HydrophobicContact CD-CG 4.06Å; K57-E250 IonicContact NZ-OE1 2.82Å; K57-E250 PolarHBondContact NZ-OE1 2.8Å; K57-E250 IonicContact NZ-OE2 3.24Å; K57-E250 PolarHBondContact NZ-OE2 3.01Å; K57-E250 VanDerWaalsContact O-CB 3.22Å; K57-E250 WeakPolarHBondContact O-CB 3.45Å; L58-E250 VanDerWaalsContact O-OE2 3.13Å; D59-E250 WeakPolarHBondContact CA-OE2 3.39Å; D59-E250 HydrophobicContact CB-CG 4.47Å; D59-E250 WeakPolarHBondContact CB-OE2 3.3Å; D59-E250 PolarHBondContact N-OE2 2.78Å; E250-H265 WeakPolarHBondContact CG-CE1 3.31Å; E250-H265 PolarHBondContact O-ND1 3.27Å; E250-H265 IonicContact OE1-CD2 3.94Å; E250-H265 IonicContact OE1-CE1 2.97Å; E250-H265 PolarHBondContact OE1-CE1 3.37Å; E250-H265 IonicContact OE1-NE2 3.06Å; E250-H265 PolarHBondContact OE1-NE2 2.9Å; E250-R266 WeakPolarHBondContact O-CB 3.18Å; E250-R266 VanDerWaalsContact O-CG 3.29Å; E250-R266 WeakPolarHBondContact O-CG 3.37Å; E250-R266 PolarHBondContact O-N 2.99Å; E250-W273 VanDerWaalsContact CA-CZ3 3.44Å; E250-W273 HydrophobicContact CB-CE3 4.38Å; E250-W273 HydrophobicContact CB-CH2 3.38Å; E250-W273 HydrophobicContact CB-CZ3 3.25Å; E250-W273 HydrophobicContact CG-CE3 4.3Å; E250-W273 HydrophobicContact CG-CH2 3.98Å; E250-W273 HydrophobicContact CG-CZ3 3.34Å
251	G	96.9	Very high	94.5	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.8	-178.8	-160.7	0	0	0	0	0	111.5	K57 V249 I264	K57-G251 VanDerWaalsContact CB-C 3.44Å; K57-G251 WeakPolarHBondContact CB-O 3.33Å; K57-G251 PolarHBondContact N-O 3.46Å; V249-G251 WeakPolarHBondContact CG2-O 3.34Å; V249-G251 PolarHBondContact O-N 2.93Å; G251-I264 CarbonylContact C-O 3.59Å; G251-I264 WeakPolarHBondContact CA-O 3.32Å
252	I	98.1	Very high	94.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	142.5	175.3	-56	175.6	0	0	0	108	A54 T55 V226 L237 W240 F241 W254 K263 I264	A54-I252 HydrophobicContact CB-CG2 3.83Å; T55-I252 WeakPolarHBondContact O-CA 3.49Å; V226-I252 HydrophobicContact CG1-CD1 4.49Å; V226-I252 HydrophobicContact CG2-CG1 4.28Å; V226-I252 HydrophobicContact CG2-CG2 4.48Å; L237-I252 HydrophobicContact CD2-CD1 3.9Å; W240-I252 HydrophobicContact CE3-CD1 4.28Å; W240-I252 HydrophobicContact CH2-CD1 4.04Å; W240-I252 HydrophobicContact CH2-CG1 4.29Å; W240-I252 HydrophobicContact CZ3-CD1 3.72Å; W240-I252 HydrophobicContact CZ3-CG1 4.03Å; F241-I252 HydrophobicContact CZ-CD1 4.45Å; F241-I252 HydrophobicContact CZ-CG1 4.1Å; I252-W254 HydrophobicContact CB-CE3 4.38Å; I252-W254 HydrophobicContact CB-CH2 3.88Å; I252-W254 HydrophobicContact CB-CZ2 4.07Å; I252-W254 HydrophobicContact CB-CZ3 4.04Å; I252-W254 HydrophobicContact CD1-CH2 4.25Å; I252-W254 HydrophobicContact CD1-CZ2 4.03Å; I252-W254 HydrophobicContact CG2-CD2 3.82Å; I252-W254 HydrophobicContact CG2-CE3 4.05Å; I252-W254 HydrophobicContact CG2-CG 4.47Å; I252-W254 HydrophobicContact CG2-CH2 4.02Å; I252-W254 HydrophobicContact CG2-CZ2 3.76Å; I252-W254 HydrophobicContact CG2-CZ3 4.15Å; I252-K263 CarbonylContact O-C 3.53Å; I252-K263 WeakPolarHBondContact O-CA 3.47Å; I252-K263 WeakPolarHBondContact O-CB 3.28Å; I252-I264 HydrophobicContact CB-CG2 3.99Å; I252-I264 HydrophobicContact CG1-CG2 4.34Å; I252-I264 PolarHBondContact N-O 3.09Å; I252-I264 PolarHBondContact O-N 3.11Å
253	V	97.9	Very high	94.8	Very high	11 Å²	11	39 Å²	39	7%	0.067	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	123.4	164.7	-176.9	0	0	0	0	108.3	I11 T55 K57 L261 I262 K263	I11-V253 HydrophobicContact CD1-CG1 4.35Å; T55-V253 PolarHBondContact N-O 2.81Å; T55-V253 PolarHBondContact O-N 3.02Å; T55-V253 PolarHBondContact OG1-O 2.87Å; K57-V253 HydrophobicContact CB-CG2 3.88Å; K57-V253 HydrophobicContact CG-CG2 3.98Å; V253-L261 HydrophobicContact CG1-CD2 4.33Å; V253-I262 CarbonylContact C-O 3.45Å; V253-I262 WeakPolarHBondContact CA-O 3.48Å; V253-K263 HydrophobicContact CG2-CB 4.15Å
254	W	97.8	Very high	95	Very high	7 Å²	7	31.6 Å²	31.6	3%	0.027	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	127.3	172.1	-68.2	-92.2	0	0	0	110	V14 V49 A52 F53 V232 L237 I252 L261 I262 I264	V14-W254 HydrophobicContact CB-CE3 4.45Å; V14-W254 HydrophobicContact CB-CZ3 3.94Å; V14-W254 HydrophobicContact CG1-CH2 4.28Å; V14-W254 HydrophobicContact CG1-CZ3 4.01Å; V14-W254 HydrophobicContact CG2-CZ3 4.23Å; V49-W254 HydrophobicContact CG2-CB 3.77Å; V49-W254 HydrophobicContact CG2-CD2 4.03Å; V49-W254 HydrophobicContact CG2-CG 3.68Å; A52-W254 HydrophobicContact CB-CB 3.84Å; A52-W254 HydrophobicContact CB-CG 4.43Å; F53-W254 WeakPolarHBondContact O-CA 3.2Å; V232-W254 HydrophobicContact CG2-CZ2 4.21Å; L237-W254 HydrophobicContact CD1-CH2 4.16Å; L237-W254 HydrophobicContact CD2-CH2 4.11Å; L237-W254 HydrophobicContact CD2-CZ2 4.24Å; I252-W254 HydrophobicContact CB-CE3 4.38Å; I252-W254 HydrophobicContact CB-CH2 3.88Å; I252-W254 HydrophobicContact CB-CZ2 4.07Å; I252-W254 HydrophobicContact CB-CZ3 4.04Å; I252-W254 HydrophobicContact CD1-CH2 4.25Å; I252-W254 HydrophobicContact CD1-CZ2 4.03Å; I252-W254 HydrophobicContact CG2-CD2 3.82Å; I252-W254 HydrophobicContact CG2-CE3 4.05Å; I252-W254 HydrophobicContact CG2-CG 4.47Å; I252-W254 HydrophobicContact CG2-CH2 4.02Å; I252-W254 HydrophobicContact CG2-CZ2 3.76Å; I252-W254 HydrophobicContact CG2-CZ3 4.15Å; W254-L261 WeakPolarHBondContact O-CA 3.41Å; W254-I262 HydrophobicContact CB-CB 4.39Å; W254-I262 HydrophobicContact CE3-CG2 4.34Å; W254-I262 PolarHBondContact N-O 2.8Å; W254-I262 PolarHBondContact O-N 2.88Å; W254-I264 HydrophobicContact CH2-CB 4.1Å; W254-I264 HydrophobicContact CH2-CG2 3.45Å; W254-I264 VanDerWaalsContact CH2-CG2 3.45Å; W254-I264 HydrophobicContact CZ3-CB 3.88Å; W254-I264 HydrophobicContact CZ3-CG2 3.56Å
255	H	96.1	Very high	95.1	Very high	10 Å²	10	29.2 Å²	29.2	5%	0.046	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	97.8	175.9	-60.5	-101.9	0	0	0	108.4	L4 G5 A52 F53 T55 G222 L261	L4-H255 HydrophobicContact CB-CB 4.48Å; L4-H255 HydrophobicContact CD2-CB 4.07Å; G5-H255 PolarHBondContact N-ND1 2.88Å; G5-H255 VanDerWaalsContact N-ND1 3.2Å; A52-H255 WeakPolarHBondContact CB-O 2.99Å; F53-H255 HydrophobicContact CB-CB 4.48Å; F53-H255 PolarHBondContact N-O 2.7Å; F53-H255 VanDerWaalsContact N-O 3.15Å; F53-H255 PolarHBondContact O-CD2 3.29Å; F53-H255 PolarHBondContact O-N 3.14Å; T55-H255 PolarHBondContact OG1-CD2 3.37Å; T55-H255 PolarHBondContact OG1-NE2 3.04Å; G222-H255 WeakPolarHBondContact CA-NE2 3.45Å; H255-L261 HydrophobicContact CB-CD2 4.31Å; H255-L261 VanDerWaalsContact ND1-CD2 3.3Å; H255-L261 WeakPolarHBondContact ND1-CD2 3.31Å
256	C	95.1	Very high	95.3	Very high	8 Å²	8	26 Å²	26	5%	0.054	13%	0.132	C	C	.	.			trans	-76.4	156.8	-175.5	-55.7	0	0	0	0	111	A47 A52 D258 G259 T260	A47-C256 HydrophobicContact CB-CB 3.9Å; A47-C256 WeakPolarHBondContact O-CB 3.42Å; A52-C256 HydrophobicContact CB-CB 4.38Å; C256-D258 WeakPolarHBondContact CB-OD1 3.23Å; C256-D258 PolarHBondContact O-N 2.67Å; C256-G259 PolarHBondContact O-N 2.97Å; C256-T260 VanDerWaalsContact CB-O 3.24Å; C256-T260 WeakPolarHBondContact CB-O 3.19Å; C256-T260 PolarHBondContact N-O 3.12Å
257	N	92.4	Very high	95.3	Very high	125 Å²	125	25.7 Å²	25.7	67%	0.668	13%	0.131	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-25.1	-173.6	-72.1	-35.9	0	0	0	113.7	G259	N257-G259 PolarHBondContact O-N 3.28Å
258	D	91	Very high	95.3	Very high	96 Å²	96	27.3 Å²	27.3	51%	0.513	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-2	173.6	69.1	-17.8	0	0	0	113	C256 T260	C256-D258 WeakPolarHBondContact CB-OD1 3.23Å; C256-D258 PolarHBondContact O-N 2.67Å; D258-T260 VanDerWaalsContact C-N 3.33Å; D258-T260 VanDerWaalsContact CG-OG1 3.24Å; D258-T260 WeakPolarHBondContact OD1-CB 3.1Å; D258-T260 PolarHBondContact OD1-N 3.29Å; D258-T260 PolarHBondContact OD1-OG1 3.2Å; D258-T260 WeakPolarHBondContact OD2-CB 3.37Å; D258-T260 PolarHBondContact OD2-OG1 3.14Å
259	G	89.9	Confident	95.3	Very high	20 Å²	20	22.8 Å²	22.8	21%	0.206	12%	0.122	C	C	.	.	S	Bend	trans	81.8	8.3	-175.6	0	0	0	0	0	114.1	R123 C256 N257	R123-G259 PolarHBondContact NH1-O 3.21Å; C256-G259 PolarHBondContact O-N 2.97Å; N257-G259 PolarHBondContact O-N 3.28Å
260	T	93.3	Very high	95	Very high	36 Å²	36	23 Å²	23	22%	0.221	13%	0.126	C	C	.	.			trans	-70.1	137.6	168.7	-63.4	0	0	0	0	109.6	V43 A47 C256 D258 I262	V43-T260 HydrophobicContact CG1-CG2 4.39Å; A47-T260 HydrophobicContact CB-CG2 3.88Å; C256-T260 VanDerWaalsContact CB-O 3.24Å; C256-T260 WeakPolarHBondContact CB-O 3.19Å; C256-T260 PolarHBondContact N-O 3.12Å; D258-T260 VanDerWaalsContact C-N 3.33Å; D258-T260 VanDerWaalsContact CG-OG1 3.24Å; D258-T260 WeakPolarHBondContact OD1-CB 3.1Å; D258-T260 PolarHBondContact OD1-N 3.29Å; D258-T260 PolarHBondContact OD1-OG1 3.2Å; D258-T260 WeakPolarHBondContact OD2-CB 3.37Å; D258-T260 PolarHBondContact OD2-OG1 3.14Å; T260-I262 HydrophobicContact CG2-CD1 3.76Å; T260-I262 HydrophobicContact CG2-CG1 4.19Å
261	L	95.6	Very high	94.8	Very high	15 Å²	15	23.7 Å²	23.7	8%	0.079	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	132.2	172.1	-64.2	-179	0	0	0	108.3	V7 I11 P12 V253 W254 H255	V7-L261 HydrophobicContact CG2-CD1 3.93Å; I11-L261 HydrophobicContact CD1-CB 4.19Å; I11-L261 HydrophobicContact CD1-CD1 3.93Å; I11-L261 HydrophobicContact CG1-CB 4.05Å; I11-L261 HydrophobicContact CG1-CD1 4.21Å; I11-L261 HydrophobicContact CG2-CB 3.87Å; I11-L261 WeakPolarHBondContact CG2-O 3.2Å; P12-L261 WeakPolarHBondContact CD-O 3.41Å; V253-L261 HydrophobicContact CG1-CD2 4.33Å; W254-L261 WeakPolarHBondContact O-CA 3.41Å; H255-L261 HydrophobicContact CB-CD2 4.31Å; H255-L261 VanDerWaalsContact ND1-CD2 3.3Å; H255-L261 WeakPolarHBondContact ND1-CD2 3.31Å
262	I	97.4	Very high	94.5	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	144.7	174	-57.1	-62.2	0	0	0	107.6	P12 V14 V43 A44 V49 V253 W254 T260	P12-I262 HydrophobicContact CG-CD1 3.76Å; V14-I262 VanDerWaalsContact CA-CG2 3.44Å; V14-I262 HydrophobicContact CB-CG2 3.52Å; V14-I262 HydrophobicContact CG2-CG2 3.74Å; V43-I262 HydrophobicContact CG1-CD1 4.11Å; A44-I262 HydrophobicContact CB-CD1 4.01Å; A44-I262 HydrophobicContact CB-CG1 4.08Å; A44-I262 HydrophobicContact CB-CG2 3.93Å; V49-I262 HydrophobicContact CG2-CB 4.37Å; V49-I262 HydrophobicContact CG2-CG2 4.38Å; V253-I262 CarbonylContact C-O 3.45Å; V253-I262 WeakPolarHBondContact CA-O 3.48Å; W254-I262 HydrophobicContact CB-CB 4.39Å; W254-I262 HydrophobicContact CE3-CG2 4.34Å; W254-I262 PolarHBondContact N-O 2.8Å; W254-I262 PolarHBondContact O-N 2.88Å; T260-I262 HydrophobicContact CG2-CD1 3.76Å; T260-I262 HydrophobicContact CG2-CG1 4.19Å
263	K	97.5	Very high	94.1	Very high	37 Å²	37	34.5 Å²	34.5	16%	0.161	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	160.9	176.4	72.6	-179.6	179.2	-145	0	113.6	I11 P12 C13 V14 K57 I252 V253	I11-K263 HydrophobicContact CB-CD 3.98Å; I11-K263 HydrophobicContact CB-CG 4.25Å; I11-K263 HydrophobicContact CG2-CB 3.77Å; I11-K263 HydrophobicContact CG2-CD 4.05Å; I11-K263 HydrophobicContact CG2-CG 3.79Å; I11-K263 WeakPolarHBondContact O-CE 3.44Å; I11-K263 PolarHBondContact O-NZ 2.78Å; P12-K263 PolarHBondContact O-N 2.83Å; C13-K263 CarbonylContact C-O 3.59Å; C13-K263 WeakPolarHBondContact CA-O 3.43Å; V14-K263 PolarHBondContact N-O 3.42Å; K57-K263 HydrophobicContact CD-CD 4.37Å; I252-K263 CarbonylContact O-C 3.53Å; I252-K263 WeakPolarHBondContact O-CA 3.47Å; I252-K263 WeakPolarHBondContact O-CB 3.28Å; V253-K263 HydrophobicContact CG2-CB 4.15Å
264	I	97.9	Very high	93.7	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	139.6	155.7	-172.2	58.1	0	0	0	107.9	V14 F15 A36 L237 F241 G251 I252 W254 H268 L269	V14-I264 HydrophobicContact CG1-CB 3.87Å; V14-I264 HydrophobicContact CG1-CD1 4.21Å; V14-I264 HydrophobicContact CG1-CG1 4.34Å; F15-I264 HydrophobicContact CD2-CD1 3.93Å; F15-I264 HydrophobicContact CE2-CD1 4.36Å; A36-I264 HydrophobicContact CB-CD1 4.37Å; L237-I264 HydrophobicContact CD2-CG2 4.44Å; F241-I264 HydrophobicContact CE2-CG1 4.37Å; F241-I264 HydrophobicContact CE2-CG2 3.81Å; F241-I264 HydrophobicContact CZ-CG2 3.83Å; G251-I264 CarbonylContact C-O 3.59Å; G251-I264 WeakPolarHBondContact CA-O 3.32Å; I252-I264 HydrophobicContact CB-CG2 3.99Å; I252-I264 HydrophobicContact CG1-CG2 4.34Å; I252-I264 PolarHBondContact N-O 3.09Å; I252-I264 PolarHBondContact O-N 3.11Å; W254-I264 HydrophobicContact CH2-CB 4.1Å; W254-I264 HydrophobicContact CH2-CG2 3.45Å; W254-I264 VanDerWaalsContact CH2-CG2 3.45Å; W254-I264 HydrophobicContact CZ3-CB 3.88Å; W254-I264 HydrophobicContact CZ3-CG2 3.56Å; I264-H268 HydrophobicContact CD1-CB 4.03Å; I264-L269 HydrophobicContact CD1-CD2 4.12Å; I264-L269 HydrophobicContact CD1-CG 4.19Å; I264-L269 HydrophobicContact CG1-CD1 4.18Å; I264-L269 HydrophobicContact CG1-CD2 4.44Å; I264-L269 HydrophobicContact CG1-CG 4.21Å
265	H	95.8	Very high	92.7	Very high	13 Å²	13	41.2 Å²	41.2	6%	0.06	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	134.3	170.9	-176.2	-5.3	0	0	0	107.2	E250 H267 H268	E250-H265 WeakPolarHBondContact CG-CE1 3.31Å; E250-H265 PolarHBondContact O-ND1 3.27Å; E250-H265 IonicContact OE1-CD2 3.94Å; E250-H265 IonicContact OE1-CE1 2.97Å; E250-H265 PolarHBondContact OE1-CE1 3.37Å; E250-H265 IonicContact OE1-NE2 3.06Å; E250-H265 PolarHBondContact OE1-NE2 2.9Å; H265-H267 AromaticContact CE1-CE1 3.7Å; H265-H267 AromaticContact CE1-CG 3.6Å; H265-H267 AromaticContact CE1-ND1 2.95Å; H265-H267 PolarHBondContact CE1-ND1 2.68Å; H265-H267 PolarHBondContact ND1-N 2.93Å; H265-H267 AromaticContact ND1-ND1 3.87Å; H265-H267 AromaticContact NE2-CE1 3.96Å; H265-H267 AromaticContact NE2-CG 3.85Å; H265-H267 AromaticContact NE2-ND1 3.03Å; H265-H267 PolarHBondContact NE2-ND1 3.04Å; H265-H267 PolarHBondContact O-N 2.98Å; H265-H267 VanDerWaalsContact O-N 3.09Å; H265-H268 VanDerWaalsContact O-CB 3.31Å; H265-H268 WeakPolarHBondContact O-CB 3.49Å; H265-H268 PolarHBondContact O-N 2.84Å
266	R	94.3	Very high	92	Very high	12 Å²	12	44.2 Å²	44.2	5%	0.045	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-53.6	-31.2	179.6	73.9	-166.9	-61.4	123.3	6.7	114.2	F241 G247 V249 E250 H268 L269 G270 L271 R272	F241-R266 HydrophobicContact CD1-CB 4.11Å; F241-R266 HydrophobicContact CE1-CB 4.31Å; F241-R266 HydrophobicContact CG-CB 4.36Å; F241-R266 PolarHBondContact O-NH2 3.48Å; G247-R266 PolarHBondContact O-NH1 2.79Å; V249-R266 WeakPolarHBondContact O-CD 3.4Å; V249-R266 PolarHBondContact O-NH1 3.48Å; E250-R266 WeakPolarHBondContact O-CB 3.18Å; E250-R266 VanDerWaalsContact O-CG 3.29Å; E250-R266 WeakPolarHBondContact O-CG 3.37Å; E250-R266 PolarHBondContact O-N 2.99Å; R266-H268 VanDerWaalsContact C-N 3.28Å; R266-H268 PolarHBondContact O-N 2.86Å; R266-L269 CarbonylContact O-C 2.95Å; R266-L269 WeakPolarHBondContact O-CA 3.33Å; R266-L269 WeakPolarHBondContact O-CB 3.3Å; R266-L269 PolarHBondContact O-N 3Å; R266-G270 PolarHBondContact O-N 2.95Å; R266-L271 CarbonylContact C-O 3.6Å; R266-L271 HydrophobicContact CB-CB 4.15Å; R266-L271 WeakPolarHBondContact O-CB 3.45Å; R266-L271 PolarHBondContact O-N 2.86Å; R266-R272 WeakPolarHBondContact CD-O 3.08Å; R266-R272 PolarHBondContact NE-O 3.46Å
267	H	92.8	Very high	91.5	Very high	30 Å²	30	47.3 Å²	47.3	14%	0.139	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-63.6	-30.6	173.6	-69.4	139.3	0	0	0	113.3	H265 L269 G270 L271	H265-H267 AromaticContact CE1-CE1 3.7Å; H265-H267 AromaticContact CE1-CG 3.6Å; H265-H267 AromaticContact CE1-ND1 2.95Å; H265-H267 PolarHBondContact CE1-ND1 2.68Å; H265-H267 PolarHBondContact ND1-N 2.93Å; H265-H267 AromaticContact ND1-ND1 3.87Å; H265-H267 AromaticContact NE2-CE1 3.96Å; H265-H267 AromaticContact NE2-CG 3.85Å; H265-H267 AromaticContact NE2-ND1 3.03Å; H265-H267 PolarHBondContact NE2-ND1 3.04Å; H265-H267 PolarHBondContact O-N 2.98Å; H265-H267 VanDerWaalsContact O-N 3.09Å; H267-L269 PolarHBondContact O-N 3.23Å; H267-G270 PolarHBondContact O-N 2.85Å; H267-L271 WeakPolarHBondContact CA-O 3.45Å; H267-L271 PolarHBondContact CD2-O 3.34Å; H267-L271 PolarHBondContact N-O 3.46Å
268	H	94.6	Very high	91.6	Very high	33 Å²	33	41.5 Å²	41.5	15%	0.153	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-65.7	-27.6	173.1	-62.9	170.6	0	0	0	111.3	C13 V35 A36 I264 H265 R266 G270	C13-H268 PolarHBondContact SG-ND1 2.91Å; V35-H268 CarbonylContact C-O 3.5Å; V35-H268 WeakPolarHBondContact CA-O 3.27Å; A36-H268 HydrophobicContact CB-CB 3.89Å; A36-H268 PolarHBondContact N-O 3.46Å; I264-H268 HydrophobicContact CD1-CB 4.03Å; H265-H268 VanDerWaalsContact O-CB 3.31Å; H265-H268 WeakPolarHBondContact O-CB 3.49Å; H265-H268 PolarHBondContact O-N 2.84Å; R266-H268 VanDerWaalsContact C-N 3.28Å; R266-H268 PolarHBondContact O-N 2.86Å; H268-G270 PolarHBondContact O-N 2.79Å
269	L	94.3	Very high	91.8	Very high	18 Å²	18	38.8 Å²	38.8	9%	0.094	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-84.6	8.2	173.5	-54.9	175.1	0	0	0	112.3	F15 A36 F234 L237 F241 I264 R266 H267 L271	F15-L269 HydrophobicContact CE2-CD2 4.5Å; A36-L269 HydrophobicContact CB-CD2 4.29Å; F234-L269 HydrophobicContact CD2-CD2 3.88Å; F234-L269 HydrophobicContact CE2-CD2 3.47Å; F234-L269 VanDerWaalsContact CE2-CD2 3.47Å; F234-L269 HydrophobicContact CZ-CD2 3.83Å; L237-L269 HydrophobicContact CB-CD1 4.47Å; F241-L269 HydrophobicContact CD2-CD1 3.41Å; F241-L269 VanDerWaalsContact CD2-CD1 3.41Å; F241-L269 HydrophobicContact CE2-CD1 3.74Å; F241-L269 HydrophobicContact CG-CD1 4.47Å; I264-L269 HydrophobicContact CD1-CD2 4.12Å; I264-L269 HydrophobicContact CD1-CG 4.19Å; I264-L269 HydrophobicContact CG1-CD1 4.18Å; I264-L269 HydrophobicContact CG1-CD2 4.44Å; I264-L269 HydrophobicContact CG1-CG 4.21Å; R266-L269 CarbonylContact O-C 2.95Å; R266-L269 WeakPolarHBondContact O-CA 3.33Å; R266-L269 WeakPolarHBondContact O-CB 3.3Å; R266-L269 PolarHBondContact O-N 3Å; H267-L269 PolarHBondContact O-N 3.23Å; L269-L271 HydrophobicContact CB-CD1 4.2Å; L269-L271 HydrophobicContact CB-CG 4.06Å; L269-L271 PolarHBondContact O-N 3.2Å
270	G	90.9	Very high	92.1	Very high	9 Å²	9	37.9 Å²	37.9	9%	0.093	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.5	12	-176.2	0	0	0	0	0	114.1	R25 R266 H267 H268	R25-G270 WeakPolarHBondContact CD-O 3.41Å; R25-G270 PolarHBondContact NH1-O 3.38Å; R266-G270 PolarHBondContact O-N 2.95Å; H267-G270 PolarHBondContact O-N 2.85Å; H268-G270 PolarHBondContact O-N 2.79Å
271	L	92.1	Very high	92.2	Very high	18 Å²	18	36.1 Å²	36.1	9%	0.094	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-91.4	139.8	-179.7	-51.9	177.9	0	0	0	110.2	F241 Q242 R266 H267 L269	F241-L271 HydrophobicContact CB-CD1 3.44Å; F241-L271 VanDerWaalsContact CB-CD1 3.44Å; F241-L271 HydrophobicContact CG-CD1 4.3Å; Q242-L271 HydrophobicContact CG-CD1 3.91Å; Q242-L271 HydrophobicContact CG-CD2 3.77Å; R266-L271 CarbonylContact C-O 3.6Å; R266-L271 HydrophobicContact CB-CB 4.15Å; R266-L271 WeakPolarHBondContact O-CB 3.45Å; R266-L271 PolarHBondContact O-N 2.86Å; H267-L271 WeakPolarHBondContact CA-O 3.45Å; H267-L271 PolarHBondContact CD2-O 3.34Å; H267-L271 PolarHBondContact N-O 3.46Å; L269-L271 HydrophobicContact CB-CD1 4.2Å; L269-L271 HydrophobicContact CB-CG 4.06Å; L269-L271 PolarHBondContact O-N 3.2Å
272	R	90.6	Very high	92.1	Very high	175 Å²	175	37 Å²	37	66%	0.66	19%	0.193	S	C	*	.	P	Polyproline II helix	trans	-70.3	167.1	170.9	-66.4	-178.4	179.3	175.1	-0.3	110.6	R266	R266-R272 WeakPolarHBondContact CD-O 3.08Å; R266-R272 PolarHBondContact NE-O 3.46Å
273	W	90.1	Very high	92.1	Very high	52 Å²	52	37.3 Å²	37.3	20%	0.197	19%	0.194	C	C	.	.	S	Bend	trans	-47.8	140.8	162.6	-163.9	-100	0	0	0	110.4	D59 P205 Y206 E250 D275 T278	D59-W273 HydrophobicContact CB-CH2 3.39Å; D59-W273 HydrophobicContact CB-CZ2 4.36Å; D59-W273 HydrophobicContact CB-CZ3 3.57Å; D59-W273 VanDerWaalsContact OD2-CZ3 3.3Å; D59-W273 WeakPolarHBondContact OD2-CZ3 3.13Å; P205-W273 HydrophobicContact CB-CD2 4.37Å; P205-W273 VanDerWaalsContact CB-CE2 3.44Å; P205-W273 HydrophobicContact CB-CH2 4.17Å; P205-W273 HydrophobicContact CB-CZ2 3.41Å; P205-W273 VanDerWaalsContact CB-CZ2 3.41Å; P205-W273 HydrophobicContact CG-CH2 4.44Å; P205-W273 HydrophobicContact CG-CZ2 4.1Å; Y206-W273 HydrophobicContact CE1-CZ2 4.41Å; E250-W273 VanDerWaalsContact CA-CZ3 3.44Å; E250-W273 HydrophobicContact CB-CE3 4.38Å; E250-W273 HydrophobicContact CB-CH2 3.38Å; E250-W273 HydrophobicContact CB-CZ3 3.25Å; E250-W273 HydrophobicContact CG-CE3 4.3Å; E250-W273 HydrophobicContact CG-CH2 3.98Å; E250-W273 HydrophobicContact CG-CZ3 3.34Å; W273-D275 PolarHBondContact O-N 2.89Å; W273-T278 HydrophobicContact CZ2-CG2 4.25Å
274	P	88.4	Confident	92	Very high	14 Å²	14	37.7 Å²	37.7	9%	0.091	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-60.8	135.3	-179.1	14.7	-16.8	0	0	0	110.8	R248	R248-P274 HydrophobicContact CB-CB 4.18Å; R248-P274 HydrophobicContact CB-CG 4.34Å; R248-P274 HydrophobicContact CG-CB 4.46Å
275	D	77.6	Confident	92	Very high	145 Å²	145	37.7 Å²	37.7	78%	0.775	20%	0.2	S	C	*	.	S	Bend	trans	-75.8	138.1	173.5	-63.5	-43.7	0	0	0	109.6	W273	W273-D275 PolarHBondContact O-N 2.89Å
276	G	80.2	Confident	92.1	Very high	72 Å²	72	37.2 Å²	37.2	74%	0.742	20%	0.198	S	C	*	.	S	Bend	trans	82.3	-144.9	178	0	0	0	0	0	114.4	T278	G276-T278 PolarHBondContact O-N 2.89Å
277	E	85.8	Confident	92.1	Very high	74 Å²	74	36.6 Å²	36.6	35%	0.346	20%	0.196	S	C	.	.			trans	-72.5	122.2	-174.2	-64.1	-170.9	155.4	0	0	112.1	R248 R316 Q318	R248-E277 WeakPolarHBondContact CD-O 3.39Å; E277-R316 IonicContact OE1-CZ 2.95Å; E277-R316 IonicContact OE1-NH1 2.85Å; E277-R316 PolarHBondContact OE1-NH1 3.06Å; E277-Q318 PolarHBondContact OE1-NE2 3.21Å
278	T	94.3	Very high	92.2	Very high	3 Å²	3	40 Å²	40	2%	0.018	21%	0.207	C	C	.	.			trans	-75.6	158.2	172.9	60.3	0	0	0	0	111.4	P205 R248 W273 G276 G281 S282	P205-T278 WeakPolarHBondContact O-CG2 3.29Å; R248-T278 WeakPolarHBondContact O-CA 3.12Å; W273-T278 HydrophobicContact CZ2-CG2 4.25Å; G276-T278 PolarHBondContact O-N 2.89Å; T278-G281 PolarHBondContact O-N 2.99Å; T278-G281 PolarHBondContact OG1-N 2.8Å; T278-G281 VanDerWaalsContact OG1-N 3.17Å; T278-S282 WeakPolarHBondContact O-CB 3.32Å; T278-S282 PolarHBondContact O-N 3.33Å; T278-S282 VanDerWaalsContact O-N 3.07Å; T278-S282 PolarHBondContact O-OG 2.83Å
279	R	94.4	Very high	91.9	Very high	39 Å²	39	38.5 Å²	38.5	15%	0.147	20%	0.2	C	C	.	.	H	α-helix	trans	-58.8	-52	177.6	-176.6	55.4	175.9	135.8	0.4	111.1	E56 D177 E246 R248 V249 G281 S282 R283	E56-R279 WeakPolarHBondContact OE1-CG 3.34Å; D177-R279 IonicContact OD1-NH2 3.86Å; D177-R279 PolarHBondContact OD1-NH2 2.71Å; E246-R279 IonicContact OE1-CZ 3.73Å; E246-R279 IonicContact OE1-NE 2.95Å; E246-R279 PolarHBondContact OE1-NE 3.25Å; E246-R279 IonicContact OE1-NH1 2.68Å; E246-R279 IonicContact OE1-NH2 3.24Å; E246-R279 PolarHBondContact OE1-NH2 2.68Å; E246-R279 IonicContact OE2-CZ 2.68Å; E246-R279 IonicContact OE2-NE 3.48Å; E246-R279 PolarHBondContact OE2-NE 3.09Å; E246-R279 IonicContact OE2-NH2 3.31Å; E246-R279 PolarHBondContact OE2-NH2 2.83Å; R248-R279 PolarHBondContact O-N 3.04Å; V249-R279 HydrophobicContact CG1-CB 3.56Å; V249-R279 HydrophobicContact CG1-CG 4.26Å; R279-G281 PolarHBondContact O-N 2.88Å; R279-S282 PolarHBondContact O-N 2.92Å; R279-S282 PolarHBondContact O-OG 2.91Å; R279-S282 VanDerWaalsContact O-OG 3.05Å; R279-R283 WeakPolarHBondContact O-CG 3.25Å; R279-R283 PolarHBondContact O-N 2.92Å
280	L	95.6	Very high	91	Very high	0 Å²	0	40 Å²	40	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.4	-46	178.8	-169.6	77.4	0	0	0	112.5	L58 L169 L179 I197 Y206 I224 S282 R283 L317	L58-L280 HydrophobicContact CD1-CD2 4.5Å; L58-L280 HydrophobicContact CD2-CD2 3.95Å; L169-L280 HydrophobicContact CD2-CD2 4.35Å; L179-L280 HydrophobicContact CD1-CD1 3.85Å; L179-L280 HydrophobicContact CD1-CG 4.31Å; L179-L280 HydrophobicContact CD2-CD1 4.32Å; I197-L280 HydrophobicContact CD1-CD2 3.81Å; Y206-L280 HydrophobicContact CD1-CB 3.84Å; Y206-L280 HydrophobicContact CD1-CD2 3.79Å; Y206-L280 HydrophobicContact CD1-CG 4.36Å; Y206-L280 HydrophobicContact CD2-CD2 4.39Å; Y206-L280 HydrophobicContact CE1-CB 3.99Å; Y206-L280 HydrophobicContact CE1-CD2 3.88Å; Y206-L280 HydrophobicContact CE2-CD2 4.47Å; Y206-L280 HydrophobicContact CG-CD2 4.04Å; I224-L280 HydrophobicContact CD1-CD1 4.38Å; I224-L280 HydrophobicContact CG1-CD1 4.27Å; I224-L280 HydrophobicContact CG2-CD1 4.11Å; L280-S282 VanDerWaalsContact C-N 3.3Å; L280-S282 PolarHBondContact O-N 3.16Å; L280-R283 PolarHBondContact O-N 3.19Å; L280-L317 HydrophobicContact CD2-CD2 4.41Å; L280-L317 HydrophobicContact CG-CD2 4.1Å
281	G	95.5	Very high	89.7	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-67	-27.9	-175.9	0	0	0	0	0	114.4	T278 R279 L317 Q318	T278-G281 PolarHBondContact O-N 2.99Å; T278-G281 PolarHBondContact OG1-N 2.8Å; T278-G281 VanDerWaalsContact OG1-N 3.17Å; R279-G281 PolarHBondContact O-N 2.88Å; G281-L317 PolarHBondContact O-N 3.01Å; G281-Q318 PolarHBondContact O-N 2.93Å
282	S	95.2	Very high	88.4	Confident	33 Å²	33	45.2 Å²	45.2	23%	0.231	28%	0.275	C	S	.	.	H	α-helix	trans	-86.5	-9.3	179.5	57.2	0	0	0	0	114.5	T278 R279 L280	T278-S282 WeakPolarHBondContact O-CB 3.32Å; T278-S282 PolarHBondContact O-N 3.33Å; T278-S282 VanDerWaalsContact O-N 3.07Å; T278-S282 PolarHBondContact O-OG 2.83Å; R279-S282 PolarHBondContact O-N 2.92Å; R279-S282 PolarHBondContact O-OG 2.91Å; R279-S282 VanDerWaalsContact O-OG 3.05Å; L280-S282 VanDerWaalsContact C-N 3.3Å; L280-S282 PolarHBondContact O-N 3.16Å
283	R	95.6	Very high	87.2	Confident	7 Å²	7	37.8 Å²	37.8	3%	0.026	25%	0.25	C	C	.	.	S	Bend	trans	-71.9	144.1	-179.4	-77.9	172	65	165.6	1.2	111.9	D176 D177 L179 R279 L280 R316 L317	D176-R283 PolarHBondContact O-NH2 3.15Å; D177-R283 PolarHBondContact O-NE 2.83Å; D177-R283 PolarHBondContact O-NH2 2.87Å; D177-R283 VanDerWaalsContact O-NH2 3.08Å; L179-R283 HydrophobicContact CD1-CB 3.74Å; L179-R283 VanDerWaalsContact CD2-CZ 3.46Å; L179-R283 HydrophobicContact CG-CB 4.06Å; R279-R283 WeakPolarHBondContact O-CG 3.25Å; R279-R283 PolarHBondContact O-N 2.92Å; L280-R283 PolarHBondContact O-N 3.19Å; R283-R316 CarbonylContact O-C 3.45Å; R283-R316 VanDerWaalsContact O-CA 3.28Å; R283-R316 WeakPolarHBondContact O-CA 3.46Å; R283-L317 PolarHBondContact O-N 3.31Å
284	P	96.9	Very high	86.1	Confident	45 Å²	45	39.1 Å²	39.1	29%	0.292	27%	0.272	S	S	.	.			trans	-61.5	148.6	174	27.1	-33.6	0	0	0	110.7	L178 L179 F314 S315	L178-P284 HydrophobicContact CD1-CB 4.07Å; L178-P284 HydrophobicContact CD1-CG 4.37Å; L179-P284 PolarHBondContact N-O 3.5Å; P284-F314 WeakPolarHBondContact CA-O 3.31Å; P284-S315 VanDerWaalsContact CA-O 3.28Å; P284-S315 WeakPolarHBondContact CA-O 3.49Å
285	A	97.4	Very high	85.4	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	151.9	-177.9	0	0	0	0	0	112.1	L179 R313 F314 L317 V320	L179-A285 HydrophobicContact CB-CB 4.37Å; L179-A285 CarbonylContact O-C 3.58Å; L179-A285 VanDerWaalsContact O-CA 3.24Å; L179-A285 WeakPolarHBondContact O-CA 3.36Å; A285-R313 CarbonylContact O-C 3.59Å; A285-R313 WeakPolarHBondContact O-CA 3.29Å; A285-F314 PolarHBondContact N-O 3.34Å; A285-F314 PolarHBondContact O-N 2.94Å; A285-L317 HydrophobicContact CB-CB 4.32Å; A285-L317 HydrophobicContact CB-CD1 3.89Å; A285-V320 HydrophobicContact CB-CG2 4.33Å
286	V	96.8	Very high	85.5	Confident	2 Å²	2	34.8 Å²	34.8	1%	0.012	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	141.9	170.5	64.5	0	0	0	0	109.4	L178 L179 E180 I181 R288 Q312 R313	L178-V286 HydrophobicContact CD1-CB 4.36Å; L178-V286 HydrophobicContact CD1-CG1 4.31Å; L178-V286 HydrophobicContact CD2-CB 4.35Å; L178-V286 HydrophobicContact CD2-CG1 3.73Å; L178-V286 HydrophobicContact CG-CG1 4.04Å; L179-V286 PolarHBondContact O-N 3Å; E180-V286 WeakPolarHBondContact CA-O 3.37Å; E180-V286 HydrophobicContact CB-CG1 4.26Å; E180-V286 HydrophobicContact CG-CG1 4.28Å; I181-V286 PolarHBondContact N-O 3.03Å; V286-R288 HydrophobicContact CG1-CG 4.23Å; V286-R288 HydrophobicContact CG2-CG 3.98Å; V286-Q312 WeakPolarHBondContact CA-O 3.21Å; V286-Q312 WeakPolarHBondContact CG2-O 3.47Å; V286-R313 HydrophobicContact CB-CG 4.2Å; V286-R313 HydrophobicContact CG2-CG 3.83Å
287	V	96.2	Very high	85.2	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	123.1	171.2	178.8	0	0	0	0	108.4	I181 L289 F306 L309 G311 Q312 F314	I181-V287 HydrophobicContact CB-CG2 4.34Å; I181-V287 WeakPolarHBondContact O-CA 3.23Å; V287-L289 HydrophobicContact CG1-CD2 4.37Å; V287-L289 HydrophobicContact CG1-CG 4.06Å; V287-F306 HydrophobicContact CG1-CB 4.47Å; V287-F306 HydrophobicContact CG1-CD1 3.93Å; V287-F306 HydrophobicContact CG2-CD1 3.89Å; V287-F306 HydrophobicContact CG2-CE1 4.07Å; V287-L309 HydrophobicContact CB-CB 4.25Å; V287-L309 WeakPolarHBondContact CB-O 3.28Å; V287-L309 HydrophobicContact CG1-CB 4.18Å; V287-L309 HydrophobicContact CG2-CB 4.06Å; V287-G311 WeakPolarHBondContact O-CA 3.38Å; V287-G311 PolarHBondContact O-N 3.02Å; V287-Q312 PolarHBondContact N-O 3.41Å; V287-F314 HydrophobicContact CG2-CE2 4.02Å
288	R	93.9	Very high	84.6	Confident	101 Å²	101	37.9 Å²	37.9	38%	0.381	26%	0.26	S	S	.	.			trans	-136.4	88.4	177	-65.5	-168.7	-176.4	-155.7	10.2	110.3	D174 E180 I181 T182 V286 G290 N310	D174-R288 IonicContact OD2-NH2 3.1Å; E180-R288 HydrophobicContact CG-CB 4.07Å; E180-R288 HydrophobicContact CG-CG 4.35Å; I181-R288 PolarHBondContact O-N 3.12Å; T182-R288 WeakPolarHBondContact CA-O 3.48Å; T182-R288 VanDerWaalsContact CB-O 3.22Å; T182-R288 WeakPolarHBondContact CB-O 3.19Å; T182-R288 PolarHBondContact OG1-O 3.06Å; V286-R288 HydrophobicContact CG1-CG 4.23Å; V286-R288 HydrophobicContact CG2-CG 3.98Å; R288-G290 PolarHBondContact O-N 3Å; R288-G290 VanDerWaalsContact O-N 3.17Å; R288-N310 WeakPolarHBondContact CA-OD1 3.38Å
289	L	89.1	Confident	83.7	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	26%	0.263	C	S	.	.			trans	-81.7	20.2	179.8	-61	-173.3	0	0	0	113.8	L167 A183 V287 Y296 F306 N310	L167-L289 HydrophobicContact CD1-CD2 4.21Å; A183-L289 HydrophobicContact CB-CD2 4.26Å; V287-L289 HydrophobicContact CG1-CD2 4.37Å; V287-L289 HydrophobicContact CG1-CG 4.06Å; L289-Y296 HydrophobicContact CB-CD2 3.94Å; L289-Y296 HydrophobicContact CB-CE2 4.05Å; L289-Y296 HydrophobicContact CD1-CD2 4.08Å; L289-Y296 VanDerWaalsContact O-CE2 3.23Å; L289-Y296 WeakPolarHBondContact O-CE2 3.15Å; L289-F306 HydrophobicContact CD1-CB 3.78Å; L289-F306 HydrophobicContact CD2-CB 4.3Å; L289-F306 HydrophobicContact CG-CB 4.42Å; L289-N310 PolarHBondContact N-OD1 3.39Å
290	G	73.9	Confident	82.8	Confident	50 Å²	50	45.7 Å²	45.7	52%	0.515	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	59.7	-170	177.9	0	0	0	0	0	114.8	R288 A292	R288-G290 PolarHBondContact O-N 3Å; R288-G290 VanDerWaalsContact O-N 3.17Å; G290-A292 PolarHBondContact O-N 3.49Å
291	G	63.2	Low	82.3	Confident	96 Å²	96	47.4 Å²	47.4	99%	0.99	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-73.4	-6.2	-174.4	0	0	0	0	0	115.7
292	A	65.9	Low	82	Confident	41 Å²	41	47.9 Å²	47.9	34%	0.339	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-100.1	13.5	-178.7	0	0	0	0	0	113.5	G290 A294 A295 Y296	G290-A292 PolarHBondContact O-N 3.49Å; A292-A294 PolarHBondContact O-N 3.42Å; A292-A295 WeakPolarHBondContact O-CB 3.33Å; A292-A295 PolarHBondContact O-N 2.94Å; A292-Y296 HydrophobicContact CB-CE1 4.26Å; A292-Y296 HydrophobicContact CB-CE2 4.16Å; A292-Y296 PolarHBondContact O-N 3.24Å
293	S	66.1	Low	81.7	Confident	19 Å²	19	46.7 Å²	46.7	13%	0.133	31%	0.31	C	S	.	.	H	α-helix	trans	-49.9	-35.6	-178.4	-166.1	0	0	0	0	113.9	Y296 S297 S307 N310	S293-Y296 PolarHBondContact O-N 2.91Å; S293-S297 PolarHBondContact O-N 3.31Å; S293-S297 PolarHBondContact O-OG 2.89Å; S293-S307 PolarHBondContact O-OG 2.99Å; S293-S307 PolarHBondContact OG-OG 2.92Å; S293-N310 PolarHBondContact OG-ND2 3.23Å
294	A	65.5	Low	81.4	Confident	80 Å²	80	47.5 Å²	47.5	66%	0.661	32%	0.317	S	S	*	.	H	α-helix	trans	-64.7	-38.5	177.1	0	0	0	0	0	112.9	A292 Y296 S297	A292-A294 PolarHBondContact O-N 3.42Å; A294-Y296 PolarHBondContact O-N 3.09Å; A294-S297 PolarHBondContact O-N 3.41Å
295	A	73.9	Confident	81.1	Confident	47 Å²	47	50.4 Å²	50.4	39%	0.388	32%	0.322	S	S	.	.	H	α-helix	trans	-69.2	-24.5	176.9	0	0	0	0	0	112.3	A292	A292-A295 WeakPolarHBondContact O-CB 3.33Å; A292-A295 PolarHBondContact O-N 2.94Å
296	Y	80.3	Confident	80.8	Confident	21 Å²	21	50.4 Å²	50.4	8%	0.082	32%	0.322	C	S	.	.	H	α-helix	trans	-78.1	-26.8	177.4	-55.3	-33.1	0	0	0	113.1	L163 V165 A183 L289 A292 S293 A294 D298 S299 S304	L163-Y296 HydrophobicContact CD1-CD1 3.64Å; L163-Y296 HydrophobicContact CD1-CE1 3.99Å; V165-Y296 HydrophobicContact CG2-CE1 4.1Å; A183-Y296 HydrophobicContact CB-CE2 3.74Å; L289-Y296 HydrophobicContact CB-CD2 3.94Å; L289-Y296 HydrophobicContact CB-CE2 4.05Å; L289-Y296 HydrophobicContact CD1-CD2 4.08Å; L289-Y296 VanDerWaalsContact O-CE2 3.23Å; L289-Y296 WeakPolarHBondContact O-CE2 3.15Å; A292-Y296 HydrophobicContact CB-CE1 4.26Å; A292-Y296 HydrophobicContact CB-CE2 4.16Å; A292-Y296 PolarHBondContact O-N 3.24Å; S293-Y296 PolarHBondContact O-N 2.91Å; A294-Y296 PolarHBondContact O-N 3.09Å; Y296-D298 PolarHBondContact O-N 3.03Å; Y296-S299 WeakPolarHBondContact O-CB 3.47Å; Y296-S299 PolarHBondContact O-N 3.36Å; Y296-S299 PolarHBondContact O-OG 2.75Å; Y296-S304 WeakPolarHBondContact O-CA 3.49Å; Y296-S304 WeakPolarHBondContact O-CB 3.29Å; Y296-S304 PolarHBondContact O-N 2.94Å
297	S	72.9	Confident	80.6	Confident	61 Å²	61	51 Å²	51	43%	0.427	33%	0.326	S	S	.	.	H	α-helix	trans	-59.4	-31.2	175.9	-59.6	0	0	0	0	112.7	S293 A294 S299 S304 S307	S293-S297 PolarHBondContact O-N 3.31Å; S293-S297 PolarHBondContact O-OG 2.89Å; A294-S297 PolarHBondContact O-N 3.41Å; S297-S299 VanDerWaalsContact C-N 3.35Å; S297-S304 WeakPolarHBondContact O-CB 3.37Å; S297-S307 PolarHBondContact OG-OG 2.8Å
298	D	73.1	Confident	80.4	Confident	150 Å²	150	55.5 Å²	55.5	80%	0.802	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-4.7	179.4	-61.8	-28.5	0	0	0	112.8	Y296	Y296-D298 PolarHBondContact O-N 3.03Å
299	S	77.1	Confident	80.3	Confident	12 Å²	12	51.2 Å²	51.2	8%	0.084	34%	0.34	C	S	.	.	S	Bend	trans	-74.4	147.9	176.1	73.3	0	0	0	0	112.4	D160 Y296 S297 L303 S304	D160-S299 WeakPolarHBondContact OD2-CB 3.37Å; Y296-S299 WeakPolarHBondContact O-CB 3.47Å; Y296-S299 PolarHBondContact O-N 3.36Å; Y296-S299 PolarHBondContact O-OG 2.75Å; S297-S299 VanDerWaalsContact C-N 3.35Å; S299-L303 WeakPolarHBondContact OG-CB 3.32Å; S299-S304 WeakPolarHBondContact O-CB 3.32Å; S299-S304 PolarHBondContact O-OG 2.75Å; S299-S304 PolarHBondContact OG-N 3Å
300	E	75.1	Confident	80.6	Confident	193 Å²	193	54.3 Å²	54.3	90%	0.902	36%	0.357	S	S	*	.	S	Bend	trans	-82.4	127.3	167.7	-65.6	-168.6	164.2	0	0	110.1
301	G	84	Confident	81.5	Confident	37 Å²	37	54.5 Å²	54.5	38%	0.381	36%	0.359	S	S	.	.	S	Bend	trans	112.6	-149.9	169.2	0	0	0	0	0	114.9	L303 S304 W305	G301-L303 VanDerWaalsContact C-N 3.32Å; G301-L303 PolarHBondContact O-N 3.25Å; G301-S304 PolarHBondContact O-N 3.08Å; G301-S304 PolarHBondContact O-OG 2.93Å; G301-W305 PolarHBondContact O-N 3.22Å
302	L	89.1	Confident	83	Confident	10 Å²	10	54 Å²	54	5%	0.052	33%	0.331	C	S	.	.	H	α-helix	trans	-64.9	-33.9	-169.5	-70.3	178.5	0	0	0	113.2	V158 L167 P214 H216 S304 W305 F306	V158-L302 HydrophobicContact CG1-CD1 4.23Å; L167-L302 HydrophobicContact CD2-CB 4.05Å; L167-L302 HydrophobicContact CD2-CD1 4.36Å; P214-L302 WeakPolarHBondContact O-CD2 3.5Å; H216-L302 HydrophobicContact CB-CD1 3.99Å; L302-S304 PolarHBondContact O-N 3.32Å; L302-W305 HydrophobicContact CD2-CE3 3.92Å; L302-W305 HydrophobicContact CD2-CZ3 4.32Å; L302-W305 WeakPolarHBondContact O-CB 3.11Å; L302-W305 PolarHBondContact O-N 3.5Å; L302-W305 VanDerWaalsContact O-N 3.13Å; L302-F306 VanDerWaalsContact O-CD2 3.32Å; L302-F306 WeakPolarHBondContact O-CD2 3.21Å; L302-F306 PolarHBondContact O-N 2.76Å
303	L	88.9	Confident	84.5	Confident	8 Å²	8	59.2 Å²	59.2	4%	0.042	34%	0.342	C	S	.	.	H	α-helix	trans	-62.1	-41.3	-178.2	-76.2	165.1	0	0	0	112.4	D160 V165 L167 A183 S299 G301 W305 F306 S307	D160-L303 HydrophobicContact CB-CD1 3.64Å; V165-L303 HydrophobicContact CG2-CD1 3.66Å; L167-L303 HydrophobicContact CB-CD2 4.34Å; L167-L303 HydrophobicContact CD1-CD2 4.13Å; A183-L303 HydrophobicContact CB-CD2 3.84Å; S299-L303 WeakPolarHBondContact OG-CB 3.32Å; G301-L303 VanDerWaalsContact C-N 3.32Å; G301-L303 PolarHBondContact O-N 3.25Å; L303-W305 VanDerWaalsContact C-N 3.31Å; L303-W305 PolarHBondContact O-N 3.31Å; L303-F306 PolarHBondContact O-N 2.67Å; L303-S307 PolarHBondContact O-N 3.13Å
304	S	89.3	Confident	85.9	Confident	24 Å²	24	59.6 Å²	59.6	17%	0.168	34%	0.341	C	S	.	.	H	α-helix	trans	-67.4	-33.6	174.6	52.4	0	0	0	0	112.4	Y296 S297 S299 G301 L302 F306 S307 P308	Y296-S304 WeakPolarHBondContact O-CA 3.49Å; Y296-S304 WeakPolarHBondContact O-CB 3.29Å; Y296-S304 PolarHBondContact O-N 2.94Å; S297-S304 WeakPolarHBondContact O-CB 3.37Å; S299-S304 WeakPolarHBondContact O-CB 3.32Å; S299-S304 PolarHBondContact O-OG 2.75Å; S299-S304 PolarHBondContact OG-N 3Å; G301-S304 PolarHBondContact O-N 3.08Å; G301-S304 PolarHBondContact O-OG 2.93Å; L302-S304 PolarHBondContact O-N 3.32Å; S304-F306 VanDerWaalsContact C-N 3.34Å; S304-F306 PolarHBondContact O-N 3.12Å; S304-S307 WeakPolarHBondContact O-CB 3.38Å; S304-S307 PolarHBondContact O-N 3.27Å; S304-P308 VanDerWaalsContact O-CD 3.26Å; S304-P308 WeakPolarHBondContact O-CD 3.45Å
305	W	90.8	Very high	87.4	Confident	106 Å²	106	60 Å²	60	40%	0.402	34%	0.339	S	S	.	.	H	α-helix	trans	-68.4	-32.7	176.8	-64.6	8	0	0	0	112.5	G301 L302 L303 P308 F322	G301-W305 PolarHBondContact O-N 3.22Å; L302-W305 HydrophobicContact CD2-CE3 3.92Å; L302-W305 HydrophobicContact CD2-CZ3 4.32Å; L302-W305 WeakPolarHBondContact O-CB 3.11Å; L302-W305 PolarHBondContact O-N 3.5Å; L302-W305 VanDerWaalsContact O-N 3.13Å; L303-W305 VanDerWaalsContact C-N 3.31Å; L303-W305 PolarHBondContact O-N 3.31Å; W305-P308 WeakPolarHBondContact O-CD 3.36Å; W305-F322 HydrophobicContact CB-CD1 3.71Å; W305-F322 HydrophobicContact CB-CD2 4.27Å; W305-F322 HydrophobicContact CB-CE1 3.49Å; W305-F322 VanDerWaalsContact CB-CE1 3.49Å; W305-F322 HydrophobicContact CB-CE2 4.11Å; W305-F322 HydrophobicContact CB-CG 4.09Å; W305-F322 HydrophobicContact CB-CZ 3.7Å; W305-F322 HydrophobicContact CD2-CD2 4.37Å; W305-F322 HydrophobicContact CD2-CE2 4.34Å; W305-F322 AromaticContact CE3-CD2 3.62Å; W305-F322 HydrophobicContact CE3-CD2 3.62Å; W305-F322 AromaticContact CE3-CE2 3.43Å; W305-F322 HydrophobicContact CE3-CE2 3.43Å; W305-F322 VanDerWaalsContact CE3-CE2 3.43Å; W305-F322 HydrophobicContact CE3-CG 4.42Å; W305-F322 HydrophobicContact CE3-CZ 4.09Å; W305-F322 HydrophobicContact CZ3-CD2 4.29Å; W305-F322 HydrophobicContact CZ3-CE2 4.19Å; W305-F322 WeakPolarHBondContact O-CD1 3.45Å; W305-F322 VanDerWaalsContact O-CE1 3.28Å; W305-F322 WeakPolarHBondContact O-CE1 3.46Å
306	F	92.7	Very high	88.5	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-79.6	-17	175.2	-84.9	-81.6	0	0	0	113.9	L167 I181 I215 V287 L289 L302 L303 S304 L309 N310 V320 F322	L167-F306 HydrophobicContact CD1-CD2 4.18Å; L167-F306 HydrophobicContact CD1-CG 4.46Å; L167-F306 HydrophobicContact CD2-CD2 3.63Å; L167-F306 HydrophobicContact CD2-CE2 3.49Å; L167-F306 VanDerWaalsContact CD2-CE2 3.49Å; L167-F306 HydrophobicContact CD2-CZ 4.38Å; I181-F306 HydrophobicContact CB-CE1 4.46Å; I181-F306 HydrophobicContact CD1-CE1 3.75Å; I181-F306 HydrophobicContact CD1-CZ 4.08Å; I181-F306 HydrophobicContact CG2-CD1 4.03Å; I181-F306 HydrophobicContact CG2-CE1 3.77Å; I181-F306 HydrophobicContact CG2-CZ 4.11Å; I215-F306 HydrophobicContact CD1-CZ 4.18Å; I215-F306 HydrophobicContact CG1-CZ 4.34Å; I215-F306 HydrophobicContact CG2-CE2 4.18Å; I215-F306 HydrophobicContact CG2-CZ 3.82Å; V287-F306 HydrophobicContact CG1-CB 4.47Å; V287-F306 HydrophobicContact CG1-CD1 3.93Å; V287-F306 HydrophobicContact CG2-CD1 3.89Å; V287-F306 HydrophobicContact CG2-CE1 4.07Å; L289-F306 HydrophobicContact CD1-CB 3.78Å; L289-F306 HydrophobicContact CD2-CB 4.3Å; L289-F306 HydrophobicContact CG-CB 4.42Å; L302-F306 VanDerWaalsContact O-CD2 3.32Å; L302-F306 WeakPolarHBondContact O-CD2 3.21Å; L302-F306 PolarHBondContact O-N 2.76Å; L303-F306 PolarHBondContact O-N 2.67Å; S304-F306 VanDerWaalsContact C-N 3.34Å; S304-F306 PolarHBondContact O-N 3.12Å; F306-L309 HydrophobicContact CD1-CD1 4.1Å; F306-L309 HydrophobicContact CE1-CD1 4.35Å; F306-L309 WeakPolarHBondContact O-CA 3.37Å; F306-L309 WeakPolarHBondContact O-CB 3.11Å; F306-L309 PolarHBondContact O-N 3.49Å; F306-N310 PolarHBondContact O-N 2.9Å; F306-V320 HydrophobicContact CE1-CG1 3.7Å; F306-V320 HydrophobicContact CZ-CG1 4.16Å; F306-F322 HydrophobicContact CD1-CE1 4.16Å; F306-F322 AromaticContact CD2-CE1 3.78Å; F306-F322 HydrophobicContact CD2-CE1 3.78Å; F306-F322 AromaticContact CD2-CZ 3.76Å; F306-F322 HydrophobicContact CD2-CZ 3.76Å; F306-F322 HydrophobicContact CE1-CE1 4.27Å; F306-F322 HydrophobicContact CE1-CZ 4.5Å; F306-F322 AromaticContact CE2-CE1 3.89Å; F306-F322 HydrophobicContact CE2-CE1 3.89Å; F306-F322 AromaticContact CE2-CZ 3.5Å; F306-F322 HydrophobicContact CE2-CZ 3.5Å; F306-F322 AromaticContact CG-CE1 3.91Å; F306-F322 HydrophobicContact CG-CE1 3.91Å; F306-F322 HydrophobicContact CG-CZ 4.35Å; F306-F322 HydrophobicContact CZ-CE1 4.14Å; F306-F322 AromaticContact CZ-CZ 3.91Å; F306-F322 HydrophobicContact CZ-CZ 3.91Å
307	S	91.3	Very high	89.3	Confident	13 Å²	13	61 Å²	61	9%	0.091	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-56.6	-46.6	-178.9	-173	0	0	0	0	113.7	S293 S297 L303 S304 L309 N310	S293-S307 PolarHBondContact O-OG 2.99Å; S293-S307 PolarHBondContact OG-OG 2.92Å; S297-S307 PolarHBondContact OG-OG 2.8Å; L303-S307 PolarHBondContact O-N 3.13Å; S304-S307 WeakPolarHBondContact O-CB 3.38Å; S304-S307 PolarHBondContact O-N 3.27Å; S307-L309 PolarHBondContact O-N 3.27Å; S307-N310 WeakPolarHBondContact O-CB 3.45Å; S307-N310 PolarHBondContact O-N 3.04Å; S307-N310 VanDerWaalsContact O-N 3.16Å
308	P	91.7	Very high	90.3	Very high	96 Å²	96	60.6 Å²	60.6	62%	0.623	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-64	-20.2	174.1	-22	33.7	0	0	0	114.6	S304 W305 Q312	S304-P308 VanDerWaalsContact O-CD 3.26Å; S304-P308 WeakPolarHBondContact O-CD 3.45Å; W305-P308 WeakPolarHBondContact O-CD 3.36Å; P308-Q312 PolarHBondContact O-NE2 3.24Å; P308-Q312 VanDerWaalsContact O-NE2 3.08Å
309	L	93.3	Very high	91.4	Very high	11 Å²	11	55 Å²	55	6%	0.058	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-88	-4.1	179.6	-55.5	-176.3	0	0	0	112.7	V287 F306 S307 G311 Q312 F314 V320 H321 F322	V287-L309 HydrophobicContact CB-CB 4.25Å; V287-L309 WeakPolarHBondContact CB-O 3.28Å; V287-L309 HydrophobicContact CG1-CB 4.18Å; V287-L309 HydrophobicContact CG2-CB 4.06Å; F306-L309 HydrophobicContact CD1-CD1 4.1Å; F306-L309 HydrophobicContact CE1-CD1 4.35Å; F306-L309 WeakPolarHBondContact O-CA 3.37Å; F306-L309 WeakPolarHBondContact O-CB 3.11Å; F306-L309 PolarHBondContact O-N 3.49Å; S307-L309 PolarHBondContact O-N 3.27Å; L309-G311 PolarHBondContact O-N 3.4Å; L309-Q312 WeakPolarHBondContact O-CB 3.1Å; L309-Q312 VanDerWaalsContact O-CG 3.3Å; L309-Q312 WeakPolarHBondContact O-CG 3.35Å; L309-Q312 PolarHBondContact O-N 2.82Å; L309-F314 HydrophobicContact CD1-CZ 4.37Å; L309-F314 HydrophobicContact CD2-CZ 4.44Å; L309-V320 HydrophobicContact CD1-CG1 4.3Å; L309-H321 WeakPolarHBondContact CD1-O 3.17Å; L309-F322 HydrophobicContact CD1-CD1 3.7Å; L309-F322 HydrophobicContact CD1-CE1 3.87Å; L309-F322 HydrophobicContact CG-CD1 4.39Å
310	N	94	Very high	92.3	Very high	65 Å²	65	54.7 Å²	54.7	35%	0.348	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	126.8	-176.4	-169.6	32.3	0	0	0	112	R288 L289 S293 F306 S307 Q312	R288-N310 WeakPolarHBondContact CA-OD1 3.38Å; L289-N310 PolarHBondContact N-OD1 3.39Å; S293-N310 PolarHBondContact OG-ND2 3.23Å; F306-N310 PolarHBondContact O-N 2.9Å; S307-N310 WeakPolarHBondContact O-CB 3.45Å; S307-N310 PolarHBondContact O-N 3.04Å; S307-N310 VanDerWaalsContact O-N 3.16Å; N310-Q312 VanDerWaalsContact C-N 3.3Å
311	G	92.7	Very high	93	Very high	54 Å²	54	51.1 Å²	51.1	56%	0.557	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.1	-10.7	-175	0	0	0	0	0	115	V287 L309	V287-G311 WeakPolarHBondContact O-CA 3.38Å; V287-G311 PolarHBondContact O-N 3.02Å; L309-G311 PolarHBondContact O-N 3.4Å
312	Q	95.6	Very high	93	Very high	86 Å²	86	53.1 Å²	53.1	40%	0.402	27%	0.273	S	S	.	.			trans	-72.5	142.4	179	-60.8	-171.1	26	0	0	111.6	V286 V287 P308 L309 N310 F314	V286-Q312 WeakPolarHBondContact CA-O 3.21Å; V286-Q312 WeakPolarHBondContact CG2-O 3.47Å; V287-Q312 PolarHBondContact N-O 3.41Å; P308-Q312 PolarHBondContact O-NE2 3.24Å; P308-Q312 VanDerWaalsContact O-NE2 3.08Å; L309-Q312 WeakPolarHBondContact O-CB 3.1Å; L309-Q312 VanDerWaalsContact O-CG 3.3Å; L309-Q312 WeakPolarHBondContact O-CG 3.35Å; L309-Q312 PolarHBondContact O-N 2.82Å; N310-Q312 VanDerWaalsContact C-N 3.3Å; Q312-F314 HydrophobicContact CB-CE2 3.86Å; Q312-F314 HydrophobicContact CB-CZ 4.16Å
313	R	96.4	Very high	93.2	Very high	151 Å²	151	55.3 Å²	55.3	57%	0.57	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.1	141.6	176.4	-63.6	-178.3	71.3	93.3	-0.9	109.7	A285 V286	A285-R313 CarbonylContact O-C 3.59Å; A285-R313 WeakPolarHBondContact O-CA 3.29Å; V286-R313 HydrophobicContact CB-CG 4.2Å; V286-R313 HydrophobicContact CG2-CG 3.83Å
314	F	97.1	Very high	93.4	Very high	26 Å²	26	57.7 Å²	57.7	11%	0.114	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	141.2	-179	-61	-94.6	0	0	0	109.2	P284 A285 V287 L309 Q312 R316 D319 V320	P284-F314 WeakPolarHBondContact CA-O 3.31Å; A285-F314 PolarHBondContact N-O 3.34Å; A285-F314 PolarHBondContact O-N 2.94Å; V287-F314 HydrophobicContact CG2-CE2 4.02Å; L309-F314 HydrophobicContact CD1-CZ 4.37Å; L309-F314 HydrophobicContact CD2-CZ 4.44Å; Q312-F314 HydrophobicContact CB-CE2 3.86Å; Q312-F314 HydrophobicContact CB-CZ 4.16Å; F314-R316 VanDerWaalsContact C-N 3.25Å; F314-R316 PolarHBondContact O-N 2.76Å; F314-D319 HydrophobicContact CD1-CB 4.39Å; F314-D319 WeakPolarHBondContact CD1-O 3.15Å; F314-V320 HydrophobicContact CB-CG2 4.18Å; F314-V320 HydrophobicContact CD1-CG2 4.15Å; F314-V320 HydrophobicContact CD2-CG2 3.72Å; F314-V320 HydrophobicContact CE2-CG2 4.12Å; F314-V320 HydrophobicContact CG-CG2 3.74Å; F314-V320 HydrophobicContact CZ-CG1 4.49Å
315	S	96.3	Very high	93.7	Very high	90 Å²	90	59.6 Å²	59.6	63%	0.629	30%	0.304	S	S	*	.	S	Bend	trans	-61.5	-35.7	176.2	36.4	0	0	0	0	112.4	P284 D319	P284-S315 VanDerWaalsContact CA-O 3.28Å; P284-S315 WeakPolarHBondContact CA-O 3.49Å; S315-D319 PolarHBondContact OG-OD2 3.36Å
316	R	96.4	Very high	93.8	Very high	85 Å²	85	56.9 Å²	56.9	32%	0.321	30%	0.298	S	S	.	.	S	Bend	trans	-139	150.3	178	-52.6	173.4	-67	-170.2	-2.2	109.7	E277 R283 F314 Q318 D319	E277-R316 IonicContact OE1-CZ 2.95Å; E277-R316 IonicContact OE1-NH1 2.85Å; E277-R316 PolarHBondContact OE1-NH1 3.06Å; R283-R316 CarbonylContact O-C 3.45Å; R283-R316 VanDerWaalsContact O-CA 3.28Å; R283-R316 WeakPolarHBondContact O-CA 3.46Å; F314-R316 VanDerWaalsContact C-N 3.25Å; F314-R316 PolarHBondContact O-N 2.76Å; R316-Q318 HydrophobicContact CB-CG 3.94Å; R316-Q318 VanDerWaalsContact NH1-NE2 3.18Å; R316-Q318 PolarHBondContact O-N 3.33Å; R316-D319 VanDerWaalsContact CB-OD2 3.26Å; R316-D319 WeakPolarHBondContact CB-OD2 3.35Å; R316-D319 WeakPolarHBondContact CG-OD2 3.5Å; R316-D319 IonicContact CZ-OD1 2.99Å; R316-D319 VanDerWaalsContact CZ-OD1 3.3Å; R316-D319 IonicContact CZ-OD2 2.96Å; R316-D319 PolarHBondContact N-OD2 3.15Å; R316-D319 VanDerWaalsContact N-OD2 3.17Å; R316-D319 IonicContact NE-OD1 3.44Å; R316-D319 PolarHBondContact NE-OD1 2.7Å; R316-D319 VanDerWaalsContact NE-OD1 3.1Å; R316-D319 IonicContact NE-OD2 3.77Å; R316-D319 PolarHBondContact NE-OD2 3.06Å; R316-D319 IonicContact NH2-OD1 2.83Å; R316-D319 PolarHBondContact NH2-OD1 2.92Å; R316-D319 IonicContact NH2-OD2 3.97Å; R316-D319 WeakPolarHBondContact O-CB 3.23Å; R316-D319 PolarHBondContact O-N 3.4Å
317	L	97.1	Very high	93.9	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.01	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-58.5	-38.8	176.6	178.8	67.3	0	0	0	111.8	L169 L179 I181 L208 L280 G281 R283 A285 D319 V320	L169-L317 HydrophobicContact CD1-CD1 3.74Å; L169-L317 HydrophobicContact CD2-CD1 4.39Å; L169-L317 HydrophobicContact CD2-CD2 3.77Å; L179-L317 HydrophobicContact CD1-CB 4.28Å; L179-L317 HydrophobicContact CD1-CD1 4.49Å; L179-L317 HydrophobicContact CD1-CD2 3.87Å; L179-L317 HydrophobicContact CD1-CG 4.43Å; I181-L317 HydrophobicContact CD1-CD1 4.04Å; I181-L317 HydrophobicContact CG1-CD1 4.41Å; L208-L317 HydrophobicContact CD2-CD1 4.25Å; L208-L317 HydrophobicContact CD2-CD2 3.75Å; L208-L317 HydrophobicContact CD2-CG 3.59Å; L280-L317 HydrophobicContact CD2-CD2 4.41Å; L280-L317 HydrophobicContact CG-CD2 4.1Å; G281-L317 PolarHBondContact O-N 3.01Å; R283-L317 PolarHBondContact O-N 3.31Å; A285-L317 HydrophobicContact CB-CB 4.32Å; A285-L317 HydrophobicContact CB-CD1 3.89Å; L317-D319 PolarHBondContact O-N 3.31Å; L317-V320 WeakPolarHBondContact O-CB 3.45Å; L317-V320 VanDerWaalsContact O-CG2 3.26Å; L317-V320 WeakPolarHBondContact O-CG2 3.49Å; L317-V320 PolarHBondContact O-N 2.87Å
318	Q	95.3	Very high	94.1	Very high	53 Å²	53	63.6 Å²	63.6	25%	0.248	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-66.7	-14.8	176.9	69.4	-173.5	16	0	0	113.9	E277 G281 R316 V320	E277-Q318 PolarHBondContact OE1-NE2 3.21Å; G281-Q318 PolarHBondContact O-N 2.93Å; R316-Q318 HydrophobicContact CB-CG 3.94Å; R316-Q318 VanDerWaalsContact NH1-NE2 3.18Å; R316-Q318 PolarHBondContact O-N 3.33Å; Q318-V320 VanDerWaalsContact C-N 3.26Å
319	D	96.1	Very high	94.3	Very high	34 Å²	34	61.3 Å²	61.3	18%	0.182	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-82.8	-5	177.8	-57.9	-31.1	0	0	0	112.1	F314 S315 R316 L317 H321	F314-D319 HydrophobicContact CD1-CB 4.39Å; F314-D319 WeakPolarHBondContact CD1-O 3.15Å; S315-D319 PolarHBondContact OG-OD2 3.36Å; R316-D319 VanDerWaalsContact CB-OD2 3.26Å; R316-D319 WeakPolarHBondContact CB-OD2 3.35Å; R316-D319 WeakPolarHBondContact CG-OD2 3.5Å; R316-D319 IonicContact CZ-OD1 2.99Å; R316-D319 VanDerWaalsContact CZ-OD1 3.3Å; R316-D319 IonicContact CZ-OD2 2.96Å; R316-D319 PolarHBondContact N-OD2 3.15Å; R316-D319 VanDerWaalsContact N-OD2 3.17Å; R316-D319 IonicContact NE-OD1 3.44Å; R316-D319 PolarHBondContact NE-OD1 2.7Å; R316-D319 VanDerWaalsContact NE-OD1 3.1Å; R316-D319 IonicContact NE-OD2 3.77Å; R316-D319 PolarHBondContact NE-OD2 3.06Å; R316-D319 IonicContact NH2-OD1 2.83Å; R316-D319 PolarHBondContact NH2-OD1 2.92Å; R316-D319 IonicContact NH2-OD2 3.97Å; R316-D319 WeakPolarHBondContact O-CB 3.23Å; R316-D319 PolarHBondContact O-N 3.4Å; L317-D319 PolarHBondContact O-N 3.31Å; D319-H321 PolarHBondContact O-CD2 2.92Å; D319-H321 PolarHBondContact O-N 3.38Å
320	V	95.1	Very high	94.3	Very high	4 Å²	4	65.2 Å²	65.2	2%	0.024	33%	0.331	C	S	.	.			trans	-71.3	117	177.6	-179.3	0	0	0	0	109.7	I181 I215 A285 F306 L309 F314 L317 Q318	I181-V320 HydrophobicContact CD1-CG1 4.13Å; I181-V320 HydrophobicContact CD1-CG2 4.17Å; I215-V320 HydrophobicContact CD1-CB 4.45Å; I215-V320 HydrophobicContact CD1-CG1 3.99Å; I215-V320 WeakPolarHBondContact CD1-O 3.33Å; A285-V320 HydrophobicContact CB-CG2 4.33Å; F306-V320 HydrophobicContact CE1-CG1 3.7Å; F306-V320 HydrophobicContact CZ-CG1 4.16Å; L309-V320 HydrophobicContact CD1-CG1 4.3Å; F314-V320 HydrophobicContact CB-CG2 4.18Å; F314-V320 HydrophobicContact CD1-CG2 4.15Å; F314-V320 HydrophobicContact CD2-CG2 3.72Å; F314-V320 HydrophobicContact CE2-CG2 4.12Å; F314-V320 HydrophobicContact CG-CG2 3.74Å; F314-V320 HydrophobicContact CZ-CG1 4.49Å; L317-V320 WeakPolarHBondContact O-CB 3.45Å; L317-V320 VanDerWaalsContact O-CG2 3.26Å; L317-V320 WeakPolarHBondContact O-CG2 3.49Å; L317-V320 PolarHBondContact O-N 2.87Å; Q318-V320 VanDerWaalsContact C-N 3.26Å
321	H	88.9	Confident	94.4	Very high	119 Å²	119	65.2 Å²	65.2	55%	0.551	33%	0.329	S	S	*	.			trans	-145.8	164.8	177.4	63.7	68.5	0	0	0	110.7	L309 D319	L309-H321 WeakPolarHBondContact CD1-O 3.17Å; D319-H321 PolarHBondContact O-CD2 2.92Å; D319-H321 PolarHBondContact O-N 3.38Å
322	F	85.4	Confident	94.5	Very high	78 Å²	78	66.2 Å²	66.2	34%	0.342	31%	0.308	S	S	.	.			trans	-101.1	0	179.6	-49.8	-67.8	0	0	0	112.3	Q213 I215 W305 F306 L309	Q213-F322 HydrophobicContact CB-CD2 4.09Å; Q213-F322 HydrophobicContact CG-CD2 4.43Å; Q213-F322 PolarHBondContact NE2-O 3.28Å; Q213-F322 PolarHBondContact OE1-O 2.91Å; I215-F322 HydrophobicContact CD1-CE2 3.88Å; I215-F322 HydrophobicContact CD1-CZ 4Å; I215-F322 HydrophobicContact CG1-CE2 3.5Å; I215-F322 HydrophobicContact CG1-CZ 3.76Å; W305-F322 HydrophobicContact CB-CD1 3.71Å; W305-F322 HydrophobicContact CB-CD2 4.27Å; W305-F322 HydrophobicContact CB-CE1 3.49Å; W305-F322 VanDerWaalsContact CB-CE1 3.49Å; W305-F322 HydrophobicContact CB-CE2 4.11Å; W305-F322 HydrophobicContact CB-CG 4.09Å; W305-F322 HydrophobicContact CB-CZ 3.7Å; W305-F322 HydrophobicContact CD2-CD2 4.37Å; W305-F322 HydrophobicContact CD2-CE2 4.34Å; W305-F322 AromaticContact CE3-CD2 3.62Å; W305-F322 HydrophobicContact CE3-CD2 3.62Å; W305-F322 AromaticContact CE3-CE2 3.43Å; W305-F322 HydrophobicContact CE3-CE2 3.43Å; W305-F322 VanDerWaalsContact CE3-CE2 3.43Å; W305-F322 HydrophobicContact CE3-CG 4.42Å; W305-F322 HydrophobicContact CE3-CZ 4.09Å; W305-F322 HydrophobicContact CZ3-CD2 4.29Å; W305-F322 HydrophobicContact CZ3-CE2 4.19Å; W305-F322 WeakPolarHBondContact O-CD1 3.45Å; W305-F322 VanDerWaalsContact O-CE1 3.28Å; W305-F322 WeakPolarHBondContact O-CE1 3.46Å; F306-F322 HydrophobicContact CD1-CE1 4.16Å; F306-F322 AromaticContact CD2-CE1 3.78Å; F306-F322 HydrophobicContact CD2-CE1 3.78Å; F306-F322 AromaticContact CD2-CZ 3.76Å; F306-F322 HydrophobicContact CD2-CZ 3.76Å; F306-F322 HydrophobicContact CE1-CE1 4.27Å; F306-F322 HydrophobicContact CE1-CZ 4.5Å; F306-F322 AromaticContact CE2-CE1 3.89Å; F306-F322 HydrophobicContact CE2-CE1 3.89Å; F306-F322 AromaticContact CE2-CZ 3.5Å; F306-F322 HydrophobicContact CE2-CZ 3.5Å; F306-F322 AromaticContact CG-CE1 3.91Å; F306-F322 HydrophobicContact CG-CE1 3.91Å; F306-F322 HydrophobicContact CG-CZ 4.35Å; F306-F322 HydrophobicContact CZ-CE1 4.14Å; F306-F322 AromaticContact CZ-CZ 3.91Å; F306-F322 HydrophobicContact CZ-CZ 3.91Å; L309-F322 HydrophobicContact CD1-CD1 3.7Å; L309-F322 HydrophobicContact CD1-CE1 3.87Å; L309-F322 HydrophobicContact CG-CD1 4.39Å

Retrieved 322 of 322 residues in 155.6 ms (Link to these results)

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