A0A5K4F518_SCHMA Loading...

F-box domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F518, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 854 aa.

						>A0A5K4F518_SCHMA|A0A5K4F518
MLPENPRKWIAEKLQLLYDIGFMSLNWDTFIDSDMKPSHPYVDHELMHSLFGTSKLEFLLPEELQYQPTPEMLAKAYAAHKQSILKKCLSAWKLHFIIKRARANYTYKINVIAKISMKFRLQKNILREWQVYTQFVKSKQRMGQSLITQIKDFTVTTLYFKAWRRNVAEARKTRDYFSKMQERSDGEKSDDSESESQLLTLGGKISETENYRDRLSELPDTIQYKIFGYLTPIDLARAACISHYWRSIVNEMDKKNTLDLSCFGKRLTDELLLKLTKRRRVYLRHINLRNSSLCTLNSIRCVTSCANLQDINLSKCTGITDDAVRLITVECSLLLYLNLSYTQITDDSVRHLVINTKMLQYLSLAYCTRLTQLCSTYFNQLESFKSLIYLDLSGCIYIESAGLQLIIKSVTQVEHWILNDIPWISDTDLNVLGSNCSIIRTLEMVNNQNVFTSGLHYLSKTCLFHEKSTPVDGDIQIKDKQNRPITCIGLIHKYADSALNNSNSNVGHLITDRGLQSVCGKNLNRLLVSNMSSIDGSGLNNIVPNDNVSRRHSKSKAHRLSKLNSGLLVNGSLNLLEISFLDCPKMNDILLQHLIPLPHLTVVKLSGCESLTDQGIKLLTDGAYAENLKELYLARCDKLTDKAIHIMSVRLLNLAYLSLASCPLISDGAFELLGQLQKLWQINLNSTKLGDRGLSALGSLPKLRELKVSRCTAITDLGLQKFAHLGINLEYIDLSFCHNLTNNGIKTLAFCCRFLTSINLAGCKLLTDMAVQYISGVCHYLKFLDLSGCELITETSLGFLRKGCKKLEHLRLLYCKSIKKRKLIRSTIGKIERIEHSTDEPPPESIGYLIKENA
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	63.9	Low	80.9	Confident	103 Å²	103	114.6 Å²	114.6	51%	0.507	57%	0.567	S	S	.	*				0	123.5	0	-77.5	162.3	-176.5	0	0	108.9	I31 D32 M35	M1-I31 HydrophobicContact CE-CB 4.49Å; M1-I31 HydrophobicContact CE-CG2 3.89Å; M1-D32 HydrophobicContact CE-CB 3.48Å; M1-D32 VanDerWaalsContact CE-CB 3.48Å; M1-D32 WeakPolarHBondContact CE-OD2 3.38Å; M1-M35 HydrophobicContact CE-CB 3.67Å; M1-M35 HydrophobicContact CE-CG 3.84Å
2	L	72.5	Confident	81.4	Confident	176 Å²	176	113.3 Å²	113.3	92%	0.921	56%	0.559	S	S	*	*			trans	-127.9	88.4	-177.2	-132.5	152.6	0	0	0	107.7
3	P	72	Confident	81.7	Confident	40 Å²	40	107.8 Å²	107.8	26%	0.26	53%	0.529	S	S	.	.			trans	-72.7	135.5	-171.9	25.9	-32.1	0	0	0	111.8	N5 P6 W9	P3-N5 PolarHBondContact O-N 3.03Å; P3-P6 WeakPolarHBondContact O-CD 3.45Å; P3-W9 HydrophobicContact CB-CB 3.65Å; P3-W9 HydrophobicContact CB-CD2 4.38Å; P3-W9 HydrophobicContact CB-CG 3.63Å; P3-W9 HydrophobicContact CG-CB 3.84Å; P3-W9 HydrophobicContact CG-CD2 3.98Å; P3-W9 HydrophobicContact CG-CE3 4.45Å; P3-W9 HydrophobicContact CG-CG 3.71Å
4	E	80.3	Confident	81.9	Confident	207 Å²	207	107.5 Å²	107.5	97%	0.967	53%	0.53	S	S	*	.	S	Bend	trans	-58.2	-30.5	179.5	-68.8	-172.9	156	0	0	113.1
5	N	86.1	Confident	82.2	Confident	94 Å²	94	107.2 Å²	107.2	50%	0.503	53%	0.527	S	S	.	.	S	Bend	trans	-128.7	91.1	172.3	-168.1	-25.5	0	0	0	110.5	P3 R7 K8 W9	P3-N5 PolarHBondContact O-N 3.03Å; N5-R7 PolarHBondContact O-N 3.5Å; N5-R7 PolarHBondContact OD1-N 3.23Å; N5-K8 HydrophobicContact CB-CB 4.16Å; N5-K8 PolarHBondContact O-N 2.99Å; N5-K8 PolarHBondContact OD1-N 3.41Å; N5-W9 PolarHBondContact O-N 3.35Å
6	P	84.3	Confident	82.3	Confident	73 Å²	73	104.6 Å²	104.6	47%	0.474	52%	0.516	S	S	.	.	H	α-helix	trans	-58.8	-33.6	-174.7	-25.7	33.7	0	0	0	113.7	P3 I10	P3-P6 WeakPolarHBondContact O-CD 3.45Å; P6-I10 WeakPolarHBondContact O-CB 3.36Å; P6-I10 WeakPolarHBondContact O-CD1 3.48Å; P6-I10 WeakPolarHBondContact O-CG1 3.38Å; P6-I10 PolarHBondContact O-N 3.3Å
7	R	83.1	Confident	82.3	Confident	218 Å²	218	100.2 Å²	100.2	82%	0.823	50%	0.495	S	S	*	.	H	α-helix	trans	-69.1	-42.5	-179.7	-71.1	-175.1	-178.9	175.5	1.1	111.8	N5 A11	N5-R7 PolarHBondContact O-N 3.5Å; N5-R7 PolarHBondContact OD1-N 3.23Å; R7-A11 PolarHBondContact O-N 3.17Å; R7-A11 VanDerWaalsContact O-N 3.12Å
8	K	87.3	Confident	82.3	Confident	127 Å²	127	105.1 Å²	105.1	55%	0.552	51%	0.508	S	S	*	.	H	α-helix	trans	-65.6	-45.1	176.2	-167.3	-174.5	-179.2	-159	0	110.7	N5 I10 A11 E12	N5-K8 HydrophobicContact CB-CB 4.16Å; N5-K8 PolarHBondContact O-N 2.99Å; N5-K8 PolarHBondContact OD1-N 3.41Å; K8-I10 PolarHBondContact O-N 2.73Å; K8-A11 PolarHBondContact O-N 3.36Å; K8-E12 WeakPolarHBondContact CE-OE1 3.42Å; K8-E12 IonicContact NZ-OE1 2.71Å; K8-E12 WeakPolarHBondContact O-CG 3.4Å; K8-E12 PolarHBondContact O-N 2.9Å
9	W	88.4	Confident	82.5	Confident	73 Å²	73	105.4 Å²	105.4	28%	0.277	51%	0.512	S	S	.	.	H	α-helix	trans	-59.6	-44.8	177.4	-174.4	91	0	0	0	112.4	P3 N5 A11 E12 K13	P3-W9 HydrophobicContact CB-CB 3.65Å; P3-W9 HydrophobicContact CB-CD2 4.38Å; P3-W9 HydrophobicContact CB-CG 3.63Å; P3-W9 HydrophobicContact CG-CB 3.84Å; P3-W9 HydrophobicContact CG-CD2 3.98Å; P3-W9 HydrophobicContact CG-CE3 4.45Å; P3-W9 HydrophobicContact CG-CG 3.71Å; N5-W9 PolarHBondContact O-N 3.35Å; W9-A11 VanDerWaalsContact C-N 3.34Å; W9-A11 PolarHBondContact O-N 3.04Å; W9-E12 PolarHBondContact O-N 3.47Å; W9-K13 HydrophobicContact CD2-CG 3.85Å; W9-K13 HydrophobicContact CE3-CG 4.02Å; W9-K13 HydrophobicContact CH2-CG 3.89Å; W9-K13 HydrophobicContact CZ2-CD 4.27Å; W9-K13 HydrophobicContact CZ2-CG 3.72Å; W9-K13 HydrophobicContact CZ3-CG 4.04Å; W9-K13 WeakPolarHBondContact O-CG 3.45Å; W9-K13 PolarHBondContact O-N 2.93Å
10	I	84.2	Confident	82.5	Confident	90 Å²	90	103 Å²	103	46%	0.462	50%	0.501	S	S	.	.	H	α-helix	trans	-60.9	-44.3	176	-70.9	166.2	0	0	0	110.8	P6 K8 E12 K13 L14	P6-I10 WeakPolarHBondContact O-CB 3.36Å; P6-I10 WeakPolarHBondContact O-CD1 3.48Å; P6-I10 WeakPolarHBondContact O-CG1 3.38Å; P6-I10 PolarHBondContact O-N 3.3Å; K8-I10 PolarHBondContact O-N 2.73Å; I10-E12 PolarHBondContact O-N 3.46Å; I10-K13 PolarHBondContact O-N 3.41Å; I10-L14 HydrophobicContact CG2-CD1 3.73Å; I10-L14 HydrophobicContact CG2-CG 4.22Å; I10-L14 WeakPolarHBondContact O-CB 3.39Å; I10-L14 VanDerWaalsContact O-CG 3.27Å; I10-L14 WeakPolarHBondContact O-CG 3.31Å; I10-L14 PolarHBondContact O-N 2.96Å
11	A	87.7	Confident	82.3	Confident	60 Å²	60	99.5 Å²	99.5	50%	0.496	49%	0.492	S	S	.	.	H	α-helix	trans	-61.6	-43.3	178.2	0	0	0	0	0	111.9	R7 K8 W9 L14 Q15	R7-A11 PolarHBondContact O-N 3.17Å; R7-A11 VanDerWaalsContact O-N 3.12Å; K8-A11 PolarHBondContact O-N 3.36Å; W9-A11 VanDerWaalsContact C-N 3.34Å; W9-A11 PolarHBondContact O-N 3.04Å; A11-L14 PolarHBondContact O-N 3.08Å; A11-Q15 PolarHBondContact O-N 2.9Å
12	E	87.4	Confident	82.7	Confident	99 Å²	99	102.1 Å²	102.1	46%	0.463	50%	0.501	S	S	.	.	H	α-helix	trans	-63.9	-44.4	176.5	-71.5	168.4	177.8	0	0	112.1	K8 W9 I10 Q15 L16	K8-E12 WeakPolarHBondContact CE-OE1 3.42Å; K8-E12 IonicContact NZ-OE1 2.71Å; K8-E12 WeakPolarHBondContact O-CG 3.4Å; K8-E12 PolarHBondContact O-N 2.9Å; W9-E12 PolarHBondContact O-N 3.47Å; I10-E12 PolarHBondContact O-N 3.46Å; E12-Q15 PolarHBondContact O-N 3.43Å; E12-L16 PolarHBondContact O-N 3.33Å
13	K	85.3	Confident	82.9	Confident	41 Å²	41	103 Å²	103	18%	0.178	50%	0.503	C	S	.	.	H	α-helix	trans	-71.5	-30.5	178.7	-62.5	-51	-172.7	176.8	0	112.9	W9 I10 L16 L17 F30 D32	W9-K13 HydrophobicContact CD2-CG 3.85Å; W9-K13 HydrophobicContact CE3-CG 4.02Å; W9-K13 HydrophobicContact CH2-CG 3.89Å; W9-K13 HydrophobicContact CZ2-CD 4.27Å; W9-K13 HydrophobicContact CZ2-CG 3.72Å; W9-K13 HydrophobicContact CZ3-CG 4.04Å; W9-K13 WeakPolarHBondContact O-CG 3.45Å; W9-K13 PolarHBondContact O-N 2.93Å; I10-K13 PolarHBondContact O-N 3.41Å; K13-L16 HydrophobicContact CD-CD2 4.46Å; K13-L16 PolarHBondContact O-N 2.88Å; K13-L17 WeakPolarHBondContact O-CB 3.5Å; K13-L17 PolarHBondContact O-N 3.34Å; K13-F30 HydrophobicContact CB-CD1 4.12Å; K13-F30 HydrophobicContact CB-CE1 4.15Å; K13-F30 HydrophobicContact CD-CD1 4Å; K13-F30 HydrophobicContact CG-CD1 4.26Å; K13-D32 IonicContact NZ-OD1 3.38Å
14	L	83.8	Confident	83	Confident	104 Å²	104	104.6 Å²	104.6	55%	0.545	52%	0.515	S	S	.	.	H	α-helix	trans	-68.9	-37.8	171.3	-75.9	172.4	0	0	0	111.8	I10 A11 L17 Y18	I10-L14 HydrophobicContact CG2-CD1 3.73Å; I10-L14 HydrophobicContact CG2-CG 4.22Å; I10-L14 WeakPolarHBondContact O-CB 3.39Å; I10-L14 VanDerWaalsContact O-CG 3.27Å; I10-L14 WeakPolarHBondContact O-CG 3.31Å; I10-L14 PolarHBondContact O-N 2.96Å; A11-L14 PolarHBondContact O-N 3.08Å; L14-L17 WeakPolarHBondContact O-CB 3.45Å; L14-L17 PolarHBondContact O-N 3.44Å; L14-Y18 PolarHBondContact O-N 2.97Å
15	Q	86.9	Confident	82.6	Confident	103 Å²	103	98.1 Å²	98.1	48%	0.481	49%	0.487	S	S	.	.	H	α-helix	trans	-63.9	-45.2	172.7	-170.1	61.8	45.9	0	0	110.7	A11 E12 L17 Y18 D19	A11-Q15 PolarHBondContact O-N 2.9Å; E12-Q15 PolarHBondContact O-N 3.43Å; Q15-L17 VanDerWaalsContact C-N 3.31Å; Q15-L17 PolarHBondContact O-N 3Å; Q15-Y18 WeakPolarHBondContact O-CB 3.12Å; Q15-Y18 PolarHBondContact O-N 3.46Å; Q15-Y18 VanDerWaalsContact O-N 3.07Å; Q15-D19 PolarHBondContact NE2-OD1 3.27Å; Q15-D19 PolarHBondContact O-N 2.92Å
16	L	84.5	Confident	81.9	Confident	65 Å²	65	98 Å²	98	34%	0.34	49%	0.486	S	S	.	.	H	α-helix	trans	-56.4	-44.6	174.4	-174.5	74.2	0	0	0	111.9	E12 K13 Y18 D19 I20 F30	E12-L16 PolarHBondContact O-N 3.33Å; K13-L16 HydrophobicContact CD-CD2 4.46Å; K13-L16 PolarHBondContact O-N 2.88Å; L16-Y18 VanDerWaalsContact C-N 3.31Å; L16-Y18 PolarHBondContact O-N 3.4Å; L16-D19 PolarHBondContact O-N 3.47Å; L16-I20 HydrophobicContact CD1-CG2 4.47Å; L16-I20 VanDerWaalsContact O-CG1 3.28Å; L16-I20 WeakPolarHBondContact O-CG1 3.39Å; L16-I20 PolarHBondContact O-N 2.98Å; L16-F30 HydrophobicContact CD2-CD1 4.24Å; L16-F30 HydrophobicContact CD2-CE1 4.14Å
17	L	82.4	Confident	81.5	Confident	31 Å²	31	100.9 Å²	100.9	16%	0.162	49%	0.488	C	S	.	.	H	α-helix	trans	-59.9	-41.5	176	-172.9	91.1	0	0	0	111.9	K13 L14 Q15 D19 G21 F22 L25 F30	K13-L17 WeakPolarHBondContact O-CB 3.5Å; K13-L17 PolarHBondContact O-N 3.34Å; L14-L17 WeakPolarHBondContact O-CB 3.45Å; L14-L17 PolarHBondContact O-N 3.44Å; Q15-L17 VanDerWaalsContact C-N 3.31Å; Q15-L17 PolarHBondContact O-N 3Å; L17-D19 VanDerWaalsContact C-N 3.35Å; L17-G21 PolarHBondContact O-N 3.43Å; L17-F22 HydrophobicContact CD2-CE1 4.5Å; L17-F22 HydrophobicContact CD2-CE2 3.88Å; L17-F22 HydrophobicContact CD2-CZ 3.81Å; L17-L25 HydrophobicContact CD1-CD1 3.15Å; L17-F30 HydrophobicContact CB-CZ 4.35Å; L17-F30 HydrophobicContact CD1-CE2 4.38Å; L17-F30 HydrophobicContact CD1-CZ 3.71Å
18	Y	82.1	Confident	81.1	Confident	188 Å²	188	91.9 Å²	91.9	74%	0.737	46%	0.456	S	S	*	.	H	α-helix	trans	-65.7	-39.7	178	-168.9	-92.3	0	0	0	111.4	L14 Q15 L16	L14-Y18 PolarHBondContact O-N 2.97Å; Q15-Y18 WeakPolarHBondContact O-CB 3.12Å; Q15-Y18 PolarHBondContact O-N 3.46Å; Q15-Y18 VanDerWaalsContact O-N 3.07Å; L16-Y18 VanDerWaalsContact C-N 3.31Å; L16-Y18 PolarHBondContact O-N 3.4Å
19	D	85.1	Confident	80.7	Confident	110 Å²	110	87.4 Å²	87.4	59%	0.588	44%	0.439	S	S	*	.	H	α-helix	trans	-73.7	-39.8	-177.4	-61.6	-19.5	0	0	0	112.6	Q15 L16 L17	Q15-D19 PolarHBondContact NE2-OD1 3.27Å; Q15-D19 PolarHBondContact O-N 2.92Å; L16-D19 PolarHBondContact O-N 3.47Å; L17-D19 VanDerWaalsContact C-N 3.35Å
20	I	83.6	Confident	80.3	Confident	57 Å²	57	87 Å²	87	29%	0.292	44%	0.439	S	S	.	.	H	α-helix	trans	-82.6	-24.4	179.6	68.3	-171.3	0	0	0	113.1	L16 S24 L25 T29	L16-I20 HydrophobicContact CD1-CG2 4.47Å; L16-I20 VanDerWaalsContact O-CG1 3.28Å; L16-I20 WeakPolarHBondContact O-CG1 3.39Å; L16-I20 PolarHBondContact O-N 2.98Å; I20-S24 WeakPolarHBondContact O-CB 3.37Å; I20-S24 PolarHBondContact O-OG 3.12Å; I20-L25 HydrophobicContact CD1-CD1 4.47Å; I20-T29 HydrophobicContact CD1-CG2 3.65Å
21	G	76.8	Confident	80	Confident	30 Å²	30	85.1 Å²	85.1	31%	0.309	43%	0.43	S	S	.	.			trans	74.6	150	-174.1	0	0	0	0	0	113.9	L17 M23 S24	L17-G21 PolarHBondContact O-N 3.43Å; G21-M23 PolarHBondContact O-N 3.29Å; G21-M23 VanDerWaalsContact O-N 3.14Å; G21-S24 PolarHBondContact O-N 2.8Å; G21-S24 VanDerWaalsContact O-N 3.12Å
22	F	72.8	Confident	79.4	Confident	159 Å²	159	85.6 Å²	85.6	70%	0.697	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-58.6	-28.9	-174.4	-95.4	-85.9	0	0	0	114.8	L17 S24 L25	L17-F22 HydrophobicContact CD2-CE1 4.5Å; L17-F22 HydrophobicContact CD2-CE2 3.88Å; L17-F22 HydrophobicContact CD2-CZ 3.81Å; F22-S24 PolarHBondContact O-N 3.03Å; F22-L25 WeakPolarHBondContact O-CB 3.36Å
23	M	76	Confident	78.8	Confident	194 Å²	194	86 Å²	86	96%	0.956	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-73.4	-17.3	-177.8	-63	-60	-178	0	0	113	G21	G21-M23 PolarHBondContact O-N 3.29Å; G21-M23 VanDerWaalsContact O-N 3.14Å
24	S	74.6	Confident	78.4	Confident	74 Å²	74	90.5 Å²	90.5	52%	0.517	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-94.2	5.9	-177.1	-39.6	0	0	0	0	112.8	I20 G21 F22 N26	I20-S24 WeakPolarHBondContact O-CB 3.37Å; I20-S24 PolarHBondContact O-OG 3.12Å; G21-S24 PolarHBondContact O-N 2.8Å; G21-S24 VanDerWaalsContact O-N 3.12Å; F22-S24 PolarHBondContact O-N 3.03Å; S24-N26 PolarHBondContact O-N 3.12Å
25	L	72.2	Confident	78	Confident	71 Å²	71	91.1 Å²	91.1	37%	0.372	47%	0.465	S	S	.	.			trans	-82.1	111.1	-169.5	-154.6	106.4	0	0	0	111.6	L17 I20 F22 F30	L17-L25 HydrophobicContact CD1-CD1 3.15Å; I20-L25 HydrophobicContact CD1-CD1 4.47Å; F22-L25 WeakPolarHBondContact O-CB 3.36Å; L25-F30 HydrophobicContact CD1-CE2 4.16Å; L25-F30 HydrophobicContact CD1-CZ 4.06Å
26	N	72	Confident	77.3	Confident	90 Å²	90	90.2 Å²	90.2	48%	0.481	46%	0.46	S	S	.	.			trans	-90.5	158.4	165.7	-84.3	-28.4	0	0	0	111.8	S24 D28 T29	S24-N26 PolarHBondContact O-N 3.12Å; N26-D28 WeakPolarHBondContact CB-OD1 3.44Å; N26-D28 PolarHBondContact O-N 2.78Å; N26-D28 VanDerWaalsContact O-N 3.12Å; N26-T29 WeakPolarHBondContact CA-OG1 3.43Å; N26-T29 PolarHBondContact N-OG1 3.14Å; N26-T29 WeakPolarHBondContact O-CB 3.47Å; N26-T29 PolarHBondContact O-N 3.2Å; N26-T29 VanDerWaalsContact O-N 3.09Å; N26-T29 PolarHBondContact O-OG1 2.88Å
27	W	74.4	Confident	76.3	Confident	135 Å²	135	90.2 Å²	90.2	51%	0.511	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-25.3	-178.1	67.7	-92	0	0	0	113.3	I31 P37 P40 H44	W27-I31 HydrophobicContact CE3-CD1 4.36Å; W27-I31 HydrophobicContact CZ3-CD1 3.96Å; W27-P37 HydrophobicContact CH2-CG 3.88Å; W27-P37 HydrophobicContact CZ3-CG 4.44Å; W27-P40 HydrophobicContact CZ2-CB 4.45Å; W27-H44 AromaticContact CD1-CE1 3.83Å; W27-H44 AromaticContact CD1-NE2 3.47Å; W27-H44 AromaticContact NE1-NE2 3.63Å
28	D	75	Confident	75.5	Confident	28 Å²	28	94 Å²	94	15%	0.15	49%	0.493	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	8.7	-178.2	69.9	-18.5	0	0	0	113.3	N26 F30 I31 K36	N26-D28 WeakPolarHBondContact CB-OD1 3.44Å; N26-D28 PolarHBondContact O-N 2.78Å; N26-D28 VanDerWaalsContact O-N 3.12Å; D28-F30 PolarHBondContact O-N 2.98Å; D28-F30 VanDerWaalsContact O-N 3.15Å; D28-I31 HydrophobicContact CB-CD1 4.25Å; D28-I31 PolarHBondContact O-N 3.44Å; D28-K36 HydrophobicContact CB-CD 4.4Å; D28-K36 HydrophobicContact CB-CG 4.45Å; D28-K36 VanDerWaalsContact O-CE 3.29Å; D28-K36 WeakPolarHBondContact O-CE 3.44Å; D28-K36 IonicContact OD1-NZ 3.56Å; D28-K36 VanDerWaalsContact OD2-CD 3.25Å; D28-K36 WeakPolarHBondContact OD2-CD 3.39Å; D28-K36 WeakPolarHBondContact OD2-CE 3.34Å; D28-K36 IonicContact OD2-NZ 2.73Å; D28-K36 PolarHBondContact OD2-NZ 3.38Å
29	T	80.4	Confident	74.4	Confident	33 Å²	33	91.9 Å²	91.9	20%	0.202	49%	0.489	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-34.6	-174.1	-57.9	0	0	0	0	113.4	I20 N26	I20-T29 HydrophobicContact CD1-CG2 3.65Å; N26-T29 WeakPolarHBondContact CA-OG1 3.43Å; N26-T29 PolarHBondContact N-OG1 3.14Å; N26-T29 WeakPolarHBondContact O-CB 3.47Å; N26-T29 PolarHBondContact O-N 3.2Å; N26-T29 VanDerWaalsContact O-N 3.09Å; N26-T29 PolarHBondContact O-OG1 2.88Å
30	F	80.3	Confident	72.8	Confident	64 Å²	64	90.5 Å²	90.5	28%	0.281	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	6.5	-178.5	-56.5	-55.7	0	0	0	113.8	K13 L16 L17 L25 D28	K13-F30 HydrophobicContact CB-CD1 4.12Å; K13-F30 HydrophobicContact CB-CE1 4.15Å; K13-F30 HydrophobicContact CD-CD1 4Å; K13-F30 HydrophobicContact CG-CD1 4.26Å; L16-F30 HydrophobicContact CD2-CD1 4.24Å; L16-F30 HydrophobicContact CD2-CE1 4.14Å; L17-F30 HydrophobicContact CB-CZ 4.35Å; L17-F30 HydrophobicContact CD1-CE2 4.38Å; L17-F30 HydrophobicContact CD1-CZ 3.71Å; L25-F30 HydrophobicContact CD1-CE2 4.16Å; L25-F30 HydrophobicContact CD1-CZ 4.06Å; D28-F30 PolarHBondContact O-N 2.98Å; D28-F30 VanDerWaalsContact O-N 3.15Å
31	I	77.8	Confident	71.5	Confident	51 Å²	51	98.6 Å²	98.6	26%	0.262	52%	0.515	S	S	.	.	S	Bend	trans	-94.1	113.8	174	-53.6	179.1	0	0	0	106.8	M1 W27 D28 M35 K36	M1-I31 HydrophobicContact CE-CB 4.49Å; M1-I31 HydrophobicContact CE-CG2 3.89Å; W27-I31 HydrophobicContact CE3-CD1 4.36Å; W27-I31 HydrophobicContact CZ3-CD1 3.96Å; D28-I31 HydrophobicContact CB-CD1 4.25Å; D28-I31 PolarHBondContact O-N 3.44Å; I31-M35 HydrophobicContact CG2-CB 3.77Å; I31-K36 HydrophobicContact CB-CG 4.26Å; I31-K36 HydrophobicContact CG2-CG 4.04Å; I31-K36 WeakPolarHBondContact O-CE 3.35Å
32	D	73.3	Confident	70.4	Confident	71 Å²	71	100.7 Å²	100.7	38%	0.38	52%	0.522	S	S	.	.			trans	-47.6	140.5	169.9	-52.8	-33.1	0	0	0	110.7	M1 K13 D34 M35	M1-D32 HydrophobicContact CE-CB 3.48Å; M1-D32 VanDerWaalsContact CE-CB 3.48Å; M1-D32 WeakPolarHBondContact CE-OD2 3.38Å; K13-D32 IonicContact NZ-OD1 3.38Å; D32-D34 WeakPolarHBondContact CB-OD1 3.49Å; D32-D34 PolarHBondContact O-N 3.5Å; D32-D34 VanDerWaalsContact O-N 3.11Å; D32-M35 PolarHBondContact O-N 2.94Å
33	S	74.9	Confident	69.3	Low	108 Å²	108	97.9 Å²	97.9	76%	0.755	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-59	-28.2	-164.6	37.7	0	0	0	0	114.9	M35	S33-M35 VanDerWaalsContact C-N 3.3Å
34	D	78.2	Confident	68.1	Low	134 Å²	134	93 Å²	93	72%	0.717	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-73.5	-19.6	176.6	60.8	-34.1	0	0	0	113.5	D32	D32-D34 WeakPolarHBondContact CB-OD1 3.49Å; D32-D34 PolarHBondContact O-N 3.5Å; D32-D34 VanDerWaalsContact O-N 3.11Å
35	M	75.7	Confident	66.9	Low	118 Å²	118	95.5 Å²	95.5	58%	0.581	49%	0.492	S	S	*	.	G	3₁₀ helix	trans	-103.5	1.2	-178.1	-69.3	-78.4	-76.1	0	0	113.1	M1 I31 D32 S33	M1-M35 HydrophobicContact CE-CB 3.67Å; M1-M35 HydrophobicContact CE-CG 3.84Å; I31-M35 HydrophobicContact CG2-CB 3.77Å; D32-M35 PolarHBondContact O-N 2.94Å; S33-M35 VanDerWaalsContact C-N 3.3Å
36	K	71.9	Confident	65.8	Low	83 Å²	83	96.9 Å²	96.9	36%	0.361	50%	0.499	S	S	.	.	S	Bend	trans	-71.4	126.3	178.7	-70.9	-174.9	171.9	-154.2	0	110.4	D28 I31 S38	D28-K36 HydrophobicContact CB-CD 4.4Å; D28-K36 HydrophobicContact CB-CG 4.45Å; D28-K36 VanDerWaalsContact O-CE 3.29Å; D28-K36 WeakPolarHBondContact O-CE 3.44Å; D28-K36 IonicContact OD1-NZ 3.56Å; D28-K36 VanDerWaalsContact OD2-CD 3.25Å; D28-K36 WeakPolarHBondContact OD2-CD 3.39Å; D28-K36 WeakPolarHBondContact OD2-CE 3.34Å; D28-K36 IonicContact OD2-NZ 2.73Å; D28-K36 PolarHBondContact OD2-NZ 3.38Å; I31-K36 HydrophobicContact CB-CG 4.26Å; I31-K36 HydrophobicContact CG2-CG 4.04Å; I31-K36 WeakPolarHBondContact O-CE 3.35Å; K36-S38 PolarHBondContact O-N 3.48Å
37	P	63	Low	64.7	Low	66 Å²	66	97.3 Å²	97.3	43%	0.429	50%	0.499	S	S	.	.			trans	-56.9	132.9	176.8	-22.9	32.1	0	0	0	111.2	W27 H39	W27-P37 HydrophobicContact CH2-CG 3.88Å; W27-P37 HydrophobicContact CZ3-CG 4.44Å; P37-H39 PolarHBondContact O-N 3.39Å
38	S	65.8	Low	63.4	Low	111 Å²	111	97.5 Å²	97.5	78%	0.776	51%	0.506	S	S	*	.	S	Bend	trans	-65.2	-19.3	178.9	56.9	0	0	0	0	113.5	K36	K36-S38 PolarHBondContact O-N 3.48Å
39	H	58.8	Low	62.1	Low	142 Å²	142	99.1 Å²	99.1	66%	0.657	52%	0.52	S	S	*	.	S	Bend	trans	-131.6	116.4	-179.8	-66.9	63.2	0	0	0	108.9	P37 Y41	P37-H39 PolarHBondContact O-N 3.39Å; H39-Y41 PolarHBondContact O-N 2.97Å
40	P	51.3	Low	60.7	Low	82 Å²	82	103.1 Å²	103.1	53%	0.532	54%	0.539	S	S	.	.			trans	-64.5	120	176.8	23.8	-29.2	0	0	0	109.2	W27 V42	W27-P40 HydrophobicContact CZ2-CB 4.45Å; P40-V42 PolarHBondContact O-N 3.04Å; P40-V42 VanDerWaalsContact O-N 3.07Å
41	Y	55.7	Low	59.4	Low	227 Å²	227	107.5 Å²	107.5	89%	0.89	56%	0.558	S	S	*	*	S	Bend	trans	-66.2	-8.6	-176.2	-106.4	-91.8	0	0	0	114.2	H39	H39-Y41 PolarHBondContact O-N 2.97Å
42	V	54	Low	57.7	Low	74 Å²	74	106.9 Å²	106.9	45%	0.448	56%	0.564	S	S	.	*	S	Bend	trans	-144.2	116.8	-173.8	-170	0	0	0	0	106.6	P40 H44 M47	P40-V42 PolarHBondContact O-N 3.04Å; P40-V42 VanDerWaalsContact O-N 3.07Å; V42-H44 PolarHBondContact O-N 3.42Å; V42-M47 HydrophobicContact CG1-CG 3.69Å
43	D	51.1	Low	56.1	Low	100 Å²	100	109.8 Å²	109.8	54%	0.535	59%	0.585	S	S	.	*			trans	-52.7	125.2	168.2	-174.8	-8.9	0	0	0	108.6	E45 L46	D43-E45 PolarHBondContact O-N 3.34Å; D43-E45 VanDerWaalsContact O-N 3.12Å; D43-E45 PolarHBondContact OD1-N 3.32Å; D43-L46 HydrophobicContact CB-CB 4.44Å; D43-L46 PolarHBondContact O-N 3Å
44	H	49.3	Very low	54.5	Low	90 Å²	90	110.3 Å²	110.3	42%	0.417	59%	0.588	S	S	.	*	H	α-helix	trans	-54.8	-29.7	179.1	-101.8	-81.1	0	0	0	111.3	W27 V42 H48	W27-H44 AromaticContact CD1-CE1 3.83Å; W27-H44 AromaticContact CD1-NE2 3.47Å; W27-H44 AromaticContact NE1-NE2 3.63Å; V42-H44 PolarHBondContact O-N 3.42Å; H44-H48 PolarHBondContact O-N 2.88Å; H44-H48 VanDerWaalsContact O-N 3.12Å
45	E	50.3	Low	52.7	Low	127 Å²	127	113.3 Å²	113.3	59%	0.593	60%	0.595	S	S	*	*	H	α-helix	trans	-70.9	-33.4	177.6	-67.8	-161.2	154.2	0	0	112.9	D43 M47 H48 S49	D43-E45 PolarHBondContact O-N 3.34Å; D43-E45 VanDerWaalsContact O-N 3.12Å; D43-E45 PolarHBondContact OD1-N 3.32Å; E45-M47 VanDerWaalsContact C-N 3.33Å; E45-M47 PolarHBondContact O-N 2.99Å; E45-H48 CarbonylContact O-C 3.59Å; E45-H48 PolarHBondContact O-N 3.45Å; E45-S49 WeakPolarHBondContact O-CB 3.48Å; E45-S49 PolarHBondContact O-N 3.43Å
46	L	49.2	Very low	51	Low	101 Å²	101	115 Å²	115	53%	0.529	61%	0.606	S	S	.	*	H	α-helix	trans	-67.7	-36.6	178.6	-148.5	111	0	0	0	111.4	D43 S49 L50	D43-L46 HydrophobicContact CB-CB 4.44Å; D43-L46 PolarHBondContact O-N 3Å; L46-S49 PolarHBondContact O-N 3.39Å; L46-S49 PolarHBondContact O-OG 3.48Å; L46-L50 HydrophobicContact CD2-CD1 4.18Å; L46-L50 PolarHBondContact O-N 2.95Å
47	M	48.2	Very low	49.6	Very low	98 Å²	98	119.6 Å²	119.6	48%	0.483	63%	0.628	S	S	.	*	H	α-helix	trans	-70.8	-38.5	174.3	-83.1	-73.7	-70.5	0	0	112.3	V42 E45 S49 L50 F51	V42-M47 HydrophobicContact CG1-CG 3.69Å; E45-M47 VanDerWaalsContact C-N 3.33Å; E45-M47 PolarHBondContact O-N 2.99Å; M47-S49 VanDerWaalsContact C-N 3.27Å; M47-S49 PolarHBondContact O-N 2.99Å; M47-L50 PolarHBondContact O-N 3.44Å; M47-F51 HydrophobicContact CE-CD2 4.08Å; M47-F51 HydrophobicContact CE-CE2 3.96Å; M47-F51 PolarHBondContact O-N 3.33Å; M47-F51 HydrophobicContact SD-CD2 4.13Å; M47-F51 HydrophobicContact SD-CE2 3.8Å
48	H	48	Very low	48.5	Very low	140 Å²	140	125.7 Å²	125.7	65%	0.648	65%	0.649	S	S	*	*	H	α-helix	trans	-64.8	-32.2	170.3	-91.8	-72.3	0	0	0	112	H44 E45 G52	H44-H48 PolarHBondContact O-N 2.88Å; H44-H48 VanDerWaalsContact O-N 3.12Å; E45-H48 CarbonylContact O-C 3.59Å; E45-H48 PolarHBondContact O-N 3.45Å; H48-G52 WeakPolarHBondContact O-CA 3.38Å; H48-G52 PolarHBondContact O-N 2.92Å
49	S	47.8	Very low	47.1	Very low	62 Å²	62	126.2 Å²	126.2	43%	0.434	64%	0.642	S	S	.	*	H	α-helix	trans	-70.3	-34.9	175.2	86.2	0	0	0	0	113.1	E45 L46 M47	E45-S49 WeakPolarHBondContact O-CB 3.48Å; E45-S49 PolarHBondContact O-N 3.43Å; L46-S49 PolarHBondContact O-N 3.39Å; L46-S49 PolarHBondContact O-OG 3.48Å; M47-S49 VanDerWaalsContact C-N 3.27Å; M47-S49 PolarHBondContact O-N 2.99Å
50	L	50.9	Low	46.3	Very low	116 Å²	116	126.4 Å²	126.4	61%	0.607	65%	0.647	S	S	*	*	H	α-helix	trans	-77.9	-28.3	-177.7	-90.1	158.5	0	0	0	113.2	L46 M47	L46-L50 HydrophobicContact CD2-CD1 4.18Å; L46-L50 PolarHBondContact O-N 2.95Å; M47-L50 PolarHBondContact O-N 3.44Å
51	F	51.6	Low	46.3	Very low	157 Å²	157	127.6 Å²	127.6	69%	0.689	66%	0.655	S	S	*	*	H	α-helix	trans	-123.5	-8.1	-174.4	-61.6	-73.9	0	0	0	114.5	M47	M47-F51 HydrophobicContact CE-CD2 4.08Å; M47-F51 HydrophobicContact CE-CE2 3.96Å; M47-F51 PolarHBondContact O-N 3.33Å; M47-F51 HydrophobicContact SD-CD2 4.13Å; M47-F51 HydrophobicContact SD-CE2 3.8Å
52	G	43.2	Very low	45.9	Very low	38 Å²	38	125.6 Å²	125.6	39%	0.392	65%	0.654	S	S	.	*			trans	-91.7	100.1	175.6	0	0	0	0	0	111.6	H48 S54	H48-G52 WeakPolarHBondContact O-CA 3.38Å; H48-G52 PolarHBondContact O-N 2.92Å; G52-S54 PolarHBondContact O-N 3.48Å
53	T	39.6	Very low	45.6	Very low	132 Å²	132	129.5 Å²	129.5	81%	0.81	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.1	128.9	170.5	47.4	0	0	0	0	112.1
54	S	40.7	Very low	45.4	Very low	118 Å²	118	130.6 Å²	130.6	83%	0.825	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	94.4	16.3	153.9	77.4	0	0	0	0	123	G52	G52-S54 PolarHBondContact O-N 3.48Å
55	K	41	Very low	45.5	Very low	198 Å²	198	135.1 Å²	135.1	86%	0.861	69%	0.693	S	S	*	*			trans	-131.8	49.5	171	-78.9	-169.7	175.3	-177.8	0	115.6
56	L	39.2	Very low	45.6	Very low	153 Å²	153	139.7 Å²	139.7	80%	0.801	71%	0.707	S	S	*	*			trans	-88.2	6.6	176.7	-106.4	155.1	0	0	0	114.8
57	E	43	Very low	46.1	Very low	180 Å²	180	143.1 Å²	143.1	84%	0.841	72%	0.72	S	S	*	*	S	Bend	trans	-98.2	1.2	-176.7	-89.2	-176.6	168.6	0	0	116.1
58	F	40.2	Very low	46.9	Very low	194 Å²	194	142 Å²	142	85%	0.851	72%	0.72	S	S	*	*			trans	-141.1	80.5	176.9	-82.2	-88.4	0	0	0	111.7
59	L	36.5	Very low	48.2	Very low	122 Å²	122	138.3 Å²	138.3	64%	0.639	71%	0.707	S	S	*	*			trans	-131.1	118.7	159	-75.4	172.1	0	0	0	108.5
60	L	42.4	Very low	49.7	Very low	145 Å²	145	140.5 Å²	140.5	76%	0.759	72%	0.72	S	S	*	*			trans	-74.4	147.7	-178.3	-80	152.4	0	0	0	110.3	E62	L60-E62 PolarHBondContact O-N 3.25Å
61	P	50	Low	51.1	Low	108 Å²	108	142.2 Å²	142.2	70%	0.701	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-65.4	-10.9	-167.8	-22.7	34	0	0	0	116.8	E63	P61-E63 PolarHBondContact O-N 3.07Å
62	E	48	Very low	52.4	Low	185 Å²	185	140.2 Å²	140.2	86%	0.864	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-82	-11.5	-171.1	-72.7	173.1	169.4	0	0	114.1	L60	L60-E62 PolarHBondContact O-N 3.25Å
63	E	47.9	Very low	54.1	Low	156 Å²	156	143.5 Å²	143.5	73%	0.729	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-96	5.2	178.9	-68	-179.8	159.8	0	0	114.2	P61 Q65	P61-E63 PolarHBondContact O-N 3.07Å; E63-Q65 PolarHBondContact O-N 3.01Å
64	L	46.6	Very low	56.3	Low	123 Å²	123	140.1 Å²	140.1	64%	0.644	71%	0.713	S	S	*	*			trans	-90	37.3	-176	-98.6	140.6	0	0	0	114.9	Y66	L64-Y66 PolarHBondContact O-N 2.75Å
65	Q	50.6	Low	58.3	Low	184 Å²	184	142.4 Å²	142.4	86%	0.86	71%	0.708	S	S	*	*			trans	-74.7	18.3	-173.4	-94.6	-170.8	12.4	0	0	117.1	E63	E63-Q65 PolarHBondContact O-N 3.01Å
66	Y	53.6	Low	60.2	Low	224 Å²	224	135.8 Å²	135.8	88%	0.878	69%	0.69	S	S	*	*			trans	-129.2	81.8	174.1	-108.4	-93.4	0	0	0	111.9	L64	L64-Y66 PolarHBondContact O-N 2.75Å
67	Q	60.3	Low	62.3	Low	172 Å²	172	136.2 Å²	136.2	80%	0.804	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-84	125	168.4	-69.6	-163.9	-5.9	0	0	110.4	T69	Q67-T69 PolarHBondContact O-N 2.91Å
68	P	64.2	Low	64.5	Low	74 Å²	74	130.2 Å²	130.2	48%	0.481	66%	0.664	S	S	.	*	P	Polyproline II helix	trans	-59.9	135	176.8	-20.4	30.3	0	0	0	111.4	M72 L73	P68-M72 HydrophobicContact CB-CB 4.27Å; P68-M72 HydrophobicContact CB-CE 4.41Å; P68-M72 HydrophobicContact CB-SD 4.36Å; P68-L73 HydrophobicContact CB-CG 4.44Å
69	T	76.1	Confident	66.6	Low	63 Å²	63	123.7 Å²	123.7	39%	0.387	65%	0.646	S	S	.	*	P	Polyproline II helix	trans	-66	154.1	177.9	67.1	0	0	0	0	111	Q67 E71 M72 L73	Q67-T69 PolarHBondContact O-N 2.91Å; T69-E71 PolarHBondContact O-N 2.97Å; T69-E71 VanDerWaalsContact O-N 3.08Å; T69-M72 WeakPolarHBondContact O-CB 3.35Å; T69-M72 PolarHBondContact O-N 3.36Å; T69-M72 WeakPolarHBondContact OG1-CG 3.42Å; T69-L73 PolarHBondContact O-N 3.48Å; T69-L73 VanDerWaalsContact O-N 3.17Å
70	P	79.1	Confident	68.9	Low	108 Å²	108	123.3 Å²	123.3	70%	0.701	64%	0.641	S	S	*	*	H	α-helix	trans	-52.4	-32.7	177	-27.9	34.9	0	0	0	113.8	L73 A74	P70-L73 PolarHBondContact O-N 2.98Å; P70-A74 WeakPolarHBondContact O-CB 3.37Å; P70-A74 PolarHBondContact O-N 3.49Å
71	E	79.8	Confident	71.2	Confident	153 Å²	153	122.7 Å²	122.7	72%	0.715	63%	0.632	S	S	*	*	H	α-helix	trans	-67.2	-39.4	176.4	-65.2	147.5	176.1	0	0	112.2	T69 A74 K75	T69-E71 PolarHBondContact O-N 2.97Å; T69-E71 VanDerWaalsContact O-N 3.08Å; E71-A74 PolarHBondContact O-N 3.26Å; E71-K75 WeakPolarHBondContact O-CB 3.48Å; E71-K75 PolarHBondContact O-N 3.48Å
72	M	78	Confident	73	Confident	114 Å²	114	123.5 Å²	123.5	56%	0.562	63%	0.626	S	S	*	*	H	α-helix	trans	-63.6	-43.6	174.3	-69	176.8	67.2	0	0	110.9	P68 T69 K75 A76	P68-M72 HydrophobicContact CB-CB 4.27Å; P68-M72 HydrophobicContact CB-CE 4.41Å; P68-M72 HydrophobicContact CB-SD 4.36Å; T69-M72 WeakPolarHBondContact O-CB 3.35Å; T69-M72 PolarHBondContact O-N 3.36Å; T69-M72 WeakPolarHBondContact OG1-CG 3.42Å; M72-K75 PolarHBondContact O-N 3.25Å; M72-A76 WeakPolarHBondContact O-CB 3.47Å; M72-A76 PolarHBondContact O-N 2.98Å
73	L	79.8	Confident	74.9	Confident	107 Å²	107	117.2 Å²	117.2	56%	0.56	60%	0.602	S	S	*	*	H	α-helix	trans	-62.8	-45	177	-71.3	171.6	0	0	0	111.7	P68 T69 P70 K75 A76 Y77	P68-L73 HydrophobicContact CB-CG 4.44Å; T69-L73 PolarHBondContact O-N 3.48Å; T69-L73 VanDerWaalsContact O-N 3.17Å; P70-L73 PolarHBondContact O-N 2.98Å; L73-K75 VanDerWaalsContact C-N 3.34Å; L73-K75 PolarHBondContact O-N 3.25Å; L73-A76 PolarHBondContact O-N 3.41Å; L73-Y77 WeakPolarHBondContact O-CB 3.49Å; L73-Y77 PolarHBondContact O-N 3.44Å
74	A	84.9	Confident	76.9	Confident	62 Å²	62	113.5 Å²	113.5	51%	0.512	59%	0.587	S	S	.	*	H	α-helix	trans	-61.1	-42.6	176.8	0	0	0	0	0	112	P70 E71 Y77 A78	P70-A74 WeakPolarHBondContact O-CB 3.37Å; P70-A74 PolarHBondContact O-N 3.49Å; E71-A74 PolarHBondContact O-N 3.26Å; A74-Y77 PolarHBondContact O-N 3.12Å; A74-A78 WeakPolarHBondContact O-CB 3.35Å; A74-A78 PolarHBondContact O-N 2.94Å
75	K	83.6	Confident	79	Confident	166 Å²	166	113.1 Å²	113.1	72%	0.722	59%	0.585	S	S	*	*	H	α-helix	trans	-66.6	-41.8	177.7	-165.1	173.3	-175.1	176.9	0	112	E71 M72 L73 A78 A79	E71-K75 WeakPolarHBondContact O-CB 3.48Å; E71-K75 PolarHBondContact O-N 3.48Å; M72-K75 PolarHBondContact O-N 3.25Å; L73-K75 VanDerWaalsContact C-N 3.34Å; L73-K75 PolarHBondContact O-N 3.25Å; K75-A78 PolarHBondContact O-N 3.42Å; K75-A79 WeakPolarHBondContact O-CB 3.49Å; K75-A79 PolarHBondContact O-N 3.32Å
76	A	80.2	Confident	80.8	Confident	59 Å²	59	110.6 Å²	110.6	49%	0.488	57%	0.571	S	S	.	*	H	α-helix	trans	-62.5	-44.1	175.2	0	0	0	0	0	111.6	M72 L73 A79 H80	M72-A76 WeakPolarHBondContact O-CB 3.47Å; M72-A76 PolarHBondContact O-N 2.98Å; L73-A76 PolarHBondContact O-N 3.41Å; A76-A79 PolarHBondContact O-N 3.15Å; A76-H80 WeakPolarHBondContact O-CB 3.36Å; A76-H80 PolarHBondContact O-N 2.87Å
77	Y	84.5	Confident	82.5	Confident	161 Å²	161	106.9 Å²	106.9	63%	0.631	56%	0.559	S	S	*	*	H	α-helix	trans	-62.4	-45.1	176.8	-178.7	-105.7	0	0	0	112.3	L73 A74 A79 H80 K81	L73-Y77 WeakPolarHBondContact O-CB 3.49Å; L73-Y77 PolarHBondContact O-N 3.44Å; A74-Y77 PolarHBondContact O-N 3.12Å; Y77-A79 PolarHBondContact O-N 3.38Å; Y77-H80 PolarHBondContact O-N 3.14Å; Y77-K81 WeakPolarHBondContact O-CB 3.46Å; Y77-K81 PolarHBondContact O-N 3.5Å
78	A	88.1	Confident	84	Confident	55 Å²	55	102.4 Å²	102.4	46%	0.455	55%	0.546	S	S	.	.	H	α-helix	trans	-60.7	-44.4	175.7	0	0	0	0	0	111.9	A74 K75 H80 K81 Q82	A74-A78 WeakPolarHBondContact O-CB 3.35Å; A74-A78 PolarHBondContact O-N 2.94Å; K75-A78 PolarHBondContact O-N 3.42Å; A78-H80 PolarHBondContact O-N 3.35Å; A78-K81 PolarHBondContact O-N 3.42Å; A78-Q82 WeakPolarHBondContact O-CB 3.4Å; A78-Q82 PolarHBondContact O-N 3.21Å
79	A	84.3	Confident	85.3	Confident	57 Å²	57	103 Å²	103	47%	0.471	55%	0.545	S	S	.	.	H	α-helix	trans	-62.3	-41.3	176.1	0	0	0	0	0	112	K75 A76 Y77 Q82 S83	K75-A79 WeakPolarHBondContact O-CB 3.49Å; K75-A79 PolarHBondContact O-N 3.32Å; A76-A79 PolarHBondContact O-N 3.15Å; Y77-A79 PolarHBondContact O-N 3.38Å; A79-Q82 PolarHBondContact O-N 3.19Å; A79-S83 WeakPolarHBondContact O-CB 3.32Å; A79-S83 PolarHBondContact O-N 2.95Å
80	H	85.3	Confident	86	Confident	114 Å²	114	103.5 Å²	103.5	53%	0.528	55%	0.551	S	S	.	*	H	α-helix	trans	-63.3	-47.8	176.5	-174.6	73	0	0	0	111.9	A76 Y77 A78 Q82 S83 I84	A76-H80 WeakPolarHBondContact O-CB 3.36Å; A76-H80 PolarHBondContact O-N 2.87Å; Y77-H80 PolarHBondContact O-N 3.14Å; A78-H80 PolarHBondContact O-N 3.35Å; H80-Q82 VanDerWaalsContact C-N 3.31Å; H80-Q82 PolarHBondContact O-N 3.06Å; H80-S83 WeakPolarHBondContact O-CB 3.29Å; H80-S83 PolarHBondContact O-N 2.99Å; H80-S83 VanDerWaalsContact O-N 3.14Å; H80-I84 VanDerWaalsContact NE2-CD1 3.31Å; H80-I84 WeakPolarHBondContact NE2-CD1 3.19Å; H80-I84 PolarHBondContact O-N 3.29Å
81	K	89.3	Confident	86.5	Confident	131 Å²	131	101.3 Å²	101.3	57%	0.57	54%	0.542	S	S	*	.	H	α-helix	trans	-57.4	-44.6	175.6	-174.8	178	179.8	179.3	0	111.5	Y77 A78 S83 I84 L85	Y77-K81 WeakPolarHBondContact O-CB 3.46Å; Y77-K81 PolarHBondContact O-N 3.5Å; A78-K81 PolarHBondContact O-N 3.42Å; K81-S83 VanDerWaalsContact C-N 3.34Å; K81-S83 PolarHBondContact O-N 3.39Å; K81-I84 PolarHBondContact O-N 2.94Å; K81-L85 WeakPolarHBondContact O-CB 3.14Å; K81-L85 PolarHBondContact O-N 3.44Å
82	Q	88.8	Confident	87.2	Confident	126 Å²	126	101.1 Å²	101.1	59%	0.589	54%	0.535	S	S	*	.	H	α-helix	trans	-67.8	-34.9	178.5	-161.4	168.1	15.1	0	0	112.3	A78 A79 H80 L85 K86	A78-Q82 WeakPolarHBondContact O-CB 3.4Å; A78-Q82 PolarHBondContact O-N 3.21Å; A79-Q82 PolarHBondContact O-N 3.19Å; H80-Q82 VanDerWaalsContact C-N 3.31Å; H80-Q82 PolarHBondContact O-N 3.06Å; Q82-L85 PolarHBondContact O-N 2.99Å; Q82-K86 WeakPolarHBondContact O-CG 3.33Å; Q82-K86 PolarHBondContact O-N 3.05Å
83	S	87.6	Confident	87.9	Confident	52 Å²	52	101.2 Å²	101.2	36%	0.364	53%	0.532	S	S	.	.	H	α-helix	trans	-63.1	-46.9	173.2	-177.2	0	0	0	0	111.9	A79 H80 K81 L85 K86 K87	A79-S83 WeakPolarHBondContact O-CB 3.32Å; A79-S83 PolarHBondContact O-N 2.95Å; H80-S83 WeakPolarHBondContact O-CB 3.29Å; H80-S83 PolarHBondContact O-N 2.99Å; H80-S83 VanDerWaalsContact O-N 3.14Å; K81-S83 VanDerWaalsContact C-N 3.34Å; K81-S83 PolarHBondContact O-N 3.39Å; S83-L85 VanDerWaalsContact C-N 3.34Å; S83-L85 PolarHBondContact O-N 3.41Å; S83-K86 PolarHBondContact O-N 3.48Å; S83-K87 WeakPolarHBondContact O-CG 3.4Å; S83-K87 PolarHBondContact O-N 3.22Å
84	I	89.2	Confident	88.4	Confident	79 Å²	79	101 Å²	101	41%	0.405	53%	0.531	S	S	.	.	H	α-helix	trans	-58.9	-47.6	174.7	-69	172.7	0	0	0	110.4	H80 K81 K86 K87 C88	H80-I84 VanDerWaalsContact NE2-CD1 3.31Å; H80-I84 WeakPolarHBondContact NE2-CD1 3.19Å; H80-I84 PolarHBondContact O-N 3.29Å; K81-I84 PolarHBondContact O-N 2.94Å; I84-K86 VanDerWaalsContact C-N 3.3Å; I84-K86 PolarHBondContact O-N 3.43Å; I84-K87 WeakPolarHBondContact O-CB 3.48Å; I84-K87 PolarHBondContact O-N 3.39Å; I84-C88 PolarHBondContact O-N 2.97Å; I84-C88 PolarHBondContact O-SG 3.13Å; I84-C88 VanDerWaalsContact O-SG 3.42Å
85	L	91.6	Very high	88.8	Confident	114 Å²	114	103.4 Å²	103.4	60%	0.597	53%	0.531	S	S	*	.	H	α-helix	trans	-61.2	-40.2	-178.3	-153.6	125.4	0	0	0	111.8	K81 Q82 S83 C88 L89	K81-L85 WeakPolarHBondContact O-CB 3.14Å; K81-L85 PolarHBondContact O-N 3.44Å; Q82-L85 PolarHBondContact O-N 2.99Å; S83-L85 VanDerWaalsContact C-N 3.34Å; S83-L85 PolarHBondContact O-N 3.41Å; L85-C88 PolarHBondContact O-N 3.1Å; L85-L89 WeakPolarHBondContact O-CB 3.25Å; L85-L89 PolarHBondContact O-N 3.4Å
86	K	89.3	Confident	89.2	Confident	132 Å²	132	100.4 Å²	100.4	57%	0.574	52%	0.518	S	S	*	.	H	α-helix	trans	-63	-39.9	172.6	-77.1	179.2	-180	179.2	0	112.6	Q82 S83 I84 S90	Q82-K86 WeakPolarHBondContact O-CG 3.33Å; Q82-K86 PolarHBondContact O-N 3.05Å; S83-K86 PolarHBondContact O-N 3.48Å; I84-K86 VanDerWaalsContact C-N 3.3Å; I84-K86 PolarHBondContact O-N 3.43Å; K86-S90 WeakPolarHBondContact O-CB 3.38Å; K86-S90 PolarHBondContact O-N 3Å; K86-S90 PolarHBondContact O-OG 3.39Å
87	K	89.3	Confident	89.7	Confident	145 Å²	145	102.3 Å²	102.3	63%	0.63	52%	0.519	S	S	*	.	H	α-helix	trans	-65.2	-47.8	176.1	-73.1	178.8	-178.9	-178.3	0	111.3	S83 I84 L89 S90 A91	S83-K87 WeakPolarHBondContact O-CG 3.4Å; S83-K87 PolarHBondContact O-N 3.22Å; I84-K87 WeakPolarHBondContact O-CB 3.48Å; I84-K87 PolarHBondContact O-N 3.39Å; K87-L89 PolarHBondContact O-N 3.5Å; K87-S90 PolarHBondContact O-N 3.37Å; K87-A91 WeakPolarHBondContact O-CB 3.44Å; K87-A91 PolarHBondContact O-N 3.09Å
88	C	91.1	Very high	90.1	Very high	79 Å²	79	98.3 Å²	98.3	53%	0.534	51%	0.508	S	S	.	.	H	α-helix	trans	-60.9	-44.9	177.4	-66.9	0	0	0	0	111.9	I84 L85 S90 A91 W92	I84-C88 PolarHBondContact O-N 2.97Å; I84-C88 PolarHBondContact O-SG 3.13Å; I84-C88 VanDerWaalsContact O-SG 3.42Å; L85-C88 PolarHBondContact O-N 3.1Å; C88-S90 VanDerWaalsContact C-N 3.33Å; C88-S90 PolarHBondContact O-N 3.19Å; C88-A91 PolarHBondContact O-N 3.4Å; C88-W92 WeakPolarHBondContact O-CB 3.4Å; C88-W92 PolarHBondContact O-N 3.04Å
89	L	92.2	Very high	90.3	Very high	86 Å²	86	101.8 Å²	101.8	45%	0.45	51%	0.513	S	S	.	.	H	α-helix	trans	-62.3	-40.9	177.1	-175.3	65.9	0	0	0	111.9	L85 K87 W92 K93	L85-L89 WeakPolarHBondContact O-CB 3.25Å; L85-L89 PolarHBondContact O-N 3.4Å; K87-L89 PolarHBondContact O-N 3.5Å; L89-W92 HydrophobicContact CD1-CE3 4.19Å; L89-W92 PolarHBondContact O-N 2.62Å; L89-K93 WeakPolarHBondContact O-CG 3.49Å; L89-K93 PolarHBondContact O-N 3.05Å
90	S	90.6	Very high	90.6	Very high	74 Å²	74	107.3 Å²	107.3	52%	0.517	52%	0.521	S	S	.	.	H	α-helix	trans	-64.5	-44.6	176.5	-59.8	0	0	0	0	112	K86 K87 C88 W92 K93 L94	K86-S90 WeakPolarHBondContact O-CB 3.38Å; K86-S90 PolarHBondContact O-N 3Å; K86-S90 PolarHBondContact O-OG 3.39Å; K87-S90 PolarHBondContact O-N 3.37Å; C88-S90 VanDerWaalsContact C-N 3.33Å; C88-S90 PolarHBondContact O-N 3.19Å; S90-W92 PolarHBondContact O-N 2.73Å; S90-K93 PolarHBondContact O-N 2.61Å; S90-L94 WeakPolarHBondContact O-CB 3.28Å; S90-L94 PolarHBondContact O-N 2.86Å
91	A	89.6	Confident	90.8	Very high	61 Å²	61	104.6 Å²	104.6	50%	0.504	52%	0.519	S	S	.	.	H	α-helix	trans	-62.7	-41.9	176.7	0	0	0	0	0	112.1	K87 C88 L94 H95	K87-A91 WeakPolarHBondContact O-CB 3.44Å; K87-A91 PolarHBondContact O-N 3.09Å; C88-A91 PolarHBondContact O-N 3.4Å; A91-L94 PolarHBondContact O-N 3.39Å; A91-H95 PolarHBondContact O-N 2.89Å
92	W	94.8	Very high	90.9	Very high	149 Å²	149	107 Å²	107	56%	0.564	53%	0.525	S	S	*	.	H	α-helix	trans	-62.1	-46.3	175.4	179.4	82.5	0	0	0	112.2	C88 L89 S90 L94 H95 F96	C88-W92 WeakPolarHBondContact O-CB 3.4Å; C88-W92 PolarHBondContact O-N 3.04Å; L89-W92 HydrophobicContact CD1-CE3 4.19Å; L89-W92 PolarHBondContact O-N 2.62Å; S90-W92 PolarHBondContact O-N 2.73Å; W92-L94 VanDerWaalsContact C-N 3.33Å; W92-L94 PolarHBondContact O-N 3.04Å; W92-H95 WeakPolarHBondContact O-CB 3.45Å; W92-H95 PolarHBondContact O-N 3.42Å; W92-F96 HydrophobicContact CD2-CD2 4.12Å; W92-F96 HydrophobicContact CD2-CE2 4.28Å; W92-F96 AromaticContact CE2-CD2 3.68Å; W92-F96 AromaticContact CE2-CE2 3.41Å; W92-F96 VanDerWaalsContact CE2-CE2 3.41Å; W92-F96 HydrophobicContact CG-CD2 4.48Å; W92-F96 AromaticContact CZ2-CD2 3.92Å; W92-F96 HydrophobicContact CZ2-CD2 3.92Å; W92-F96 AromaticContact CZ2-CE2 3.54Å; W92-F96 HydrophobicContact CZ2-CE2 3.54Å; W92-F96 HydrophobicContact CZ2-CZ 4.2Å; W92-F96 AromaticContact NE1-CD2 3.84Å; W92-F96 AromaticContact NE1-CE2 3.31Å; W92-F96 VanDerWaalsContact NE1-CE2 3.31Å; W92-F96 PolarHBondContact O-N 3.12Å; W92-F96 VanDerWaalsContact O-N 3.15Å
93	K	91.6	Very high	91	Very high	117 Å²	117	103.9 Å²	103.9	51%	0.509	52%	0.521	S	S	.	.	H	α-helix	trans	-57.9	-45.2	174.2	-77.1	179.7	178.2	-178.2	0	111.6	L89 S90 H95 F96 I97	L89-K93 WeakPolarHBondContact O-CG 3.49Å; L89-K93 PolarHBondContact O-N 3.05Å; S90-K93 PolarHBondContact O-N 2.61Å; K93-H95 PolarHBondContact O-N 3.18Å; K93-F96 PolarHBondContact O-N 3.01Å; K93-I97 WeakPolarHBondContact O-CG1 3.45Å; K93-I97 PolarHBondContact O-N 3.15Å
94	L	90.9	Very high	91.1	Very high	102 Å²	102	105.8 Å²	105.8	53%	0.534	53%	0.527	S	S	.	.	H	α-helix	trans	-62.1	-42.6	178.6	-175.9	62	0	0	0	111.8	S90 A91 W92 F96 I97 I98	S90-L94 WeakPolarHBondContact O-CB 3.28Å; S90-L94 PolarHBondContact O-N 2.86Å; A91-L94 PolarHBondContact O-N 3.39Å; W92-L94 VanDerWaalsContact C-N 3.33Å; W92-L94 PolarHBondContact O-N 3.04Å; L94-F96 VanDerWaalsContact C-N 3.34Å; L94-F96 PolarHBondContact O-N 3.19Å; L94-I97 PolarHBondContact O-N 3.4Å; L94-I98 HydrophobicContact CD1-CD1 4.21Å; L94-I98 HydrophobicContact CD1-CG1 4.44Å; L94-I98 HydrophobicContact CG-CD1 3.96Å; L94-I98 WeakPolarHBondContact O-CG1 3.39Å; L94-I98 PolarHBondContact O-N 3.07Å
95	H	92.8	Very high	91.2	Very high	113 Å²	113	109.6 Å²	109.6	52%	0.523	54%	0.537	S	S	.	.	H	α-helix	trans	-57.1	-45.8	175.5	177.9	85.3	0	0	0	112	A91 W92 K93 I98 K99	A91-H95 PolarHBondContact O-N 2.89Å; W92-H95 WeakPolarHBondContact O-CB 3.45Å; W92-H95 PolarHBondContact O-N 3.42Å; K93-H95 PolarHBondContact O-N 3.18Å; H95-I98 PolarHBondContact O-N 3.36Å; H95-K99 WeakPolarHBondContact O-CB 3.49Å; H95-K99 PolarHBondContact O-N 3.09Å
96	F	92.2	Very high	91.1	Very high	103 Å²	103	107.9 Å²	107.9	45%	0.452	53%	0.532	S	S	.	.	H	α-helix	trans	-65	-39.5	178.1	-93	-85.5	0	0	0	113	W92 K93 L94 K99 R100	W92-F96 HydrophobicContact CD2-CD2 4.12Å; W92-F96 HydrophobicContact CD2-CE2 4.28Å; W92-F96 AromaticContact CE2-CD2 3.68Å; W92-F96 AromaticContact CE2-CE2 3.41Å; W92-F96 VanDerWaalsContact CE2-CE2 3.41Å; W92-F96 HydrophobicContact CG-CD2 4.48Å; W92-F96 AromaticContact CZ2-CD2 3.92Å; W92-F96 HydrophobicContact CZ2-CD2 3.92Å; W92-F96 AromaticContact CZ2-CE2 3.54Å; W92-F96 HydrophobicContact CZ2-CE2 3.54Å; W92-F96 HydrophobicContact CZ2-CZ 4.2Å; W92-F96 AromaticContact NE1-CD2 3.84Å; W92-F96 AromaticContact NE1-CE2 3.31Å; W92-F96 VanDerWaalsContact NE1-CE2 3.31Å; W92-F96 PolarHBondContact O-N 3.12Å; W92-F96 VanDerWaalsContact O-N 3.15Å; K93-F96 PolarHBondContact O-N 3.01Å; L94-F96 VanDerWaalsContact C-N 3.34Å; L94-F96 PolarHBondContact O-N 3.19Å; F96-K99 PolarHBondContact O-N 3.3Å; F96-R100 WeakPolarHBondContact O-CB 3.34Å; F96-R100 PolarHBondContact O-N 3.07Å
97	I	91.5	Very high	91.2	Very high	98 Å²	98	109.4 Å²	109.4	50%	0.503	54%	0.535	S	S	.	.	H	α-helix	trans	-60.8	-47.6	175.1	-68.5	167.3	0	0	0	110.3	K93 L94 R100 A101	K93-I97 WeakPolarHBondContact O-CG1 3.45Å; K93-I97 PolarHBondContact O-N 3.15Å; L94-I97 PolarHBondContact O-N 3.4Å; I97-R100 PolarHBondContact O-N 3.49Å; I97-A101 WeakPolarHBondContact O-CB 3.48Å; I97-A101 PolarHBondContact O-N 3.46Å
98	I	91.3	Very high	91.2	Very high	77 Å²	77	109.1 Å²	109.1	40%	0.395	53%	0.534	S	S	.	.	H	α-helix	trans	-64.4	-44.2	179	-66.8	169.3	0	0	0	111.1	L94 H95 R100 A101 R102	L94-I98 HydrophobicContact CD1-CD1 4.21Å; L94-I98 HydrophobicContact CD1-CG1 4.44Å; L94-I98 HydrophobicContact CG-CD1 3.96Å; L94-I98 WeakPolarHBondContact O-CG1 3.39Å; L94-I98 PolarHBondContact O-N 3.07Å; H95-I98 PolarHBondContact O-N 3.36Å; I98-R100 VanDerWaalsContact C-N 3.34Å; I98-R100 PolarHBondContact O-N 3.28Å; I98-A101 PolarHBondContact O-N 3.43Å; I98-R102 WeakPolarHBondContact O-CG 3.35Å; I98-R102 PolarHBondContact O-N 3.31Å
99	K	92.2	Very high	91.1	Very high	129 Å²	129	109.1 Å²	109.1	56%	0.561	53%	0.527	S	S	*	.	H	α-helix	trans	-59.1	-44.4	177.5	-173.2	177	-179.4	178.1	0	111.4	H95 F96 R102 A103	H95-K99 WeakPolarHBondContact O-CB 3.49Å; H95-K99 PolarHBondContact O-N 3.09Å; F96-K99 PolarHBondContact O-N 3.3Å; K99-R102 PolarHBondContact O-N 3.1Å; K99-A103 PolarHBondContact O-N 3.06Å; K99-A103 VanDerWaalsContact O-N 3.1Å
100	R	91.1	Very high	90.9	Very high	172 Å²	172	109.4 Å²	109.4	65%	0.649	53%	0.529	S	S	*	.	H	α-helix	trans	-64.6	-41.4	175.7	-169.7	173.7	71.4	173.5	3	112	F96 I97 I98 R102 A103 N104	F96-R100 WeakPolarHBondContact O-CB 3.34Å; F96-R100 PolarHBondContact O-N 3.07Å; I97-R100 PolarHBondContact O-N 3.49Å; I98-R100 VanDerWaalsContact C-N 3.34Å; I98-R100 PolarHBondContact O-N 3.28Å; R100-R102 PolarHBondContact O-N 3.35Å; R100-A103 PolarHBondContact O-N 3.37Å; R100-N104 PolarHBondContact O-N 3Å
101	A	89.5	Confident	90.9	Very high	58 Å²	58	108.7 Å²	108.7	48%	0.479	52%	0.522	S	S	.	.	H	α-helix	trans	-61.8	-42.8	177	0	0	0	0	0	112.2	I97 I98 N104 Y105	I97-A101 WeakPolarHBondContact O-CB 3.48Å; I97-A101 PolarHBondContact O-N 3.46Å; I98-A101 PolarHBondContact O-N 3.43Å; A101-N104 PolarHBondContact O-N 2.97Å; A101-Y105 PolarHBondContact O-N 3.49Å
102	R	92.3	Very high	90.8	Very high	181 Å²	181	111.2 Å²	111.2	68%	0.683	53%	0.526	S	S	*	.	H	α-helix	trans	-62.4	-46.1	175.5	-73.2	179.9	177.7	177.4	-0.6	112.2	I98 K99 R100 N104 Y105 T106	I98-R102 WeakPolarHBondContact O-CG 3.35Å; I98-R102 PolarHBondContact O-N 3.31Å; K99-R102 PolarHBondContact O-N 3.1Å; R100-R102 PolarHBondContact O-N 3.35Å; R102-N104 VanDerWaalsContact C-N 3.33Å; R102-N104 PolarHBondContact O-N 3.07Å; R102-Y105 PolarHBondContact O-N 3.47Å; R102-T106 PolarHBondContact O-N 2.96Å; R102-T106 PolarHBondContact O-OG1 3.48Å; R102-T106 VanDerWaalsContact O-OG1 3.13Å
103	A	90.4	Very high	90.4	Very high	61 Å²	61	106.8 Å²	106.8	50%	0.504	52%	0.52	S	S	.	.	H	α-helix	trans	-59.2	-43.4	177	0	0	0	0	0	112.2	K99 R100 Y105 T106 Y107	K99-A103 PolarHBondContact O-N 3.06Å; K99-A103 VanDerWaalsContact O-N 3.1Å; R100-A103 PolarHBondContact O-N 3.37Å; A103-Y105 PolarHBondContact O-N 2.93Å; A103-T106 PolarHBondContact O-N 2.91Å; A103-Y107 WeakPolarHBondContact O-CB 3.37Å; A103-Y107 PolarHBondContact O-N 3.28Å
104	N	90.8	Very high	90.2	Very high	92 Å²	92	109 Å²	109	49%	0.492	53%	0.53	S	S	.	.	H	α-helix	trans	-64.2	-38.4	176.5	-74.6	-12.8	0	0	0	112.6	R100 A101 R102 K108	R100-N104 PolarHBondContact O-N 3Å; A101-N104 PolarHBondContact O-N 2.97Å; R102-N104 VanDerWaalsContact C-N 3.33Å; R102-N104 PolarHBondContact O-N 3.07Å; N104-K108 WeakPolarHBondContact O-CG 3.27Å; N104-K108 PolarHBondContact O-N 3Å; N104-K108 VanDerWaalsContact O-N 3.07Å
105	Y	90.8	Very high	90.1	Very high	158 Å²	158	109.3 Å²	109.3	62%	0.62	53%	0.531	S	S	*	.	H	α-helix	trans	-65.3	-47.1	176.9	-176.4	-104	0	0	0	111.7	A101 R102 A103 Y107 K108 I109	A101-Y105 PolarHBondContact O-N 3.49Å; R102-Y105 PolarHBondContact O-N 3.47Å; A103-Y105 PolarHBondContact O-N 2.93Å; Y105-Y107 VanDerWaalsContact C-N 3.32Å; Y105-Y107 PolarHBondContact O-N 3.46Å; Y105-K108 PolarHBondContact O-N 3.35Å; Y105-I109 HydrophobicContact CD1-CD1 3.85Å; Y105-I109 HydrophobicContact CE1-CD1 3.24Å; Y105-I109 HydrophobicContact CE1-CG1 4.28Å; Y105-I109 HydrophobicContact CE2-CD1 4.29Å; Y105-I109 VanDerWaalsContact CZ-CD1 3.5Å; Y105-I109 PolarHBondContact O-N 3.38Å
106	T	90	Very high	89.7	Confident	79 Å²	79	107.7 Å²	107.7	49%	0.485	53%	0.533	S	S	.	.	H	α-helix	trans	-59.9	-42.1	175.8	-55.3	0	0	0	0	111.8	R102 A103 K108 I109 N110	R102-T106 PolarHBondContact O-N 2.96Å; R102-T106 PolarHBondContact O-OG1 3.48Å; R102-T106 VanDerWaalsContact O-OG1 3.13Å; A103-T106 PolarHBondContact O-N 2.91Å; T106-K108 PolarHBondContact O-N 3.11Å; T106-I109 PolarHBondContact O-N 2.97Å; T106-N110 PolarHBondContact O-N 3.32Å; T106-N110 PolarHBondContact O-ND2 3.3Å
107	Y	90.1	Very high	89.5	Confident	163 Å²	163	108.8 Å²	108.8	64%	0.639	54%	0.541	S	S	*	.	H	α-helix	trans	-58.8	-47.6	174.8	178.5	-95.9	0	0	0	111.9	A103 Y105 I109 N110 V111	A103-Y107 WeakPolarHBondContact O-CB 3.37Å; A103-Y107 PolarHBondContact O-N 3.28Å; Y105-Y107 VanDerWaalsContact C-N 3.32Å; Y105-Y107 PolarHBondContact O-N 3.46Å; Y107-I109 PolarHBondContact O-N 2.92Å; Y107-N110 PolarHBondContact O-N 3.26Å; Y107-V111 HydrophobicContact CD1-CG2 4.33Å; Y107-V111 HydrophobicContact CE1-CG2 3.93Å; Y107-V111 HydrophobicContact CE2-CG2 4.5Å; Y107-V111 WeakPolarHBondContact O-CG2 3.33Å; Y107-V111 PolarHBondContact O-N 3.08Å
108	K	89.9	Confident	89.4	Confident	140 Å²	140	110.7 Å²	110.7	61%	0.609	55%	0.545	S	S	*	.	H	α-helix	trans	-59.9	-44.6	178.3	-74.6	178.9	179.4	-174.2	0	112.4	N104 Y105 T106 N110 V111 I112	N104-K108 WeakPolarHBondContact O-CG 3.27Å; N104-K108 PolarHBondContact O-N 3Å; N104-K108 VanDerWaalsContact O-N 3.07Å; Y105-K108 PolarHBondContact O-N 3.35Å; T106-K108 PolarHBondContact O-N 3.11Å; K108-N110 PolarHBondContact O-N 3.08Å; K108-V111 PolarHBondContact O-N 3.34Å; K108-I112 WeakPolarHBondContact O-CG1 3.39Å; K108-I112 PolarHBondContact O-N 3.49Å; K108-I112 VanDerWaalsContact O-N 3.09Å
109	I	88.2	Confident	89.2	Confident	79 Å²	79	113.6 Å²	113.6	41%	0.405	56%	0.555	S	S	.	*	H	α-helix	trans	-61.8	-44.2	177.4	-72.9	179.3	0	0	0	111.3	Y105 T106 Y107 V111 I112 A113	Y105-I109 HydrophobicContact CD1-CD1 3.85Å; Y105-I109 HydrophobicContact CE1-CD1 3.24Å; Y105-I109 HydrophobicContact CE1-CG1 4.28Å; Y105-I109 HydrophobicContact CE2-CD1 4.29Å; Y105-I109 VanDerWaalsContact CZ-CD1 3.5Å; Y105-I109 PolarHBondContact O-N 3.38Å; T106-I109 PolarHBondContact O-N 2.97Å; Y107-I109 PolarHBondContact O-N 2.92Å; I109-V111 VanDerWaalsContact C-N 3.29Å; I109-V111 PolarHBondContact O-N 2.98Å; I109-I112 PolarHBondContact O-N 3.24Å; I109-A113 WeakPolarHBondContact O-CB 3.35Å; I109-A113 PolarHBondContact O-N 3.36Å
110	N	89.1	Confident	89.1	Confident	91 Å²	91	115.1 Å²	115.1	49%	0.487	56%	0.557	S	S	.	*	H	α-helix	trans	-62.7	-35.7	179	-76.7	-24.5	0	0	0	112.5	T106 Y107 K108 K114	T106-N110 PolarHBondContact O-N 3.32Å; T106-N110 PolarHBondContact O-ND2 3.3Å; Y107-N110 PolarHBondContact O-N 3.26Å; K108-N110 PolarHBondContact O-N 3.08Å; N110-K114 WeakPolarHBondContact O-CG 3.43Å; N110-K114 PolarHBondContact O-N 3.09Å; N110-K114 VanDerWaalsContact O-N 3.1Å
111	V	89.5	Confident	89	Confident	59 Å²	59	112.2 Å²	112.2	36%	0.358	55%	0.554	S	S	.	*	H	α-helix	trans	-64.2	-47.9	173.4	172.4	0	0	0	0	110.8	Y107 K108 I109 A113 K114 I115	Y107-V111 HydrophobicContact CD1-CG2 4.33Å; Y107-V111 HydrophobicContact CE1-CG2 3.93Å; Y107-V111 HydrophobicContact CE2-CG2 4.5Å; Y107-V111 WeakPolarHBondContact O-CG2 3.33Å; Y107-V111 PolarHBondContact O-N 3.08Å; K108-V111 PolarHBondContact O-N 3.34Å; I109-V111 VanDerWaalsContact C-N 3.29Å; I109-V111 PolarHBondContact O-N 2.98Å; V111-A113 VanDerWaalsContact C-N 3.33Å; V111-A113 PolarHBondContact O-N 2.93Å; V111-K114 PolarHBondContact O-N 3.16Å; V111-I115 HydrophobicContact CG1-CD1 3.91Å; V111-I115 WeakPolarHBondContact O-CG1 3.46Å; V111-I115 PolarHBondContact O-N 2.99Å; V111-I115 VanDerWaalsContact O-N 3.08Å
112	I	87.5	Confident	89.1	Confident	115 Å²	115	114.4 Å²	114.4	59%	0.59	56%	0.555	S	S	*	*	H	α-helix	trans	-61	-42.5	178.4	-65.7	168	0	0	0	111	K108 I109 K114 I115 S116	K108-I112 WeakPolarHBondContact O-CG1 3.39Å; K108-I112 PolarHBondContact O-N 3.49Å; K108-I112 VanDerWaalsContact O-N 3.09Å; I109-I112 PolarHBondContact O-N 3.24Å; I112-K114 PolarHBondContact O-N 3.35Å; I112-I115 PolarHBondContact O-N 3.4Å; I112-S116 WeakPolarHBondContact O-CB 3.18Å; I112-S116 PolarHBondContact O-N 2.99Å
113	A	87.3	Confident	88.9	Confident	55 Å²	55	110.8 Å²	110.8	46%	0.455	54%	0.544	S	S	.	.	H	α-helix	trans	-61.6	-43.9	178.1	0	0	0	0	0	112.4	I109 V111 I115 S116 M117	I109-A113 WeakPolarHBondContact O-CB 3.35Å; I109-A113 PolarHBondContact O-N 3.36Å; V111-A113 VanDerWaalsContact C-N 3.33Å; V111-A113 PolarHBondContact O-N 2.93Å; A113-I115 VanDerWaalsContact C-N 3.35Å; A113-I115 PolarHBondContact O-N 3Å; A113-S116 PolarHBondContact O-N 3.09Å; A113-M117 WeakPolarHBondContact O-CB 3.37Å; A113-M117 PolarHBondContact O-N 2.99Å
114	K	88	Confident	89	Confident	165 Å²	165	112 Å²	112	72%	0.717	54%	0.542	S	S	*	.	H	α-helix	trans	-60.9	-42.1	174.8	-77.2	-179.2	178.3	-177.8	0	112.1	N110 V111 I112 K118	N110-K114 WeakPolarHBondContact O-CG 3.43Å; N110-K114 PolarHBondContact O-N 3.09Å; N110-K114 VanDerWaalsContact O-N 3.1Å; V111-K114 PolarHBondContact O-N 3.16Å; I112-K114 PolarHBondContact O-N 3.35Å; K114-K118 PolarHBondContact O-N 3.39Å; K114-K118 VanDerWaalsContact O-N 3.09Å
115	I	87.7	Confident	89	Confident	108 Å²	108	112.5 Å²	112.5	55%	0.554	54%	0.543	S	S	*	.	H	α-helix	trans	-63.5	-47.6	177.2	-66.9	166.7	0	0	0	110.6	V111 I112 A113 M117 K118 F119	V111-I115 HydrophobicContact CG1-CD1 3.91Å; V111-I115 WeakPolarHBondContact O-CG1 3.46Å; V111-I115 PolarHBondContact O-N 2.99Å; V111-I115 VanDerWaalsContact O-N 3.08Å; I112-I115 PolarHBondContact O-N 3.4Å; A113-I115 VanDerWaalsContact C-N 3.35Å; A113-I115 PolarHBondContact O-N 3Å; I115-M117 PolarHBondContact O-N 3.46Å; I115-K118 PolarHBondContact O-N 3.21Å; I115-F119 PolarHBondContact O-N 3.48Å
116	S	85.3	Confident	89	Confident	79 Å²	79	109 Å²	109	55%	0.552	54%	0.535	S	S	*	.	H	α-helix	trans	-60.4	-42.8	178.8	-177.4	0	0	0	0	112.3	I112 A113 K118 F119 R120	I112-S116 WeakPolarHBondContact O-CB 3.18Å; I112-S116 PolarHBondContact O-N 2.99Å; A113-S116 PolarHBondContact O-N 3.09Å; S116-K118 PolarHBondContact O-N 3.48Å; S116-F119 PolarHBondContact O-N 2.96Å; S116-R120 PolarHBondContact O-N 3.32Å
117	M	87.7	Confident	89.1	Confident	126 Å²	126	111.7 Å²	111.7	62%	0.621	54%	0.536	S	S	*	.	H	α-helix	trans	-62.1	-43.6	176.3	-174	177.3	177.6	0	0	112.1	A113 I115 R120 L121	A113-M117 WeakPolarHBondContact O-CB 3.37Å; A113-M117 PolarHBondContact O-N 2.99Å; I115-M117 PolarHBondContact O-N 3.46Å; M117-R120 PolarHBondContact O-N 2.89Å; M117-L121 PolarHBondContact O-N 3.48Å
118	K	88.8	Confident	89.1	Confident	137 Å²	137	110.4 Å²	110.4	60%	0.596	54%	0.536	S	S	*	.	H	α-helix	trans	-61.5	-44.5	176.2	-171.9	178.9	-179.5	-179.7	0	111.5	K114 I115 S116 R120 L121 Q122	K114-K118 PolarHBondContact O-N 3.39Å; K114-K118 VanDerWaalsContact O-N 3.09Å; I115-K118 PolarHBondContact O-N 3.21Å; S116-K118 PolarHBondContact O-N 3.48Å; K118-R120 PolarHBondContact O-N 3.4Å; K118-L121 PolarHBondContact O-N 3.42Å; K118-Q122 WeakPolarHBondContact O-CG 3.46Å; K118-Q122 PolarHBondContact O-N 2.91Å
119	F	88	Confident	89.3	Confident	138 Å²	138	110.9 Å²	110.9	61%	0.605	53%	0.534	S	S	*	.	H	α-helix	trans	-63.3	-41	178.3	-170	-98.6	0	0	0	112.2	I115 S116 Q122 K123	I115-F119 PolarHBondContact O-N 3.48Å; S116-F119 PolarHBondContact O-N 2.96Å; F119-Q122 PolarHBondContact O-N 3.32Å; F119-K123 WeakPolarHBondContact O-CB 3.41Å; F119-K123 PolarHBondContact O-N 3.46Å
120	R	88.2	Confident	89.5	Confident	161 Å²	161	111.8 Å²	111.8	61%	0.608	54%	0.537	S	S	*	.	H	α-helix	trans	-63	-43.4	176	-172.9	177.1	63.7	172.7	-0.1	112.1	S116 M117 K118 K123 N124	S116-R120 PolarHBondContact O-N 3.32Å; M117-R120 PolarHBondContact O-N 2.89Å; K118-R120 PolarHBondContact O-N 3.4Å; R120-K123 PolarHBondContact O-N 3.42Å; R120-N124 PolarHBondContact O-N 3.13Å; R120-N124 VanDerWaalsContact O-N 3.08Å
121	L	90	Very high	89.6	Confident	112 Å²	112	111.8 Å²	111.8	59%	0.586	54%	0.54	S	S	*	.	H	α-helix	trans	-61	-46.4	175.9	-167.4	84	0	0	0	111	M117 K118 K123 N124 I125	M117-L121 PolarHBondContact O-N 3.48Å; K118-L121 PolarHBondContact O-N 3.42Å; L121-K123 VanDerWaalsContact C-N 3.32Å; L121-K123 PolarHBondContact O-N 3.04Å; L121-N124 PolarHBondContact O-N 3.46Å; L121-I125 HydrophobicContact CD2-CD1 4.27Å; L121-I125 HydrophobicContact CG-CD1 4.1Å; L121-I125 WeakPolarHBondContact O-CG1 3.23Å; L121-I125 PolarHBondContact O-N 2.87Å
122	Q	90.9	Very high	89.7	Confident	103 Å²	103	116 Å²	116	48%	0.481	55%	0.551	S	S	.	*	H	α-helix	trans	-59	-41.8	176.2	-74	175	-22.6	0	0	112.1	K118 F119 N124 I125 L126	K118-Q122 WeakPolarHBondContact O-CG 3.46Å; K118-Q122 PolarHBondContact O-N 2.91Å; F119-Q122 PolarHBondContact O-N 3.32Å; Q122-N124 PolarHBondContact O-N 3.08Å; Q122-I125 PolarHBondContact O-N 3.5Å; Q122-L126 VanDerWaalsContact O-CB 3.29Å; Q122-L126 WeakPolarHBondContact O-CB 3.42Å; Q122-L126 PolarHBondContact O-N 2.96Å
123	K	89.5	Confident	89.7	Confident	106 Å²	106	112 Å²	112	46%	0.461	53%	0.531	S	S	.	.	H	α-helix	trans	-63.6	-39	177.3	-170.1	175.4	-178.6	176	0	112.5	F119 R120 L121 L126 R127	F119-K123 WeakPolarHBondContact O-CB 3.41Å; F119-K123 PolarHBondContact O-N 3.46Å; R120-K123 PolarHBondContact O-N 3.42Å; L121-K123 VanDerWaalsContact C-N 3.32Å; L121-K123 PolarHBondContact O-N 3.04Å; K123-L126 PolarHBondContact O-N 3.18Å; K123-R127 WeakPolarHBondContact O-CG 3.42Å; K123-R127 PolarHBondContact O-N 3.28Å; K123-R127 VanDerWaalsContact O-N 3.08Å
124	N	91.4	Very high	89.9	Confident	85 Å²	85	116 Å²	116	46%	0.455	54%	0.54	S	S	.	.	H	α-helix	trans	-67.5	-46.6	176	-74	-4.4	0	0	0	111.4	R120 L121 Q122 L126 R127 E128	R120-N124 PolarHBondContact O-N 3.13Å; R120-N124 VanDerWaalsContact O-N 3.08Å; L121-N124 PolarHBondContact O-N 3.46Å; Q122-N124 PolarHBondContact O-N 3.08Å; N124-L126 VanDerWaalsContact C-N 3.27Å; N124-L126 PolarHBondContact O-N 2.87Å; N124-R127 PolarHBondContact O-N 3.5Å; N124-R127 VanDerWaalsContact O-N 3.16Å; N124-E128 PolarHBondContact O-N 3.49Å; N124-E128 VanDerWaalsContact O-N 3.09Å
125	I	90.5	Very high	90	Very high	103 Å²	103	113.5 Å²	113.5	53%	0.528	53%	0.53	S	S	.	.	H	α-helix	trans	-58.3	-42.3	175.4	-66.8	166.5	0	0	0	110.6	L121 Q122 R127 E128 W129	L121-I125 HydrophobicContact CD2-CD1 4.27Å; L121-I125 HydrophobicContact CG-CD1 4.1Å; L121-I125 WeakPolarHBondContact O-CG1 3.23Å; L121-I125 PolarHBondContact O-N 2.87Å; Q122-I125 PolarHBondContact O-N 3.5Å; I125-R127 VanDerWaalsContact C-N 3.35Å; I125-R127 PolarHBondContact O-N 3.43Å; I125-E128 PolarHBondContact O-N 3.18Å; I125-W129 VanDerWaalsContact O-CB 3.27Å; I125-W129 WeakPolarHBondContact O-CB 3.13Å; I125-W129 PolarHBondContact O-N 3.44Å
126	L	91.3	Very high	90	Very high	86 Å²	86	110.4 Å²	110.4	45%	0.45	52%	0.516	S	S	.	.	H	α-helix	trans	-63.5	-39	178.7	-175.4	65.5	0	0	0	112.2	Q122 K123 N124 W129 Q130	Q122-L126 VanDerWaalsContact O-CB 3.29Å; Q122-L126 WeakPolarHBondContact O-CB 3.42Å; Q122-L126 PolarHBondContact O-N 2.96Å; K123-L126 PolarHBondContact O-N 3.18Å; N124-L126 VanDerWaalsContact C-N 3.27Å; N124-L126 PolarHBondContact O-N 2.87Å; L126-W129 HydrophobicContact CD1-CE3 3.9Å; L126-W129 HydrophobicContact CD1-CZ3 4.29Å; L126-W129 PolarHBondContact O-N 3.04Å; L126-Q130 WeakPolarHBondContact O-CB 3.29Å; L126-Q130 VanDerWaalsContact O-CG 3.23Å; L126-Q130 WeakPolarHBondContact O-CG 3.5Å; L126-Q130 PolarHBondContact O-N 3.38Å
127	R	91.6	Very high	90.2	Very high	135 Å²	135	112 Å²	112	51%	0.509	51%	0.513	S	S	.	.	H	α-helix	trans	-64.7	-48.4	176	-78	177.2	-179.7	171.6	-4.3	111.9	K123 N124 I125 W129 Q130 V131	K123-R127 WeakPolarHBondContact O-CG 3.42Å; K123-R127 PolarHBondContact O-N 3.28Å; K123-R127 VanDerWaalsContact O-N 3.08Å; N124-R127 PolarHBondContact O-N 3.5Å; N124-R127 VanDerWaalsContact O-N 3.16Å; I125-R127 VanDerWaalsContact C-N 3.35Å; I125-R127 PolarHBondContact O-N 3.43Å; R127-W129 VanDerWaalsContact C-N 3.3Å; R127-W129 PolarHBondContact O-N 2.9Å; R127-Q130 WeakPolarHBondContact O-CB 3.27Å; R127-Q130 PolarHBondContact O-N 2.95Å; R127-Q130 VanDerWaalsContact O-N 3.13Å; R127-V131 PolarHBondContact O-N 3.12Å
128	E	91.7	Very high	90.2	Very high	136 Å²	136	108.9 Å²	108.9	64%	0.636	50%	0.504	S	S	*	.	H	α-helix	trans	-60.9	-42.4	176.9	-67.1	-53.6	134.7	0	0	111.3	N124 I125 Q130 V131 Y132	N124-E128 PolarHBondContact O-N 3.49Å; N124-E128 VanDerWaalsContact O-N 3.09Å; I125-E128 PolarHBondContact O-N 3.18Å; E128-Q130 VanDerWaalsContact C-N 3.33Å; E128-Q130 PolarHBondContact O-N 2.94Å; E128-V131 PolarHBondContact O-N 3.19Å; E128-Y132 PolarHBondContact O-N 3.19Å
129	W	93.5	Very high	90.2	Very high	150 Å²	150	108.5 Å²	108.5	57%	0.568	50%	0.502	S	S	*	.	H	α-helix	trans	-62.3	-38.9	174.5	179	81	0	0	0	112.5	I125 L126 R127 Y132 T133	I125-W129 VanDerWaalsContact O-CB 3.27Å; I125-W129 WeakPolarHBondContact O-CB 3.13Å; I125-W129 PolarHBondContact O-N 3.44Å; L126-W129 HydrophobicContact CD1-CE3 3.9Å; L126-W129 HydrophobicContact CD1-CZ3 4.29Å; L126-W129 PolarHBondContact O-N 3.04Å; R127-W129 VanDerWaalsContact C-N 3.3Å; R127-W129 PolarHBondContact O-N 2.9Å; W129-Y132 PolarHBondContact O-N 2.95Å; W129-T133 WeakPolarHBondContact O-CB 3.47Å; W129-T133 PolarHBondContact O-N 3.41Å; W129-T133 PolarHBondContact O-OG1 2.68Å
130	Q	91	Very high	90.1	Very high	97 Å²	97	107.6 Å²	107.6	45%	0.453	50%	0.5	S	S	.	.	H	α-helix	trans	-62.5	-44.4	175.4	-79.7	173.1	-21.2	0	0	111.7	L126 R127 E128 T133 Q134	L126-Q130 WeakPolarHBondContact O-CB 3.29Å; L126-Q130 VanDerWaalsContact O-CG 3.23Å; L126-Q130 WeakPolarHBondContact O-CG 3.5Å; L126-Q130 PolarHBondContact O-N 3.38Å; R127-Q130 WeakPolarHBondContact O-CB 3.27Å; R127-Q130 PolarHBondContact O-N 2.95Å; R127-Q130 VanDerWaalsContact O-N 3.13Å; E128-Q130 VanDerWaalsContact C-N 3.33Å; E128-Q130 PolarHBondContact O-N 2.94Å; Q130-T133 PolarHBondContact O-N 3.05Å; Q130-Q134 WeakPolarHBondContact O-CG 3.41Å; Q130-Q134 PolarHBondContact O-N 2.82Å
131	V	92	Very high	90.1	Very high	91 Å²	91	108.5 Å²	108.5	55%	0.552	50%	0.503	S	S	*	.	H	α-helix	trans	-62.1	-49.6	176.7	174.8	0	0	0	0	110.8	R127 E128 T133 Q134 F135	R127-V131 PolarHBondContact O-N 3.12Å; E128-V131 PolarHBondContact O-N 3.19Å; V131-T133 VanDerWaalsContact C-N 3.31Å; V131-T133 PolarHBondContact O-N 3.42Å; V131-Q134 WeakPolarHBondContact O-CB 3.41Å; V131-Q134 PolarHBondContact O-N 3.19Å; V131-F135 PolarHBondContact O-N 3.44Å
132	Y	90.9	Very high	89.9	Confident	149 Å²	149	109 Å²	109	58%	0.584	50%	0.504	S	S	*	.	H	α-helix	trans	-59.7	-42.1	176.2	178	-104.9	0	0	0	112.2	E128 W129 Q134 F135 V136	E128-Y132 PolarHBondContact O-N 3.19Å; W129-Y132 PolarHBondContact O-N 2.95Å; Y132-Q134 VanDerWaalsContact C-N 3.32Å; Y132-Q134 PolarHBondContact O-N 3.21Å; Y132-F135 WeakPolarHBondContact O-CB 3.4Å; Y132-F135 PolarHBondContact O-N 3.34Å; Y132-V136 HydrophobicContact CD1-CG2 4.15Å; Y132-V136 HydrophobicContact CD2-CG2 4.49Å; Y132-V136 HydrophobicContact CE1-CG2 3.67Å; Y132-V136 HydrophobicContact CE2-CG2 4.04Å; Y132-V136 WeakPolarHBondContact O-CG2 3.39Å; Y132-V136 PolarHBondContact O-N 3.19Å
133	T	88.8	Confident	89.6	Confident	29 Å²	29	105.6 Å²	105.6	18%	0.178	50%	0.496	C	S	.	.	H	α-helix	trans	-62.9	-38.5	177.6	-61.3	0	0	0	0	111.6	W129 Q130 V131 V136 K137	W129-T133 WeakPolarHBondContact O-CB 3.47Å; W129-T133 PolarHBondContact O-N 3.41Å; W129-T133 PolarHBondContact O-OG1 2.68Å; Q130-T133 PolarHBondContact O-N 3.05Å; V131-T133 VanDerWaalsContact C-N 3.31Å; V131-T133 PolarHBondContact O-N 3.42Å; T133-V136 PolarHBondContact O-N 2.92Å; T133-K137 HydrophobicContact CG2-CD 4.26Å; T133-K137 WeakPolarHBondContact O-CB 3.4Å; T133-K137 VanDerWaalsContact O-CG 3.31Å; T133-K137 WeakPolarHBondContact O-CG 3.2Å; T133-K137 PolarHBondContact O-N 3.35Å
134	Q	90.3	Very high	89.3	Confident	139 Å²	139	106.7 Å²	106.7	65%	0.65	50%	0.503	S	S	*	.	H	α-helix	trans	-64.6	-42.3	174.2	-74.7	-177	-2.4	0	0	111.7	Q130 V131 Y132 K137 S138	Q130-Q134 WeakPolarHBondContact O-CG 3.41Å; Q130-Q134 PolarHBondContact O-N 2.82Å; V131-Q134 WeakPolarHBondContact O-CB 3.41Å; V131-Q134 PolarHBondContact O-N 3.19Å; Y132-Q134 VanDerWaalsContact C-N 3.32Å; Y132-Q134 PolarHBondContact O-N 3.21Å; Q134-K137 PolarHBondContact O-N 3.1Å; Q134-S138 PolarHBondContact O-N 2.92Å
135	F	90.8	Very high	89	Confident	114 Å²	114	105.9 Å²	105.9	50%	0.5	50%	0.504	S	S	.	.	H	α-helix	trans	-59.6	-46.8	174.4	171.4	-99.6	0	0	0	112	V131 Y132 S138 K139	V131-F135 PolarHBondContact O-N 3.44Å; Y132-F135 WeakPolarHBondContact O-CB 3.4Å; Y132-F135 PolarHBondContact O-N 3.34Å; F135-S138 WeakPolarHBondContact O-CB 3.34Å; F135-S138 PolarHBondContact O-N 3.46Å; F135-K139 HydrophobicContact CE1-CD 4.27Å; F135-K139 HydrophobicContact CZ-CD 4.14Å; F135-K139 PolarHBondContact O-N 2.91Å; F135-K139 VanDerWaalsContact O-N 3.1Å
136	V	88.5	Confident	88.5	Confident	43 Å²	43	106 Å²	106	26%	0.261	51%	0.505	S	S	.	.	H	α-helix	trans	-61.8	-45.4	176.6	172.9	0	0	0	0	111.1	Y132 T133 S138 K139 Q140	Y132-V136 HydrophobicContact CD1-CG2 4.15Å; Y132-V136 HydrophobicContact CD2-CG2 4.49Å; Y132-V136 HydrophobicContact CE1-CG2 3.67Å; Y132-V136 HydrophobicContact CE2-CG2 4.04Å; Y132-V136 WeakPolarHBondContact O-CG2 3.39Å; Y132-V136 PolarHBondContact O-N 3.19Å; T133-V136 PolarHBondContact O-N 2.92Å; V136-S138 VanDerWaalsContact C-N 3.28Å; V136-S138 PolarHBondContact O-N 3.27Å; V136-K139 PolarHBondContact O-N 3.36Å; V136-Q140 HydrophobicContact CG1-CG 4.34Å; V136-Q140 WeakPolarHBondContact O-CG 3.31Å; V136-Q140 PolarHBondContact O-N 2.93Å
137	K	89.4	Confident	88	Confident	112 Å²	112	107.4 Å²	107.4	49%	0.487	51%	0.512	S	S	.	.	H	α-helix	trans	-59.3	-37.9	175.5	-78.1	177.7	178.4	-179.4	0	112.2	T133 Q134 Q140 R141	T133-K137 HydrophobicContact CG2-CD 4.26Å; T133-K137 WeakPolarHBondContact O-CB 3.4Å; T133-K137 VanDerWaalsContact O-CG 3.31Å; T133-K137 WeakPolarHBondContact O-CG 3.2Å; T133-K137 PolarHBondContact O-N 3.35Å; Q134-K137 PolarHBondContact O-N 3.1Å; K137-Q140 PolarHBondContact O-N 3.43Å; K137-R141 VanDerWaalsContact O-CG 3.3Å; K137-R141 WeakPolarHBondContact O-CG 3.3Å; K137-R141 PolarHBondContact O-N 2.91Å
138	S	88.1	Confident	87.6	Confident	61 Å²	61	103.8 Å²	103.8	43%	0.427	51%	0.505	S	S	.	.	H	α-helix	trans	-63.3	-48.3	176	-173.9	0	0	0	0	111.9	Q134 F135 V136 Q140 R141 M142	Q134-S138 PolarHBondContact O-N 2.92Å; F135-S138 WeakPolarHBondContact O-CB 3.34Å; F135-S138 PolarHBondContact O-N 3.46Å; V136-S138 VanDerWaalsContact C-N 3.28Å; V136-S138 PolarHBondContact O-N 3.27Å; S138-Q140 VanDerWaalsContact C-N 3.35Å; S138-Q140 PolarHBondContact O-N 2.97Å; S138-R141 PolarHBondContact O-N 3.38Å; S138-M142 PolarHBondContact O-N 3.08Å; S138-M142 VanDerWaalsContact O-N 3.08Å
139	K	86.9	Confident	87	Confident	128 Å²	128	103.4 Å²	103.4	56%	0.557	50%	0.503	S	S	*	.	H	α-helix	trans	-60.2	-42.3	174	-84.8	-164.6	171.2	-173.4	0	112.8	F135 V136 R141 M142 G143	F135-K139 HydrophobicContact CE1-CD 4.27Å; F135-K139 HydrophobicContact CZ-CD 4.14Å; F135-K139 PolarHBondContact O-N 2.91Å; F135-K139 VanDerWaalsContact O-N 3.1Å; V136-K139 PolarHBondContact O-N 3.36Å; K139-R141 VanDerWaalsContact C-N 3.35Å; K139-R141 PolarHBondContact O-N 3.34Å; K139-M142 HydrophobicContact CG-CE 4.4Å; K139-M142 PolarHBondContact O-N 3.49Å; K139-G143 PolarHBondContact O-N 3.12Å
140	Q	87.8	Confident	86.3	Confident	120 Å²	120	101.2 Å²	101.2	56%	0.561	50%	0.502	S	S	*	.	H	α-helix	trans	-61.8	-41.6	176.4	-73.9	174.6	-14.7	0	0	111.9	V136 K137 S138 G143 Q144	V136-Q140 HydrophobicContact CG1-CG 4.34Å; V136-Q140 WeakPolarHBondContact O-CG 3.31Å; V136-Q140 PolarHBondContact O-N 2.93Å; K137-Q140 PolarHBondContact O-N 3.43Å; S138-Q140 VanDerWaalsContact C-N 3.35Å; S138-Q140 PolarHBondContact O-N 2.97Å; Q140-G143 PolarHBondContact O-N 3.23Å; Q140-Q144 VanDerWaalsContact O-CB 3.24Å; Q140-Q144 WeakPolarHBondContact O-CB 3.49Å; Q140-Q144 PolarHBondContact O-N 3.43Å
141	R	87.5	Confident	85.6	Confident	180 Å²	180	102.8 Å²	102.8	68%	0.679	51%	0.507	S	S	*	.	H	α-helix	trans	-62.2	-43.2	175.9	-75.7	172.3	-179.4	175	-1.4	112.3	K137 S138 K139 Q144 S145	K137-R141 VanDerWaalsContact O-CG 3.3Å; K137-R141 WeakPolarHBondContact O-CG 3.3Å; K137-R141 PolarHBondContact O-N 2.91Å; S138-R141 PolarHBondContact O-N 3.38Å; K139-R141 VanDerWaalsContact C-N 3.35Å; K139-R141 PolarHBondContact O-N 3.34Å; R141-Q144 PolarHBondContact O-N 2.91Å; R141-S145 PolarHBondContact O-N 3.49Å
142	M	84.7	Confident	85	Confident	122 Å²	122	102.3 Å²	102.3	60%	0.601	50%	0.501	S	S	*	.	H	α-helix	trans	-62.9	-47.1	175.6	-74.9	-170	-74.3	0	0	111.8	S138 K139 Q144 S145 L146	S138-M142 PolarHBondContact O-N 3.08Å; S138-M142 VanDerWaalsContact O-N 3.08Å; K139-M142 HydrophobicContact CG-CE 4.4Å; K139-M142 PolarHBondContact O-N 3.49Å; M142-Q144 VanDerWaalsContact C-N 3.32Å; M142-Q144 PolarHBondContact O-N 3.23Å; M142-S145 WeakPolarHBondContact O-CB 3.24Å; M142-S145 PolarHBondContact O-N 3.43Å; M142-L146 PolarHBondContact O-N 3.4Å; M142-L146 VanDerWaalsContact O-N 3.12Å
143	G	85.2	Confident	84.5	Confident	32 Å²	32	102.5 Å²	102.5	33%	0.33	51%	0.505	S	S	.	.	H	α-helix	trans	-60.6	-41.7	175.8	0	0	0	0	0	112.4	K139 Q140 S145 L146 I147	K139-G143 PolarHBondContact O-N 3.12Å; Q140-G143 PolarHBondContact O-N 3.23Å; G143-S145 PolarHBondContact O-N 3.39Å; G143-L146 PolarHBondContact O-N 3.31Å; G143-I147 VanDerWaalsContact O-CG1 3.27Å; G143-I147 WeakPolarHBondContact O-CG1 3.43Å; G143-I147 PolarHBondContact O-N 3.38Å
144	Q	83.3	Confident	84	Confident	129 Å²	129	104.4 Å²	104.4	60%	0.603	52%	0.517	S	S	*	.	H	α-helix	trans	-63.5	-40.9	176.3	-170.5	173.5	6.7	0	0	111.6	Q140 R141 M142 L146 I147 T148	Q140-Q144 VanDerWaalsContact O-CB 3.24Å; Q140-Q144 WeakPolarHBondContact O-CB 3.49Å; Q140-Q144 PolarHBondContact O-N 3.43Å; R141-Q144 PolarHBondContact O-N 2.91Å; M142-Q144 VanDerWaalsContact C-N 3.32Å; M142-Q144 PolarHBondContact O-N 3.23Å; Q144-L146 PolarHBondContact O-N 3.49Å; Q144-I147 PolarHBondContact O-N 2.86Å; Q144-T148 VanDerWaalsContact O-CB 3.32Å; Q144-T148 WeakPolarHBondContact O-CB 3.32Å; Q144-T148 PolarHBondContact O-N 2.86Å; Q144-T148 PolarHBondContact O-OG1 3.44Å
145	S	85.1	Confident	83.2	Confident	67 Å²	67	99.8 Å²	99.8	47%	0.469	50%	0.498	S	S	.	.	H	α-helix	trans	-60.6	-44.7	175.9	-171.7	0	0	0	0	112.2	R141 M142 G143 T148 Q149	R141-S145 PolarHBondContact O-N 3.49Å; M142-S145 WeakPolarHBondContact O-CB 3.24Å; M142-S145 PolarHBondContact O-N 3.43Å; G143-S145 PolarHBondContact O-N 3.39Å; S145-T148 PolarHBondContact O-N 2.82Å; S145-Q149 PolarHBondContact O-N 3.08Å
146	L	81	Confident	82.5	Confident	106 Å²	106	97.4 Å²	97.4	56%	0.555	49%	0.493	S	S	*	.	H	α-helix	trans	-65.2	-45.1	179.1	-164.5	79.7	0	0	0	111.5	M142 G143 Q144 T148 Q149 I150	M142-L146 PolarHBondContact O-N 3.4Å; M142-L146 VanDerWaalsContact O-N 3.12Å; G143-L146 PolarHBondContact O-N 3.31Å; Q144-L146 PolarHBondContact O-N 3.49Å; L146-T148 VanDerWaalsContact C-N 3.32Å; L146-T148 PolarHBondContact O-N 3.46Å; L146-Q149 PolarHBondContact O-N 3.35Å; L146-I150 HydrophobicContact CG-CD1 4.41Å; L146-I150 WeakPolarHBondContact O-CG1 3.44Å; L146-I150 PolarHBondContact O-N 2.99Å; L146-I150 VanDerWaalsContact O-N 3.08Å
147	I	79.4	Confident	82	Confident	116 Å²	116	97.9 Å²	97.9	60%	0.595	50%	0.496	S	S	*	.	H	α-helix	trans	-62.3	-42	176.7	-68.5	166.5	0	0	0	110.5	G143 Q144 I150 K151	G143-I147 VanDerWaalsContact O-CG1 3.27Å; G143-I147 WeakPolarHBondContact O-CG1 3.43Å; G143-I147 PolarHBondContact O-N 3.38Å; Q144-I147 PolarHBondContact O-N 2.86Å; I147-I150 PolarHBondContact O-N 2.93Å; I147-K151 WeakPolarHBondContact O-CB 3.27Å; I147-K151 PolarHBondContact O-N 3Å
148	T	83	Confident	81.3	Confident	59 Å²	59	97.3 Å²	97.3	36%	0.362	50%	0.498	S	S	.	.	H	α-helix	trans	-61.5	-45.7	176.7	-62.8	0	0	0	0	110.9	Q144 S145 L146 I150 K151 D152	Q144-T148 VanDerWaalsContact O-CB 3.32Å; Q144-T148 WeakPolarHBondContact O-CB 3.32Å; Q144-T148 PolarHBondContact O-N 2.86Å; Q144-T148 PolarHBondContact O-OG1 3.44Å; S145-T148 PolarHBondContact O-N 2.82Å; L146-T148 VanDerWaalsContact C-N 3.32Å; L146-T148 PolarHBondContact O-N 3.46Å; T148-I150 PolarHBondContact O-N 3.05Å; T148-K151 PolarHBondContact O-N 2.91Å; T148-D152 VanDerWaalsContact CG2-OD2 3.31Å; T148-D152 WeakPolarHBondContact CG2-OD2 3.4Å; T148-D152 VanDerWaalsContact O-CB 3.28Å; T148-D152 WeakPolarHBondContact O-CB 3.37Å; T148-D152 PolarHBondContact O-N 2.73Å
149	Q	80.2	Confident	80.5	Confident	127 Å²	127	102.3 Å²	102.3	59%	0.593	51%	0.509	S	S	*	.	H	α-helix	trans	-60	-46.7	176.9	-77	-179.3	-6.1	0	0	113	S145 L146 K151 D152 F153	S145-Q149 PolarHBondContact O-N 3.08Å; L146-Q149 PolarHBondContact O-N 3.35Å; Q149-K151 VanDerWaalsContact C-N 3.35Å; Q149-D152 PolarHBondContact O-N 2.69Å; Q149-F153 WeakPolarHBondContact O-CB 3.17Å; Q149-F153 PolarHBondContact O-N 3.16Å
150	I	78.8	Confident	79.8	Confident	105 Å²	105	101.8 Å²	101.8	54%	0.538	51%	0.507	S	S	.	.	H	α-helix	trans	-63.6	-44.4	178.3	-66.4	169.3	0	0	0	110.3	L146 I147 T148 F153 T154	L146-I150 HydrophobicContact CG-CD1 4.41Å; L146-I150 WeakPolarHBondContact O-CG1 3.44Å; L146-I150 PolarHBondContact O-N 2.99Å; L146-I150 VanDerWaalsContact O-N 3.08Å; I147-I150 PolarHBondContact O-N 2.93Å; T148-I150 PolarHBondContact O-N 3.05Å; I150-F153 PolarHBondContact O-N 3.24Å; I150-T154 WeakPolarHBondContact O-CB 3.47Å; I150-T154 PolarHBondContact O-N 2.63Å; I150-T154 PolarHBondContact O-OG1 3.37Å
151	K	76.3	Confident	79.2	Confident	129 Å²	129	102 Å²	102	56%	0.561	51%	0.506	S	S	*	.	H	α-helix	trans	-59.9	-49.9	176.8	-179.8	-171.6	172	-166.8	0	110.3	I147 T148 Q149 F153 T154 V155	I147-K151 WeakPolarHBondContact O-CB 3.27Å; I147-K151 PolarHBondContact O-N 3Å; T148-K151 PolarHBondContact O-N 2.91Å; Q149-K151 VanDerWaalsContact C-N 3.35Å; K151-F153 VanDerWaalsContact C-N 3.34Å; K151-F153 PolarHBondContact O-N 3.4Å; K151-T154 PolarHBondContact O-N 3.28Å; K151-V155 HydrophobicContact CG-CG2 3.93Å; K151-V155 WeakPolarHBondContact O-CB 3.32Å; K151-V155 WeakPolarHBondContact O-CG2 2.82Å; K151-V155 PolarHBondContact O-N 3.13Å
152	D	80.2	Confident	78.2	Confident	82 Å²	82	96 Å²	96	44%	0.439	49%	0.494	S	S	.	.	H	α-helix	trans	-62.5	-42.8	-177	-69.5	-12.4	0	0	0	110.8	T148 Q149 T156	T148-D152 VanDerWaalsContact CG2-OD2 3.31Å; T148-D152 WeakPolarHBondContact CG2-OD2 3.4Å; T148-D152 VanDerWaalsContact O-CB 3.28Å; T148-D152 WeakPolarHBondContact O-CB 3.37Å; T148-D152 PolarHBondContact O-N 2.73Å; Q149-D152 PolarHBondContact O-N 2.69Å; D152-T156 WeakPolarHBondContact O-CB 3.14Å; D152-T156 PolarHBondContact O-N 2.63Å; D152-T156 PolarHBondContact O-OG1 3.06Å
153	F	80.3	Confident	77.7	Confident	152 Å²	152	97.4 Å²	97.4	67%	0.667	49%	0.493	S	S	*	.	H	α-helix	trans	-61.4	-47.4	174.2	-179.7	-98.5	0	0	0	112.5	Q149 I150 K151 T156 T157	Q149-F153 WeakPolarHBondContact O-CB 3.17Å; Q149-F153 PolarHBondContact O-N 3.16Å; I150-F153 PolarHBondContact O-N 3.24Å; K151-F153 VanDerWaalsContact C-N 3.34Å; K151-F153 PolarHBondContact O-N 3.4Å; F153-T156 PolarHBondContact O-N 2.69Å; F153-T157 WeakPolarHBondContact O-CB 3.36Å; F153-T157 PolarHBondContact O-N 3.23Å; F153-T157 PolarHBondContact O-OG1 3.31Å
154	T	77.2	Confident	77.1	Confident	69 Å²	69	104.4 Å²	104.4	42%	0.423	51%	0.51	S	S	.	.	H	α-helix	trans	-66.3	-46	-178.2	-51.7	0	0	0	0	111.2	I150 K151 T157 L158	I150-T154 WeakPolarHBondContact O-CB 3.47Å; I150-T154 PolarHBondContact O-N 2.63Å; I150-T154 PolarHBondContact O-OG1 3.37Å; K151-T154 PolarHBondContact O-N 3.28Å; T154-T157 PolarHBondContact O-N 3.06Å; T154-L158 HydrophobicContact CG2-CD1 4.46Å; T154-L158 WeakPolarHBondContact O-CG 3.31Å; T154-L158 PolarHBondContact O-N 2.9Å
155	V	74.4	Confident	76.4	Confident	42 Å²	42	105.7 Å²	105.7	26%	0.255	51%	0.509	S	S	.	.	H	α-helix	trans	-64.5	-43.2	178.5	167.5	0	0	0	0	110.7	K151 T157 L158 Y159	K151-V155 HydrophobicContact CG-CG2 3.93Å; K151-V155 WeakPolarHBondContact O-CB 3.32Å; K151-V155 WeakPolarHBondContact O-CG2 2.82Å; K151-V155 PolarHBondContact O-N 3.13Å; V155-T157 VanDerWaalsContact C-N 3.34Å; V155-T157 PolarHBondContact O-N 3.44Å; V155-L158 WeakPolarHBondContact O-CB 3.27Å; V155-L158 PolarHBondContact O-N 3.05Å; V155-Y159 HydrophobicContact CG1-CD2 3.61Å; V155-Y159 HydrophobicContact CG1-CE2 3.09Å; V155-Y159 VanDerWaalsContact O-CD2 3.29Å; V155-Y159 WeakPolarHBondContact O-CD2 3.46Å; V155-Y159 PolarHBondContact O-N 3.28Å
156	T	75.9	Confident	75.6	Confident	64 Å²	64	105.7 Å²	105.7	39%	0.393	50%	0.503	S	S	.	.	H	α-helix	trans	-59.9	-44.6	175	-61	0	0	0	0	111.3	D152 F153 L158 Y159 F160	D152-T156 WeakPolarHBondContact O-CB 3.14Å; D152-T156 PolarHBondContact O-N 2.63Å; D152-T156 PolarHBondContact O-OG1 3.06Å; F153-T156 PolarHBondContact O-N 2.69Å; T156-L158 VanDerWaalsContact C-N 3.33Å; T156-L158 PolarHBondContact O-N 3.04Å; T156-Y159 PolarHBondContact O-N 3.28Å; T156-F160 HydrophobicContact CG2-CD2 3.71Å; T156-F160 HydrophobicContact CG2-CE2 3.53Å; T156-F160 VanDerWaalsContact O-CD2 3.26Å; T156-F160 WeakPolarHBondContact O-CD2 3.29Å; T156-F160 PolarHBondContact O-N 3.49Å
157	T	77.4	Confident	75	Confident	53 Å²	53	102.8 Å²	102.8	33%	0.325	49%	0.49	S	S	.	.	H	α-helix	trans	-61.6	-40.9	176.1	-58.2	0	0	0	0	111.8	F153 T154 V155 F160 K161	F153-T157 WeakPolarHBondContact O-CB 3.36Å; F153-T157 PolarHBondContact O-N 3.23Å; F153-T157 PolarHBondContact O-OG1 3.31Å; T154-T157 PolarHBondContact O-N 3.06Å; V155-T157 VanDerWaalsContact C-N 3.34Å; V155-T157 PolarHBondContact O-N 3.44Å; T157-F160 PolarHBondContact O-N 2.98Å; T157-K161 PolarHBondContact O-N 3.02Å
158	L	74.5	Confident	74.5	Confident	101 Å²	101	99.6 Å²	99.6	53%	0.529	48%	0.481	S	S	.	.	H	α-helix	trans	-65.2	-42.7	175.1	-72.2	171.6	0	0	0	111.6	T154 V155 T156 F160 K161 A162	T154-L158 HydrophobicContact CG2-CD1 4.46Å; T154-L158 WeakPolarHBondContact O-CG 3.31Å; T154-L158 PolarHBondContact O-N 2.9Å; V155-L158 WeakPolarHBondContact O-CB 3.27Å; V155-L158 PolarHBondContact O-N 3.05Å; T156-L158 VanDerWaalsContact C-N 3.33Å; T156-L158 PolarHBondContact O-N 3.04Å; L158-F160 PolarHBondContact O-N 2.76Å; L158-K161 PolarHBondContact O-N 2.85Å; L158-A162 WeakPolarHBondContact O-CB 3.27Å; L158-A162 PolarHBondContact O-N 2.91Å
159	Y	70.8	Confident	73.6	Confident	165 Å²	165	99.8 Å²	99.8	65%	0.647	48%	0.478	S	S	*	.	H	α-helix	trans	-59.5	-45.8	174.9	-73.3	-44.8	0	0	0	111.6	V155 T156 K161 A162 W163	V155-Y159 HydrophobicContact CG1-CD2 3.61Å; V155-Y159 HydrophobicContact CG1-CE2 3.09Å; V155-Y159 VanDerWaalsContact O-CD2 3.29Å; V155-Y159 WeakPolarHBondContact O-CD2 3.46Å; V155-Y159 PolarHBondContact O-N 3.28Å; T156-Y159 PolarHBondContact O-N 3.28Å; Y159-K161 PolarHBondContact O-N 3.45Å; Y159-A162 PolarHBondContact O-N 3.43Å; Y159-W163 WeakPolarHBondContact O-CB 3.37Å; Y159-W163 PolarHBondContact O-N 3.39Å
160	F	72.1	Confident	72.7	Confident	117 Å²	117	95 Å²	95	51%	0.513	46%	0.46	S	S	.	.	H	α-helix	trans	-65	-39.9	177.8	-83	-66.3	0	0	0	113	T156 T157 L158 W163 R164	T156-F160 HydrophobicContact CG2-CD2 3.71Å; T156-F160 HydrophobicContact CG2-CE2 3.53Å; T156-F160 VanDerWaalsContact O-CD2 3.26Å; T156-F160 WeakPolarHBondContact O-CD2 3.29Å; T156-F160 PolarHBondContact O-N 3.49Å; T157-F160 PolarHBondContact O-N 2.98Å; L158-F160 PolarHBondContact O-N 2.76Å; F160-W163 HydrophobicContact CD1-CE3 4.48Å; F160-R164 WeakPolarHBondContact O-CB 3.28Å; F160-R164 WeakPolarHBondContact O-CG 3.15Å; F160-R164 PolarHBondContact O-N 3.29Å
161	K	76.1	Confident	72.1	Confident	125 Å²	125	97.6 Å²	97.6	54%	0.543	46%	0.463	S	S	.	.	H	α-helix	trans	-64.5	-43.9	174.9	-76.9	-177.5	-179.8	179.5	0	111.6	T157 L158 Y159 R165	T157-K161 PolarHBondContact O-N 3.02Å; L158-K161 PolarHBondContact O-N 2.85Å; Y159-K161 PolarHBondContact O-N 3.45Å; K161-R165 PolarHBondContact O-N 2.83Å; K161-R165 VanDerWaalsContact O-N 3.17Å
162	A	66.7	Low	71.8	Confident	53 Å²	53	97 Å²	97	44%	0.438	46%	0.461	S	S	.	.	H	α-helix	trans	-65.2	-43.7	176.8	0	0	0	0	0	111.6	L158 Y159 R165 N166	L158-A162 WeakPolarHBondContact O-CB 3.27Å; L158-A162 PolarHBondContact O-N 2.91Å; Y159-A162 PolarHBondContact O-N 3.43Å; A162-R165 PolarHBondContact O-N 3.22Å; A162-N166 WeakPolarHBondContact O-CB 3.22Å; A162-N166 PolarHBondContact O-N 2.91Å
163	W	73.5	Confident	71	Confident	153 Å²	153	94.2 Å²	94.2	58%	0.58	45%	0.446	S	S	*	.	H	α-helix	trans	-60.2	-48.2	176	177.6	80.4	0	0	0	111.6	Y159 F160 R165 N166 V167	Y159-W163 WeakPolarHBondContact O-CB 3.37Å; Y159-W163 PolarHBondContact O-N 3.39Å; F160-W163 HydrophobicContact CD1-CE3 4.48Å; W163-R165 VanDerWaalsContact C-N 3.33Å; W163-R165 PolarHBondContact O-N 3.14Å; W163-N166 PolarHBondContact O-N 3.37Å; W163-N166 VanDerWaalsContact O-N 3.15Å; W163-V167 HydrophobicContact CD2-CG2 3.93Å; W163-V167 HydrophobicContact CE3-CG2 4.48Å; W163-V167 HydrophobicContact CG-CG2 4.33Å; W163-V167 HydrophobicContact CH2-CG2 4.36Å; W163-V167 HydrophobicContact CZ2-CG2 3.78Å; W163-V167 VanDerWaalsContact O-CG2 3.32Å; W163-V167 WeakPolarHBondContact O-CG2 3.44Å; W163-V167 PolarHBondContact O-N 3.07Å
164	R	72.3	Confident	70.3	Confident	179 Å²	179	94.2 Å²	94.2	68%	0.675	44%	0.442	S	S	*	.	H	α-helix	trans	-58	-43.4	176.7	-78	-176.4	-173.1	176.4	2.9	112.5	F160 V167 A168	F160-R164 WeakPolarHBondContact O-CB 3.28Å; F160-R164 WeakPolarHBondContact O-CG 3.15Å; F160-R164 PolarHBondContact O-N 3.29Å; R164-V167 PolarHBondContact O-N 2.99Å; R164-A168 WeakPolarHBondContact O-CB 3.32Å; R164-A168 PolarHBondContact O-N 2.87Å
165	R	70.4	Confident	70	Confident	156 Å²	156	94.3 Å²	94.3	59%	0.589	44%	0.44	S	S	*	.	H	α-helix	trans	-62.2	-46.9	175.1	-74	-170.1	-168.3	110.7	-4.8	111.4	K161 A162 W163 V167 A168 E169	K161-R165 PolarHBondContact O-N 2.83Å; K161-R165 VanDerWaalsContact O-N 3.17Å; A162-R165 PolarHBondContact O-N 3.22Å; W163-R165 VanDerWaalsContact C-N 3.33Å; W163-R165 PolarHBondContact O-N 3.14Å; R165-V167 PolarHBondContact O-N 2.81Å; R165-A168 PolarHBondContact O-N 3.13Å; R165-E169 PolarHBondContact O-N 3.06Å
166	N	68.1	Low	69.8	Low	66 Å²	66	96.5 Å²	96.5	35%	0.353	45%	0.445	S	S	.	.	H	α-helix	trans	-63.7	-39.3	179.9	-167.5	-10.4	0	0	0	112	A162 W163 E169 A170 R753	A162-N166 WeakPolarHBondContact O-CB 3.22Å; A162-N166 PolarHBondContact O-N 2.91Å; W163-N166 PolarHBondContact O-N 3.37Å; W163-N166 VanDerWaalsContact O-N 3.15Å; N166-E169 PolarHBondContact O-N 3.3Å; N166-A170 VanDerWaalsContact O-CB 3.24Å; N166-A170 WeakPolarHBondContact O-CB 3.21Å; N166-A170 PolarHBondContact O-N 3.08Å; N166-R753 PolarHBondContact OD1-NH2 3.1Å
167	V	67	Low	69.3	Low	45 Å²	45	94.1 Å²	94.1	27%	0.273	43%	0.429	S	S	.	.	H	α-helix	trans	-62.8	-42.7	173.8	170.6	0	0	0	0	111.2	W163 R164 R165 A170 R171	W163-V167 HydrophobicContact CD2-CG2 3.93Å; W163-V167 HydrophobicContact CE3-CG2 4.48Å; W163-V167 HydrophobicContact CG-CG2 4.33Å; W163-V167 HydrophobicContact CH2-CG2 4.36Å; W163-V167 HydrophobicContact CZ2-CG2 3.78Å; W163-V167 VanDerWaalsContact O-CG2 3.32Å; W163-V167 WeakPolarHBondContact O-CG2 3.44Å; W163-V167 PolarHBondContact O-N 3.07Å; R164-V167 PolarHBondContact O-N 2.99Å; R165-V167 PolarHBondContact O-N 2.81Å; V167-A170 PolarHBondContact O-N 3.12Å; V167-R171 WeakPolarHBondContact O-CG 3.39Å; V167-R171 PolarHBondContact O-N 3.22Å
168	A	70	Confident	68.8	Low	50 Å²	50	94 Å²	94	41%	0.413	43%	0.43	S	S	.	.	H	α-helix	trans	-64.9	-41.8	176.8	0	0	0	0	0	112	R164 R165 R171 K172	R164-A168 WeakPolarHBondContact O-CB 3.32Å; R164-A168 PolarHBondContact O-N 2.87Å; R165-A168 PolarHBondContact O-N 3.13Å; A168-R171 PolarHBondContact O-N 2.92Å; A168-K172 PolarHBondContact O-N 2.68Å
169	E	62.7	Low	68.6	Low	62 Å²	62	95 Å²	95	29%	0.29	43%	0.43	S	S	.	.	H	α-helix	trans	-65.1	-44.5	174.4	-74.7	-178.8	174.2	0	0	111.7	R165 N166 R171 K172 T173	R165-E169 PolarHBondContact O-N 3.06Å; N166-E169 PolarHBondContact O-N 3.3Å; E169-R171 VanDerWaalsContact C-N 3.28Å; E169-R171 PolarHBondContact O-N 2.73Å; E169-K172 PolarHBondContact O-N 3.02Å; E169-K172 VanDerWaalsContact O-N 3.12Å; E169-T173 PolarHBondContact O-N 3.06Å; E169-T173 PolarHBondContact O-OG1 3Å; E169-T173 VanDerWaalsContact O-OG1 3.05Å
170	A	61.9	Low	68	Low	27 Å²	27	90.1 Å²	90.1	22%	0.223	41%	0.414	C	S	.	.	H	α-helix	trans	-58.7	-38.7	177.2	0	0	0	0	0	112.3	N166 V167 R174	N166-A170 VanDerWaalsContact O-CB 3.24Å; N166-A170 WeakPolarHBondContact O-CB 3.21Å; N166-A170 PolarHBondContact O-N 3.08Å; V167-A170 PolarHBondContact O-N 3.12Å; A170-R174 WeakPolarHBondContact O-CB 3.4Å; A170-R174 PolarHBondContact O-N 3.48Å
171	R	66.9	Low	67.2	Low	160 Å²	160	89.4 Å²	89.4	60%	0.604	41%	0.412	S	S	*	.	H	α-helix	trans	-62.4	-50.6	172.9	-76.2	-178	-177.5	-179	-0.1	111.6	V167 A168 E169 T173 R174 D175	V167-R171 WeakPolarHBondContact O-CG 3.39Å; V167-R171 PolarHBondContact O-N 3.22Å; A168-R171 PolarHBondContact O-N 2.92Å; E169-R171 VanDerWaalsContact C-N 3.28Å; E169-R171 PolarHBondContact O-N 2.73Å; R171-T173 VanDerWaalsContact C-N 3.31Å; R171-T173 PolarHBondContact O-N 2.9Å; R171-R174 WeakPolarHBondContact O-CB 3.44Å; R171-R174 PolarHBondContact O-N 3.39Å; R171-D175 PolarHBondContact O-N 3.19Å
172	K	70.4	Confident	66.1	Low	117 Å²	117	90.2 Å²	90.2	51%	0.509	42%	0.418	S	S	.	.	H	α-helix	trans	-58	-43.6	178.2	-70.9	-179.7	178.9	-174.4	0	112.3	A168 E169 D175 Y176 L201	A168-K172 PolarHBondContact O-N 2.68Å; E169-K172 PolarHBondContact O-N 3.02Å; E169-K172 VanDerWaalsContact O-N 3.12Å; K172-D175 PolarHBondContact O-N 3.32Å; K172-Y176 WeakPolarHBondContact O-CB 3.46Å; K172-Y176 PolarHBondContact O-N 3.14Å; K172-L201 HydrophobicContact CB-CD2 4.45Å; K172-L201 HydrophobicContact CD-CD2 4.17Å
173	T	63.5	Low	65.2	Low	22 Å²	22	94.6 Å²	94.6	14%	0.135	42%	0.423	C	S	.	.	H	α-helix	trans	-61.9	-46.5	177.6	-57.6	0	0	0	0	110.7	E169 R171 D175 Y176 F177 V777	E169-T173 PolarHBondContact O-N 3.06Å; E169-T173 PolarHBondContact O-OG1 3Å; E169-T173 VanDerWaalsContact O-OG1 3.05Å; R171-T173 VanDerWaalsContact C-N 3.31Å; R171-T173 PolarHBondContact O-N 2.9Å; T173-D175 PolarHBondContact O-N 2.77Å; T173-Y176 PolarHBondContact O-N 3.21Å; T173-F177 HydrophobicContact CG2-CD2 3.73Å; T173-F177 HydrophobicContact CG2-CE2 3.52Å; T173-F177 WeakPolarHBondContact O-CD2 3.5Å; T173-F177 PolarHBondContact O-N 3.11Å; T173-F177 VanDerWaalsContact O-N 3.13Å; T173-V777 HydrophobicContact CG2-CG2 4.25Å
174	R	64.2	Low	63.8	Low	152 Å²	152	91.6 Å²	91.6	57%	0.574	43%	0.425	S	S	*	.	H	α-helix	trans	-57.6	-49	175.4	-174.2	-171.8	66.5	169.7	4.1	111.7	A170 R171 Y176 F177 S178	A170-R174 WeakPolarHBondContact O-CB 3.4Å; A170-R174 PolarHBondContact O-N 3.48Å; R171-R174 WeakPolarHBondContact O-CB 3.44Å; R171-R174 PolarHBondContact O-N 3.39Å; R174-Y176 VanDerWaalsContact C-N 3.31Å; R174-Y176 PolarHBondContact O-N 3.28Å; R174-F177 PolarHBondContact O-N 3.33Å; R174-S178 PolarHBondContact O-N 3.33Å; R174-S178 PolarHBondContact O-OG 3.47Å
175	D	70.8	Confident	62.7	Low	72 Å²	72	90.3 Å²	90.3	39%	0.385	43%	0.432	S	S	.	.	H	α-helix	trans	-65.1	-35.4	-176.9	-58.8	-15.7	0	0	0	111.9	R171 K172 T173 K179	R171-D175 PolarHBondContact O-N 3.19Å; K172-D175 PolarHBondContact O-N 3.32Å; T173-D175 PolarHBondContact O-N 2.77Å; D175-K179 WeakPolarHBondContact O-CG 3.42Å; D175-K179 PolarHBondContact O-N 3.35Å; D175-K179 VanDerWaalsContact O-N 3.1Å
176	Y	71.2	Confident	61.1	Low	88 Å²	88	84.7 Å²	84.7	35%	0.345	42%	0.423	S	S	.	.	H	α-helix	trans	-61.5	-47.6	172.4	170.1	-99.3	0	0	0	112.1	K172 T173 R174 K179 M180 L198 Q772	K172-Y176 WeakPolarHBondContact O-CB 3.46Å; K172-Y176 PolarHBondContact O-N 3.14Å; T173-Y176 PolarHBondContact O-N 3.21Å; R174-Y176 VanDerWaalsContact C-N 3.31Å; R174-Y176 PolarHBondContact O-N 3.28Å; Y176-K179 PolarHBondContact O-N 2.68Å; Y176-M180 PolarHBondContact O-N 3.12Å; Y176-M180 VanDerWaalsContact O-N 3.1Å; Y176-L198 HydrophobicContact CD2-CD1 4.34Å; Y176-L198 HydrophobicContact CE2-CD1 3.72Å; Y176-Q772 PolarHBondContact OH-NE2 2.97Å
177	F	65.7	Low	59.7	Low	13 Å²	13	90.7 Å²	90.7	6%	0.057	45%	0.449	C	S	.	.	H	α-helix	trans	-72.7	-31.6	-179.5	-74.4	-68.9	0	0	0	113	T173 R174 M180 Q181 F750 Y773	T173-F177 HydrophobicContact CG2-CD2 3.73Å; T173-F177 HydrophobicContact CG2-CE2 3.52Å; T173-F177 WeakPolarHBondContact O-CD2 3.5Å; T173-F177 PolarHBondContact O-N 3.11Å; T173-F177 VanDerWaalsContact O-N 3.13Å; R174-F177 PolarHBondContact O-N 3.33Å; F177-M180 HydrophobicContact CD1-SD 4.49Å; F177-M180 PolarHBondContact O-N 2.8Å; F177-Q181 PolarHBondContact O-N 2.65Å; F177-F750 HydrophobicContact CB-CZ 4.4Å; F177-F750 HydrophobicContact CD1-CZ 4.43Å; F177-F750 AromaticContact CD2-CE1 3.94Å; F177-F750 HydrophobicContact CD2-CE1 3.94Å; F177-F750 HydrophobicContact CD2-CE2 4.28Å; F177-F750 AromaticContact CD2-CZ 3.29Å; F177-F750 HydrophobicContact CD2-CZ 3.29Å; F177-F750 HydrophobicContact CE2-CE1 4.29Å; F177-F750 HydrophobicContact CE2-CE2 4.08Å; F177-F750 AromaticContact CE2-CZ 3.46Å; F177-F750 HydrophobicContact CE2-CZ 3.46Å; F177-F750 VanDerWaalsContact CE2-CZ 3.46Å; F177-F750 AromaticContact CG-CZ 3.81Å; F177-F750 HydrophobicContact CG-CZ 3.81Å; F177-F750 HydrophobicContact CZ-CE2 4.38Å; F177-F750 HydrophobicContact CZ-CZ 4.13Å; F177-Y773 HydrophobicContact CD1-CD1 4.27Å; F177-Y773 AromaticContact CD1-CE1 3.94Å; F177-Y773 HydrophobicContact CD1-CE1 3.94Å; F177-Y773 AromaticContact CE1-CD1 3.59Å; F177-Y773 HydrophobicContact CE1-CD1 3.59Å; F177-Y773 AromaticContact CE1-CE1 3.64Å; F177-Y773 HydrophobicContact CE1-CE1 3.64Å; F177-Y773 AromaticContact CZ-CD1 3.97Å; F177-Y773 HydrophobicContact CZ-CD1 3.97Å; F177-Y773 HydrophobicContact CZ-CE1 4.45Å
178	S	66.5	Low	58.2	Low	52 Å²	52	98.9 Å²	98.9	36%	0.364	48%	0.481	S	S	.	.	H	α-helix	trans	-60.5	-49.6	170.2	-69.8	0	0	0	0	111.4	R174 M180 Q181 E182	R174-S178 PolarHBondContact O-N 3.33Å; R174-S178 PolarHBondContact O-OG 3.47Å; S178-M180 PolarHBondContact O-N 3.31Å; S178-Q181 PolarHBondContact O-N 3.27Å; S178-E182 PolarHBondContact O-N 3.4Å; S178-E182 VanDerWaalsContact O-N 3.12Å
179	K	68.9	Low	56.8	Low	122 Å²	122	101.1 Å²	101.1	53%	0.53	49%	0.494	S	S	.	.	H	α-helix	trans	-60.5	-28.1	175.3	-73	177.8	-179.3	-175.1	0	113.3	D175 Y176 R183	D175-K179 WeakPolarHBondContact O-CG 3.42Å; D175-K179 PolarHBondContact O-N 3.35Å; D175-K179 VanDerWaalsContact O-N 3.1Å; Y176-K179 PolarHBondContact O-N 2.68Å; K179-R183 WeakPolarHBondContact O-CG 3.37Å; K179-R183 PolarHBondContact O-N 3.4Å
180	M	58.3	Low	55.7	Low	61 Å²	61	105.6 Å²	105.6	30%	0.3	52%	0.52	S	S	.	.	H	α-helix	trans	-76.7	-39.7	177.6	-164.7	179.8	-179.4	0	0	112.1	Y176 F177 S178 E182 R183 S184 M769	Y176-M180 PolarHBondContact O-N 3.12Å; Y176-M180 VanDerWaalsContact O-N 3.1Å; F177-M180 HydrophobicContact CD1-SD 4.49Å; F177-M180 PolarHBondContact O-N 2.8Å; S178-M180 PolarHBondContact O-N 3.31Å; M180-E182 VanDerWaalsContact C-N 3.31Å; M180-R183 PolarHBondContact O-N 2.95Å; M180-R183 VanDerWaalsContact O-N 3.1Å; M180-S184 PolarHBondContact O-N 3.23Å; M180-S184 VanDerWaalsContact O-N 3.14Å; M180-M769 HydrophobicContact CE-CE 3.81Å; M180-M769 HydrophobicContact CE-SD 4.17Å
181	Q	56	Low	54.6	Low	103 Å²	103	110.7 Å²	110.7	48%	0.481	54%	0.543	S	S	.	.	H	α-helix	trans	-62.6	-39.4	173.3	-79.5	-178.1	-74.6	0	0	111.4	F177 S178 R183 S184	F177-Q181 PolarHBondContact O-N 2.65Å; S178-Q181 PolarHBondContact O-N 3.27Å; Q181-R183 PolarHBondContact O-N 3.21Å; Q181-S184 PolarHBondContact O-N 2.82Å; Q181-S184 PolarHBondContact O-OG 3.39Å
182	E	54.2	Low	53.5	Low	141 Å²	141	108.4 Å²	108.4	66%	0.659	55%	0.551	S	S	*	*	H	α-helix	trans	-61.6	-28.7	173.4	-69.8	169.8	-177.6	0	0	112.6	S178 M180	S178-E182 PolarHBondContact O-N 3.4Å; S178-E182 VanDerWaalsContact O-N 3.12Å; M180-E182 VanDerWaalsContact C-N 3.31Å
183	R	46.5	Very low	52.2	Low	145 Å²	145	110.3 Å²	110.3	55%	0.547	56%	0.562	S	S	.	*	H	α-helix	trans	-85.4	-15.7	177.3	-73.5	176.8	-176.2	-175.9	1.1	114.5	K179 M180 Q181 S194	K179-R183 WeakPolarHBondContact O-CG 3.37Å; K179-R183 PolarHBondContact O-N 3.4Å; M180-R183 PolarHBondContact O-N 2.95Å; M180-R183 VanDerWaalsContact O-N 3.1Å; Q181-R183 PolarHBondContact O-N 3.21Å; R183-S194 PolarHBondContact NH1-OG 2.8Å; R183-S194 PolarHBondContact NH2-OG 3.29Å
184	S	45	Very low	51.2	Low	90 Å²	90	111.4 Å²	111.4	63%	0.629	57%	0.571	S	S	*	*	H	α-helix	trans	-82.1	-21.6	174.5	53.8	0	0	0	0	113	M180 Q181	M180-S184 PolarHBondContact O-N 3.23Å; M180-S184 VanDerWaalsContact O-N 3.14Å; Q181-S184 PolarHBondContact O-N 2.82Å; Q181-S184 PolarHBondContact O-OG 3.39Å
185	D	47.6	Very low	49.8	Very low	152 Å²	152	110.2 Å²	110.2	81%	0.813	57%	0.572	S	S	*	*	S	Bend	trans	-90	-6.6	174.7	-63.9	-21.5	0	0	0	112.4
186	G	38.1	Very low	48.2	Very low	39 Å²	39	110.1 Å²	110.1	40%	0.402	58%	0.577	S	S	.	*	S	Bend	trans	-114.1	133.7	176.9	0	0	0	0	0	111.8
187	E	38	Very low	46.6	Very low	192 Å²	192	113 Å²	113	90%	0.897	59%	0.594	S	S	*	*			trans	-50.2	149.3	177.6	-70	179.6	139.8	0	0	113.7	S189	E187-S189 PolarHBondContact O-N 2.85Å
188	K	36.4	Very low	45.3	Very low	217 Å²	217	115.4 Å²	115.4	94%	0.943	61%	0.607	S	S	*	*			trans	-40.6	101.9	178.6	-66.5	171.5	178.6	171.5	0	112.7
189	S	40.3	Very low	43.8	Very low	97 Å²	97	120 Å²	120	68%	0.678	63%	0.626	S	S	*	*			trans	-106.8	113.5	157.7	64.4	0	0	0	0	109	E187 D191	E187-S189 PolarHBondContact O-N 2.85Å; S189-D191 PolarHBondContact O-N 2.9Å
190	D	39.7	Very low	42.3	Very low	156 Å²	156	117.9 Å²	117.9	83%	0.834	62%	0.624	S	S	*	*			trans	-44.5	125.3	157.3	-87.9	-37	0	0	0	108.7
191	D	39.3	Very low	41.4	Very low	133 Å²	133	117.9 Å²	117.9	71%	0.711	62%	0.624	S	S	*	*			trans	-167.6	114.6	149.4	-92.9	-29.8	0	0	0	111.7	S189 E193	S189-D191 PolarHBondContact O-N 2.9Å; D191-E193 PolarHBondContact O-N 2.63Å
192	S	43.2	Very low	40.5	Very low	112 Å²	112	114.8 Å²	114.8	78%	0.783	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	8.7	-175.7	50.3	0	0	0	0	114.1
193	E	43.3	Very low	39.5	Very low	158 Å²	158	110.8 Å²	110.8	74%	0.738	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-11.6	-176.4	-71.6	-161.6	147	0	0	115.1	D191 S196	D191-E193 PolarHBondContact O-N 2.63Å; E193-S196 PolarHBondContact O-OG 3.45Å
194	S	41.9	Very low	38.8	Very low	45 Å²	45	112.9 Å²	112.9	32%	0.315	63%	0.63	S	S	.	*	S	Bend	trans	-83.9	-15.5	178.4	-56.8	0	0	0	0	114	R183 S196	R183-S194 PolarHBondContact NH1-OG 2.8Å; R183-S194 PolarHBondContact NH2-OG 3.29Å; S194-S196 VanDerWaalsContact C-N 3.35Å
195	E	34.3	Very low	38.4	Very low	126 Å²	126	115.4 Å²	115.4	59%	0.589	64%	0.635	S	S	*	*	S	Bend	trans	-75.2	-22	-178.1	-89.2	-151.2	112.1	0	0	113.8	K802	E195-K802 IonicContact OE1-NZ 2.7Å; E195-K802 PolarHBondContact OE1-NZ 2.94Å
196	S	38.7	Very low	37.9	Very low	71 Å²	71	110.5 Å²	110.5	50%	0.497	61%	0.613	S	S	.	*	G	3₁₀ helix	trans	-78.4	-23.8	-177.7	54.8	0	0	0	0	113.1	E193 S194 L198 L199	E193-S196 PolarHBondContact O-OG 3.45Å; S194-S196 VanDerWaalsContact C-N 3.35Å; S196-L198 VanDerWaalsContact C-N 3.27Å; S196-L198 PolarHBondContact O-N 3.41Å; S196-L199 WeakPolarHBondContact O-CB 3.47Å; S196-L199 PolarHBondContact O-N 3.37Å
197	Q	36	Very low	38.3	Very low	149 Å²	149	118 Å²	118	70%	0.696	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-72.2	-18.7	178.9	-69.4	-171.8	-1.4	0	0	113.7	L199 T200	Q197-L199 PolarHBondContact O-N 3.14Å; Q197-T200 PolarHBondContact O-OG1 2.99Å
198	L	38.7	Very low	38.4	Very low	63 Å²	63	114.5 Å²	114.5	33%	0.33	63%	0.629	S	S	.	*	G	3₁₀ helix	trans	-69.6	-15.1	172.8	-108	143.4	0	0	0	113	Y176 S196 T200 L201	Y176-L198 HydrophobicContact CD2-CD1 4.34Å; Y176-L198 HydrophobicContact CE2-CD1 3.72Å; S196-L198 VanDerWaalsContact C-N 3.27Å; S196-L198 PolarHBondContact O-N 3.41Å; L198-T200 PolarHBondContact O-N 3.09Å; L198-L201 HydrophobicContact CD2-CD1 3.67Å; L198-L201 HydrophobicContact CG-CD1 4.18Å
199	L	35.1	Very low	38.6	Very low	148 Å²	148	109.3 Å²	109.3	78%	0.775	61%	0.608	S	S	*	*	G	3₁₀ helix	trans	-77	7	-176.8	-74.8	165.6	0	0	0	115.2	S196 Q197	S196-L199 WeakPolarHBondContact O-CB 3.47Å; S196-L199 PolarHBondContact O-N 3.37Å; Q197-L199 PolarHBondContact O-N 3.14Å
200	T	38.3	Very low	38.7	Very low	78 Å²	78	110.5 Å²	110.5	48%	0.479	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-119.1	13.4	177.9	56.6	0	0	0	0	114.6	Q197 L198	Q197-T200 PolarHBondContact O-OG1 2.99Å; L198-T200 PolarHBondContact O-N 3.09Å
201	L	39	Very low	39.1	Very low	60 Å²	60	114.6 Å²	114.6	31%	0.314	61%	0.613	S	S	.	*	S	Bend	trans	-85.6	-3.9	-179.6	-80.6	158.2	0	0	0	115.1	K172 L198	K172-L201 HydrophobicContact CB-CD2 4.45Å; K172-L201 HydrophobicContact CD-CD2 4.17Å; L198-L201 HydrophobicContact CD2-CD1 3.67Å; L198-L201 HydrophobicContact CG-CD1 4.18Å
202	G	36.6	Very low	39.8	Very low	39 Å²	39	117.1 Å²	117.1	40%	0.402	61%	0.612	S	S	.	*	S	Bend	trans	-100.7	110.3	152.5	0	0	0	0	0	105	K204	G202-K204 PolarHBondContact O-N 3.48Å; G202-K204 VanDerWaalsContact O-N 3.1Å
203	G	32.9	Very low	41	Very low	57 Å²	57	114 Å²	114	59%	0.588	59%	0.587	S	S	*	*			trans	-39.7	124.6	-178.5	0	0	0	0	0	110	I205	G203-I205 VanDerWaalsContact C-N 3.27Å; G203-I205 PolarHBondContact O-N 2.94Å
204	K	32.2	Very low	42.4	Very low	188 Å²	188	113.7 Å²	113.7	82%	0.817	58%	0.578	S	S	*	*			trans	-49.1	106.7	163.5	-86.5	-175.1	174.7	-176	0	104.5	G202 S206	G202-K204 PolarHBondContact O-N 3.48Å; G202-K204 VanDerWaalsContact O-N 3.1Å; K204-S206 PolarHBondContact O-N 3.27Å
205	I	36.7	Very low	44.1	Very low	144 Å²	144	112.9 Å²	112.9	74%	0.738	57%	0.57	S	S	*	*			trans	-58.8	104.1	160.3	-60.4	169.7	0	0	0	101.2	G203 E207	G203-I205 VanDerWaalsContact C-N 3.27Å; G203-I205 PolarHBondContact O-N 2.94Å; I205-E207 PolarHBondContact O-N 2.78Å
206	S	36.8	Very low	46.2	Very low	48 Å²	48	109.6 Å²	109.6	34%	0.336	56%	0.561	S	S	.	*			trans	-51.9	131.6	-179.7	49.7	0	0	0	0	107.1	K204 T208 E209	K204-S206 PolarHBondContact O-N 3.27Å; S206-T208 PolarHBondContact O-N 3.13Å; S206-E209 PolarHBondContact O-N 3.01Å; S206-E209 PolarHBondContact OG-N 3.49Å
207	E	47	Very low	48.3	Very low	196 Å²	196	112.5 Å²	112.5	92%	0.916	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.8	-15.3	176.1	-70.8	174.5	163	0	0	112.3	I205	I205-E207 PolarHBondContact O-N 2.78Å
208	T	40.3	Very low	50.6	Low	119 Å²	119	108.6 Å²	108.6	73%	0.73	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-2.4	177.5	53.8	0	0	0	0	115.5	S206 N210	S206-T208 PolarHBondContact O-N 3.13Å; T208-N210 PolarHBondContact O-N 3.48Å
209	E	40.4	Very low	53	Low	108 Å²	108	109.5 Å²	109.5	51%	0.505	56%	0.561	S	S	.	*	S	Bend	trans	-76.4	76.5	158.2	-88.7	-166.4	-161.8	0	0	106.1	S206 Y211 R214	S206-E209 PolarHBondContact O-N 3.01Å; S206-E209 PolarHBondContact OG-N 3.49Å; E209-Y211 PolarHBondContact O-N 3.03Å; E209-R214 IonicContact OE2-NH2 2.74Å
210	N	42.2	Very low	55.5	Low	122 Å²	122	106.7 Å²	106.7	65%	0.652	55%	0.546	S	S	*	.			trans	-29.5	124.4	165.7	-86.6	-25.8	0	0	0	108.4	T208 R212	T208-N210 PolarHBondContact O-N 3.48Å; N210-R212 PolarHBondContact O-N 2.97Å
211	Y	48.4	Very low	57.8	Low	243 Å²	243	107.9 Å²	107.9	95%	0.953	55%	0.553	S	S	*	*			trans	-52.9	71.1	175.7	-73.4	-98	0	0	0	110.8	E209 D213	E209-Y211 PolarHBondContact O-N 3.03Å; Y211-D213 PolarHBondContact O-N 3.35Å
212	R	54.1	Low	60.1	Low	186 Å²	186	108.6 Å²	108.6	70%	0.702	56%	0.557	S	S	*	*			trans	-77.1	115.7	176.3	-77.3	-170.6	-179.2	-173.5	1.7	104.9	N210 R214	N210-R212 PolarHBondContact O-N 2.97Å; R212-R214 PolarHBondContact O-N 2.81Å
213	D	67.1	Low	62.7	Low	46 Å²	46	106.8 Å²	106.8	25%	0.246	54%	0.538	C	S	.	.			trans	-64.9	78.7	171.6	-174.1	7.5	0	0	0	109.2	Y211 L215 S216 Y244 W245	Y211-D213 PolarHBondContact O-N 3.35Å; D213-L215 PolarHBondContact O-N 2.82Å; D213-L215 WeakPolarHBondContact OD1-CB 3.5Å; D213-L215 PolarHBondContact OD1-N 3.36Å; D213-S216 WeakPolarHBondContact O-CB 3.19Å; D213-S216 PolarHBondContact O-N 2.9Å; D213-S216 PolarHBondContact O-OG 3.46Å; D213-Y244 WeakPolarHBondContact OD2-CD1 3.42Å; D213-W245 PolarHBondContact OD1-NE1 3.49Å; D213-W245 PolarHBondContact OD2-NE1 2.92Å
214	R	73.7	Confident	65.3	Low	151 Å²	151	107.7 Å²	107.7	57%	0.57	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-16.1	178.6	-63.2	-170.5	-172.3	178.2	6.1	112.1	E209 R212 S216 E217	E209-R214 IonicContact OE2-NH2 2.74Å; R212-R214 PolarHBondContact O-N 2.81Å; R214-S216 VanDerWaalsContact C-N 3.31Å; R214-E217 PolarHBondContact O-N 3.31Å
215	L	77	Confident	67.9	Low	28 Å²	28	104.8 Å²	104.8	15%	0.147	51%	0.512	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-39	172.9	-165.3	97.2	0	0	0	110.6	D213 E217 L218 Q223 I226 F227 W245 I248	D213-L215 PolarHBondContact O-N 2.82Å; D213-L215 WeakPolarHBondContact OD1-CB 3.5Å; D213-L215 PolarHBondContact OD1-N 3.36Å; L215-E217 PolarHBondContact O-N 2.97Å; L215-L218 HydrophobicContact CD1-CD1 4.44Å; L215-L218 WeakPolarHBondContact O-CB 3.13Å; L215-L218 PolarHBondContact O-N 2.99Å; L215-L218 VanDerWaalsContact O-N 3.07Å; L215-Q223 HydrophobicContact CG-CG 4.39Å; L215-Q223 WeakPolarHBondContact O-CG 3.4Å; L215-Q223 PolarHBondContact O-NE2 3.04Å; L215-I226 HydrophobicContact CD1-CD1 4.24Å; L215-I226 HydrophobicContact CD1-CG2 4.48Å; L215-F227 HydrophobicContact CD1-CE2 4.04Å; L215-F227 HydrophobicContact CD2-CD2 4.33Å; L215-F227 HydrophobicContact CD2-CE2 3.32Å; L215-F227 HydrophobicContact CD2-CZ 3.73Å; L215-F227 HydrophobicContact CG-CE2 4.29Å; L215-W245 HydrophobicContact CD2-CZ2 4.21Å; L215-I248 HydrophobicContact CD2-CD1 3.56Å
216	S	79.9	Confident	70.3	Confident	57 Å²	57	101.2 Å²	101.2	40%	0.399	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-19.1	177.2	71.1	0	0	0	0	113.8	D213 R214 L218 Y244	D213-S216 WeakPolarHBondContact O-CB 3.19Å; D213-S216 PolarHBondContact O-N 2.9Å; D213-S216 PolarHBondContact O-OG 3.46Å; R214-S216 VanDerWaalsContact C-N 3.31Å; S216-L218 VanDerWaalsContact C-N 3.34Å; S216-Y244 VanDerWaalsContact CB-CE1 3.49Å
217	E	82.4	Confident	72.9	Confident	133 Å²	133	99 Å²	99	62%	0.621	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-16.4	174.9	-59.7	175.8	-179.3	0	0	112.7	R214 L215	R214-E217 PolarHBondContact O-N 3.31Å; L215-E217 PolarHBondContact O-N 2.97Å
218	L	84.7	Confident	74.8	Confident	67 Å²	67	90.8 Å²	90.8	35%	0.351	45%	0.445	S	S	.	.	S	Bend	trans	-78.8	150.6	179.1	-62.2	172.7	0	0	0	110.6	L215 S216 I222 Q223 I226	L215-L218 HydrophobicContact CD1-CD1 4.44Å; L215-L218 WeakPolarHBondContact O-CB 3.13Å; L215-L218 PolarHBondContact O-N 2.99Å; L215-L218 VanDerWaalsContact O-N 3.07Å; S216-L218 VanDerWaalsContact C-N 3.34Å; L218-I222 HydrophobicContact CB-CB 4.43Å; L218-I222 HydrophobicContact CB-CG2 4.42Å; L218-I222 HydrophobicContact CD1-CG2 4.17Å; L218-Q223 HydrophobicContact CB-CG 3.93Å; L218-Q223 PolarHBondContact O-NE2 3.29Å; L218-I226 HydrophobicContact CD1-CD1 3.71Å
219	P	88.9	Confident	76.9	Confident	82 Å²	82	93.6 Å²	93.6	53%	0.532	44%	0.443	S	S	.	.			trans	-59.5	143.5	170	-22.8	33.1	0	0	0	111.7	T221 I222 Q223	P219-T221 PolarHBondContact O-N 2.63Å; P219-T221 VanDerWaalsContact O-N 3.08Å; P219-I222 HydrophobicContact CB-CG1 4.42Å; P219-I222 HydrophobicContact CG-CG1 4.46Å; P219-I222 WeakPolarHBondContact O-CA 3.28Å; P219-I222 WeakPolarHBondContact O-CB 3.49Å; P219-I222 PolarHBondContact O-N 3.36Å; P219-Q223 PolarHBondContact O-N 3.02Å; P219-Q223 VanDerWaalsContact O-N 3.1Å
220	D	86.6	Confident	79	Confident	88 Å²	88	91.5 Å²	91.5	47%	0.471	44%	0.435	S	S	.	.	H	α-helix	trans	-48.4	-42	-179.7	-65.1	-10.7	0	0	0	113.1	I222 Q223 Y224	D220-I222 PolarHBondContact O-N 2.88Å; D220-Q223 PolarHBondContact O-N 3Å; D220-Q223 VanDerWaalsContact O-N 3.12Å; D220-Y224 HydrophobicContact CB-CD2 4.3Å; D220-Y224 HydrophobicContact CB-CE2 3.69Å; D220-Y224 WeakPolarHBondContact O-CB 3.41Å; D220-Y224 WeakPolarHBondContact O-CD2 3.48Å; D220-Y224 PolarHBondContact O-N 2.86Å
221	T	87.7	Confident	81	Confident	103 Å²	103	88.2 Å²	88.2	63%	0.632	42%	0.42	S	S	*	.	H	α-helix	trans	-57.4	-35.6	177.5	54.8	0	0	0	0	113.2	P219 K225	P219-T221 PolarHBondContact O-N 2.63Å; P219-T221 VanDerWaalsContact O-N 3.08Å; T221-K225 VanDerWaalsContact O-CB 3.3Å; T221-K225 WeakPolarHBondContact O-CB 3.47Å; T221-K225 PolarHBondContact O-N 3.31Å; T221-K225 VanDerWaalsContact O-N 3.14Å
222	I	87.2	Confident	82.7	Confident	76 Å²	76	77.8 Å²	77.8	39%	0.39	38%	0.382	S	S	.	.	H	α-helix	trans	-77.4	-43.2	176.6	-57.9	-56.8	0	0	0	110.1	L218 P219 D220 Y224 K225 I226	L218-I222 HydrophobicContact CB-CB 4.43Å; L218-I222 HydrophobicContact CB-CG2 4.42Å; L218-I222 HydrophobicContact CD1-CG2 4.17Å; P219-I222 HydrophobicContact CB-CG1 4.42Å; P219-I222 HydrophobicContact CG-CG1 4.46Å; P219-I222 WeakPolarHBondContact O-CA 3.28Å; P219-I222 WeakPolarHBondContact O-CB 3.49Å; P219-I222 PolarHBondContact O-N 3.36Å; D220-I222 PolarHBondContact O-N 2.88Å; I222-Y224 PolarHBondContact O-N 3.15Å; I222-K225 PolarHBondContact O-N 3.03Å; I222-K225 VanDerWaalsContact O-N 3.16Å; I222-I226 HydrophobicContact CG2-CD1 3.88Å; I222-I226 HydrophobicContact CG2-CG1 4.38Å; I222-I226 VanDerWaalsContact O-CG1 3.28Å; I222-I226 WeakPolarHBondContact O-CG1 3.25Å; I222-I226 PolarHBondContact O-N 2.84Å
223	Q	89.4	Confident	84.1	Confident	1 Å²	1	70.1 Å²	70.1	1%	0.005	36%	0.355	C	S	.	.	H	α-helix	trans	-58.3	-48	176.7	-58.6	179.1	17.3	0	0	111.2	L215 L218 P219 D220 K225 I226 F227 Y244 I248	L215-Q223 HydrophobicContact CG-CG 4.39Å; L215-Q223 WeakPolarHBondContact O-CG 3.4Å; L215-Q223 PolarHBondContact O-NE2 3.04Å; L218-Q223 HydrophobicContact CB-CG 3.93Å; L218-Q223 PolarHBondContact O-NE2 3.29Å; P219-Q223 PolarHBondContact O-N 3.02Å; P219-Q223 VanDerWaalsContact O-N 3.1Å; D220-Q223 PolarHBondContact O-N 3Å; D220-Q223 VanDerWaalsContact O-N 3.12Å; Q223-K225 VanDerWaalsContact C-N 3.3Å; Q223-K225 PolarHBondContact O-N 2.9Å; Q223-I226 WeakPolarHBondContact O-CB 3.15Å; Q223-I226 PolarHBondContact O-N 3.49Å; Q223-F227 WeakPolarHBondContact O-CD2 3.5Å; Q223-F227 PolarHBondContact O-N 3.2Å; Q223-Y244 VanDerWaalsContact CD-OH 3.24Å; Q223-Y244 PolarHBondContact NE2-OH 3.4Å; Q223-Y244 PolarHBondContact OE1-OH 2.76Å; Q223-I248 HydrophobicContact CB-CD1 4.45Å; Q223-I248 VanDerWaalsContact OE1-CD1 3.26Å
224	Y	89.6	Confident	85.1	Confident	76 Å²	76	70.6 Å²	70.6	30%	0.298	36%	0.357	S	S	.	.	H	α-helix	trans	-63.1	-36.1	176.1	-60.2	-24.5	0	0	0	112.4	D220 I222 G228 I248 E251 M252	D220-Y224 HydrophobicContact CB-CD2 4.3Å; D220-Y224 HydrophobicContact CB-CE2 3.69Å; D220-Y224 WeakPolarHBondContact O-CB 3.41Å; D220-Y224 WeakPolarHBondContact O-CD2 3.48Å; D220-Y224 PolarHBondContact O-N 2.86Å; I222-Y224 PolarHBondContact O-N 3.15Å; Y224-G228 WeakPolarHBondContact O-CA 3.5Å; Y224-G228 PolarHBondContact O-N 3Å; Y224-I248 HydrophobicContact CD1-CG2 3.94Å; Y224-I248 HydrophobicContact CE1-CG2 4.17Å; Y224-E251 HydrophobicContact CD1-CB 4.36Å; Y224-E251 HydrophobicContact CE1-CB 3.83Å; Y224-E251 HydrophobicContact CE1-CG 4.02Å; Y224-M252 HydrophobicContact CD1-CE 3.7Å; Y224-M252 HydrophobicContact CG-CE 3.96Å
225	K	86.2	Confident	85.8	Confident	127 Å²	127	64.3 Å²	64.3	55%	0.552	34%	0.335	S	S	*	.	H	α-helix	trans	-66.8	-43.2	174.7	-171	172.6	-176.9	177.9	0	111.3	T221 I222 Q223 G228 Y229	T221-K225 VanDerWaalsContact O-CB 3.3Å; T221-K225 WeakPolarHBondContact O-CB 3.47Å; T221-K225 PolarHBondContact O-N 3.31Å; T221-K225 VanDerWaalsContact O-N 3.14Å; I222-K225 PolarHBondContact O-N 3.03Å; I222-K225 VanDerWaalsContact O-N 3.16Å; Q223-K225 VanDerWaalsContact C-N 3.3Å; Q223-K225 PolarHBondContact O-N 2.9Å; K225-G228 PolarHBondContact O-N 2.78Å; K225-Y229 WeakPolarHBondContact CE-OH 3.41Å; K225-Y229 HydrophobicContact CG-CE2 3.89Å; K225-Y229 WeakPolarHBondContact O-CD2 3.42Å; K225-Y229 WeakPolarHBondContact O-CE2 3.23Å
226	I	87.5	Confident	86.3	Confident	68 Å²	68	65.8 Å²	65.8	35%	0.349	35%	0.351	S	S	.	.	H	α-helix	trans	-60.3	-52.8	176	-68.5	164.9	0	0	0	110.1	L215 L218 I222 Q223 G228 Y229	L215-I226 HydrophobicContact CD1-CD1 4.24Å; L215-I226 HydrophobicContact CD1-CG2 4.48Å; L218-I226 HydrophobicContact CD1-CD1 3.71Å; I222-I226 HydrophobicContact CG2-CD1 3.88Å; I222-I226 HydrophobicContact CG2-CG1 4.38Å; I222-I226 VanDerWaalsContact O-CG1 3.28Å; I222-I226 WeakPolarHBondContact O-CG1 3.25Å; I222-I226 PolarHBondContact O-N 2.84Å; Q223-I226 WeakPolarHBondContact O-CB 3.15Å; Q223-I226 PolarHBondContact O-N 3.49Å; I226-G228 PolarHBondContact O-N 2.72Å; I226-Y229 PolarHBondContact O-N 3.23Å
227	F	91	Very high	86.7	Confident	3 Å²	3	70.7 Å²	70.7	1%	0.013	36%	0.361	C	S	.	.	H	α-helix	trans	-67	-28	179.7	-82.7	-123.7	0	0	0	111.8	L215 Q223 Y229 L230 L235 A238 W245 I248 V249 M252	L215-F227 HydrophobicContact CD1-CE2 4.04Å; L215-F227 HydrophobicContact CD2-CD2 4.33Å; L215-F227 HydrophobicContact CD2-CE2 3.32Å; L215-F227 HydrophobicContact CD2-CZ 3.73Å; L215-F227 HydrophobicContact CG-CE2 4.29Å; Q223-F227 WeakPolarHBondContact O-CD2 3.5Å; Q223-F227 PolarHBondContact O-N 3.2Å; F227-Y229 PolarHBondContact O-N 2.98Å; F227-L230 HydrophobicContact CD1-CD1 4.19Å; F227-L230 HydrophobicContact CG-CD1 4.19Å; F227-L230 WeakPolarHBondContact O-CB 3.37Å; F227-L230 PolarHBondContact O-N 3.44Å; F227-L235 HydrophobicContact CB-CD2 4.11Å; F227-L235 HydrophobicContact CD1-CD2 3.85Å; F227-L235 HydrophobicContact CG-CD2 4.41Å; F227-A238 HydrophobicContact CE1-CB 3.95Å; F227-W245 HydrophobicContact CE1-CD2 4.42Å; F227-W245 HydrophobicContact CE1-CE3 4.08Å; F227-W245 AromaticContact CZ-CD2 3.74Å; F227-W245 HydrophobicContact CZ-CD2 3.74Å; F227-W245 AromaticContact CZ-CE3 3.57Å; F227-W245 HydrophobicContact CZ-CE3 3.57Å; F227-W245 HydrophobicContact CZ-CG 4.23Å; F227-W245 HydrophobicContact CZ-CH2 4.37Å; F227-W245 AromaticContact CZ-CZ3 3.89Å; F227-W245 HydrophobicContact CZ-CZ3 3.89Å; F227-I248 HydrophobicContact CB-CG2 4.14Å; F227-I248 HydrophobicContact CD1-CB 4.25Å; F227-I248 HydrophobicContact CD1-CG2 3.6Å; F227-I248 HydrophobicContact CD2-CG2 4.05Å; F227-I248 HydrophobicContact CE1-CB 4.19Å; F227-I248 HydrophobicContact CE1-CG2 3.95Å; F227-I248 HydrophobicContact CE2-CD1 4.47Å; F227-I248 HydrophobicContact CE2-CG2 4.41Å; F227-I248 HydrophobicContact CG-CG2 3.65Å; F227-I248 HydrophobicContact CZ-CD1 4.26Å; F227-I248 HydrophobicContact CZ-CG2 4.35Å; F227-V249 HydrophobicContact CD1-CG2 3.92Å; F227-V249 HydrophobicContact CE1-CG2 3.93Å; F227-M252 HydrophobicContact CB-CG 4.49Å; F227-M252 HydrophobicContact CB-SD 4.07Å
228	G	86.3	Confident	87	Confident	22 Å²	22	64.6 Å²	64.6	23%	0.227	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-15.3	175.6	0	0	0	0	0	114.7	Y224 K225 I226 K255	Y224-G228 WeakPolarHBondContact O-CA 3.5Å; Y224-G228 PolarHBondContact O-N 3Å; K225-G228 PolarHBondContact O-N 2.78Å; I226-G228 PolarHBondContact O-N 2.72Å; G228-K255 PolarHBondContact O-NZ 2.78Å
229	Y	84.5	Confident	87.3	Confident	178 Å²	178	62 Å²	62	70%	0.698	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-10.1	171.6	-66.5	-68.4	0	0	0	113.8	K225 I226 F227	K225-Y229 WeakPolarHBondContact CE-OH 3.41Å; K225-Y229 HydrophobicContact CG-CE2 3.89Å; K225-Y229 WeakPolarHBondContact O-CD2 3.42Å; K225-Y229 WeakPolarHBondContact O-CE2 3.23Å; I226-Y229 PolarHBondContact O-N 3.23Å; F227-Y229 PolarHBondContact O-N 2.98Å
230	L	85.7	Confident	87.4	Confident	64 Å²	64	62.9 Å²	62.9	34%	0.335	33%	0.328	S	S	.	.	S	Bend	trans	-79	145.8	178.7	-61.8	178.5	0	0	0	111.1	F227 D234 L235	F227-L230 HydrophobicContact CD1-CD1 4.19Å; F227-L230 HydrophobicContact CG-CD1 4.19Å; F227-L230 WeakPolarHBondContact O-CB 3.37Å; F227-L230 PolarHBondContact O-N 3.44Å; L230-D234 HydrophobicContact CB-CB 4.16Å; L230-D234 HydrophobicContact CD2-CB 4.33Å; L230-L235 HydrophobicContact CB-CD2 3.97Å; L230-L235 HydrophobicContact CB-CG 3.91Å; L230-L235 HydrophobicContact CD1-CD2 4.08Å
231	T	83.2	Confident	87.4	Confident	53 Å²	53	64 Å²	64	33%	0.325	33%	0.333	S	S	.	.			trans	-69.7	159.7	171.3	72.4	0	0	0	0	110.3	I233 D234 L235	T231-I233 PolarHBondContact O-N 3.49Å; T231-I233 PolarHBondContact OG1-N 3.46Å; T231-D234 CarbonylContact O-C 3.45Å; T231-D234 PolarHBondContact O-N 2.86Å; T231-D234 VanDerWaalsContact OG1-CG 3.28Å; T231-D234 PolarHBondContact OG1-N 3.2Å; T231-D234 VanDerWaalsContact OG1-N 3.16Å; T231-D234 PolarHBondContact OG1-OD2 3.41Å; T231-L235 WeakPolarHBondContact O-CG 3.15Å; T231-L235 PolarHBondContact O-N 3.16Å
232	P	84.1	Confident	87.3	Confident	24 Å²	24	61 Å²	61	16%	0.156	32%	0.317	C	S	.	.	H	α-helix	trans	-59.2	-28.5	174.3	-24.7	34	0	0	0	113.7	A236 L258 D259 L260 F263	P232-A236 WeakPolarHBondContact O-CB 3.42Å; P232-A236 PolarHBondContact O-N 3.07Å; P232-L258 HydrophobicContact CG-CD1 4.4Å; P232-D259 WeakPolarHBondContact CD-O 3.28Å; P232-D259 WeakPolarHBondContact CG-O 3.17Å; P232-L260 HydrophobicContact CG-CD2 4.19Å; P232-F263 HydrophobicContact CB-CE2 3.8Å; P232-F263 HydrophobicContact CB-CZ 4.05Å; P232-F263 HydrophobicContact CG-CE2 4.27Å
233	I	83.3	Confident	87.4	Confident	26 Å²	26	65.1 Å²	65.1	13%	0.133	33%	0.334	C	S	.	.	H	α-helix	trans	-65.7	-45	174	-62	173.9	0	0	0	109.8	T231 A236 R237 C262 F263	T231-I233 PolarHBondContact O-N 3.49Å; T231-I233 PolarHBondContact OG1-N 3.46Å; I233-A236 PolarHBondContact O-N 3.27Å; I233-R237 WeakPolarHBondContact O-CG 3.47Å; I233-R237 PolarHBondContact O-N 2.78Å; I233-R237 VanDerWaalsContact O-N 3.08Å; I233-C262 HydrophobicContact CD1-CB 4.27Å; I233-F263 HydrophobicContact CD1-CD1 4.28Å; I233-F263 HydrophobicContact CD1-CE1 4.27Å; I233-F263 HydrophobicContact CG1-CD1 4.16Å; I233-F263 HydrophobicContact CG1-CE1 3.66Å; I233-F263 HydrophobicContact CG1-CE2 4.21Å; I233-F263 HydrophobicContact CG1-CZ 3.68Å
234	D	87.6	Confident	87.3	Confident	55 Å²	55	69 Å²	69	29%	0.294	35%	0.349	S	S	.	.	H	α-helix	trans	-73.8	-31.6	179.6	-58.9	-44.4	0	0	0	112.4	L230 T231 R237 A238	L230-D234 HydrophobicContact CB-CB 4.16Å; L230-D234 HydrophobicContact CD2-CB 4.33Å; T231-D234 CarbonylContact O-C 3.45Å; T231-D234 PolarHBondContact O-N 2.86Å; T231-D234 VanDerWaalsContact OG1-CG 3.28Å; T231-D234 PolarHBondContact OG1-N 3.2Å; T231-D234 VanDerWaalsContact OG1-N 3.16Å; T231-D234 PolarHBondContact OG1-OD2 3.41Å; D234-R237 PolarHBondContact O-N 2.89Å; D234-R237 IonicContact OD1-CZ 3.84Å; D234-R237 IonicContact OD1-NH1 3.34Å; D234-R237 PolarHBondContact OD1-NH1 3.44Å; D234-A238 VanDerWaalsContact O-CB 3.27Å; D234-A238 WeakPolarHBondContact O-CB 3.42Å; D234-A238 PolarHBondContact O-N 2.86Å
235	L	89.5	Confident	87.4	Confident	19 Å²	19	68 Å²	68	10%	0.099	35%	0.345	C	S	.	.	H	α-helix	trans	-64.1	-41.3	169.9	-72.5	171.7	0	0	0	111.7	F227 L230 T231 R237 A238 A239 V249 M252	F227-L235 HydrophobicContact CB-CD2 4.11Å; F227-L235 HydrophobicContact CD1-CD2 3.85Å; F227-L235 HydrophobicContact CG-CD2 4.41Å; L230-L235 HydrophobicContact CB-CD2 3.97Å; L230-L235 HydrophobicContact CB-CG 3.91Å; L230-L235 HydrophobicContact CD1-CD2 4.08Å; T231-L235 WeakPolarHBondContact O-CG 3.15Å; T231-L235 PolarHBondContact O-N 3.16Å; L235-R237 VanDerWaalsContact C-N 3.32Å; L235-R237 PolarHBondContact O-N 2.81Å; L235-A238 WeakPolarHBondContact O-CB 3.26Å; L235-A238 PolarHBondContact O-N 2.79Å; L235-A239 WeakPolarHBondContact O-CB 3.2Å; L235-A239 PolarHBondContact O-N 2.84Å; L235-V249 HydrophobicContact CB-CG1 4.13Å; L235-V249 HydrophobicContact CB-CG2 4.44Å; L235-V249 HydrophobicContact CD2-CG2 4Å; L235-V249 WeakPolarHBondContact O-CG2 3.35Å; L235-M252 HydrophobicContact CD1-CB 4.38Å; L235-M252 HydrophobicContact CD1-CG 4.3Å; L235-M252 HydrophobicContact CD2-CG 4.05Å
236	A	86.2	Confident	87.7	Confident	59 Å²	59	67.2 Å²	67.2	49%	0.488	34%	0.338	S	S	.	.	H	α-helix	trans	-62.4	-41.6	174.7	0	0	0	0	0	111.4	P232 I233 A239 C240	P232-A236 WeakPolarHBondContact O-CB 3.42Å; P232-A236 PolarHBondContact O-N 3.07Å; I233-A236 PolarHBondContact O-N 3.27Å; A236-A239 PolarHBondContact O-N 2.69Å; A236-C240 PolarHBondContact O-SG 2.93Å; A236-C240 VanDerWaalsContact O-SG 3.39Å
237	R	89.8	Confident	87.9	Confident	161 Å²	161	67 Å²	67	61%	0.608	34%	0.343	S	S	*	.	H	α-helix	trans	-63.1	-43.9	172.9	-68.4	167.7	176.4	163.4	-8.6	111.6	I233 D234 L235 A239 C240	I233-R237 WeakPolarHBondContact O-CG 3.47Å; I233-R237 PolarHBondContact O-N 2.78Å; I233-R237 VanDerWaalsContact O-N 3.08Å; D234-R237 PolarHBondContact O-N 2.89Å; D234-R237 IonicContact OD1-CZ 3.84Å; D234-R237 IonicContact OD1-NH1 3.34Å; D234-R237 PolarHBondContact OD1-NH1 3.44Å; L235-R237 VanDerWaalsContact C-N 3.32Å; L235-R237 PolarHBondContact O-N 2.81Å; R237-A239 VanDerWaalsContact C-N 3.32Å; R237-A239 PolarHBondContact O-N 3.01Å; R237-C240 WeakPolarHBondContact O-CB 3.44Å; R237-C240 PolarHBondContact O-N 3.11Å
238	A	89	Confident	87.9	Confident	4 Å²	4	67.1 Å²	67.1	3%	0.033	34%	0.344	C	S	.	.	H	α-helix	trans	-60.7	-40.4	177.8	0	0	0	0	0	112	F227 D234 L235 C240 I241 W245 V249	F227-A238 HydrophobicContact CE1-CB 3.95Å; D234-A238 VanDerWaalsContact O-CB 3.27Å; D234-A238 WeakPolarHBondContact O-CB 3.42Å; D234-A238 PolarHBondContact O-N 2.86Å; L235-A238 WeakPolarHBondContact O-CB 3.26Å; L235-A238 PolarHBondContact O-N 2.79Å; A238-C240 PolarHBondContact O-N 3.1Å; A238-C240 VanDerWaalsContact O-N 3.13Å; A238-I241 WeakPolarHBondContact O-CB 3.42Å; A238-I241 PolarHBondContact O-N 3.28Å; A238-W245 HydrophobicContact CB-CE3 3.76Å; A238-W245 HydrophobicContact CB-CZ3 4.11Å; A238-W245 WeakPolarHBondContact O-CB 3.38Å; A238-V249 HydrophobicContact CB-CG2 4.13Å
239	A	90.1	Very high	88.1	Confident	14 Å²	14	67 Å²	67	12%	0.116	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-11.6	175.9	0	0	0	0	0	114	L235 A236 R237 R246 V249	L235-A239 WeakPolarHBondContact O-CB 3.2Å; L235-A239 PolarHBondContact O-N 2.84Å; A236-A239 PolarHBondContact O-N 2.69Å; R237-A239 VanDerWaalsContact C-N 3.32Å; R237-A239 PolarHBondContact O-N 3.01Å; A239-R246 HydrophobicContact CB-CB 4.39Å; A239-R246 HydrophobicContact CB-CG 4.35Å; A239-R246 VanDerWaalsContact O-CZ 3.27Å; A239-R246 PolarHBondContact O-NE 3.01Å; A239-R246 PolarHBondContact O-NH2 3.07Å; A239-V249 HydrophobicContact CB-CB 4.1Å; A239-V249 HydrophobicContact CB-CG1 4.07Å; A239-V249 HydrophobicContact CB-CG2 4.09Å
240	C	90.5	Very high	88.4	Confident	100 Å²	100	62 Å²	62	68%	0.676	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-8.5	174.1	-64.7	0	0	0	0	113.3	A236 R237 A238	A236-C240 PolarHBondContact O-SG 2.93Å; A236-C240 VanDerWaalsContact O-SG 3.39Å; R237-C240 WeakPolarHBondContact O-CB 3.44Å; R237-C240 PolarHBondContact O-N 3.11Å; A238-C240 PolarHBondContact O-N 3.1Å; A238-C240 VanDerWaalsContact O-N 3.13Å
241	I	86.9	Confident	88.6	Confident	111 Å²	111	61.9 Å²	61.9	57%	0.569	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-48.9	-175.9	-66.3	174.6	0	0	0	111.5	A238 W245	A238-I241 WeakPolarHBondContact O-CB 3.42Å; A238-I241 PolarHBondContact O-N 3.28Å; I241-W245 HydrophobicContact CB-CD2 4.28Å; I241-W245 HydrophobicContact CB-CE3 4.1Å; I241-W245 HydrophobicContact CD1-CD2 4.42Å; I241-W245 HydrophobicContact CD1-CE3 3.55Å; I241-W245 HydrophobicContact CD1-CH2 4.17Å; I241-W245 HydrophobicContact CD1-CZ3 3.41Å; I241-W245 VanDerWaalsContact CD1-CZ3 3.41Å; I241-W245 HydrophobicContact CG1-CE3 4.31Å; I241-W245 HydrophobicContact CG2-CD2 4.22Å; I241-W245 HydrophobicContact CG2-CE3 4.35Å
242	S	86.4	Confident	88.7	Confident	41 Å²	41	60.1 Å²	60.1	29%	0.287	31%	0.309	S	S	.	.			trans	-155.9	164	179.3	75.2	0	0	0	0	112.1	Y244 W245 R246	S242-Y244 PolarHBondContact O-N 3.25Å; S242-Y244 PolarHBondContact OG-N 3.35Å; S242-W245 PolarHBondContact O-N 3.2Å; S242-W245 VanDerWaalsContact OG-CD1 3.28Å; S242-W245 PolarHBondContact OG-N 3.34Å; S242-R246 WeakPolarHBondContact O-CB 3.32Å; S242-R246 PolarHBondContact O-N 2.9Å
243	H	87.8	Confident	88.8	Confident	161 Å²	161	60 Å²	60	75%	0.745	31%	0.308	S	S	*	.	H	α-helix	trans	-60.3	-35.5	172.1	-74	-75.5	0	0	0	112.3	R246 S247	H243-R246 PolarHBondContact O-N 3.43Å; H243-S247 PolarHBondContact O-N 3.29Å
244	Y	88.9	Confident	88.9	Confident	82 Å²	82	63.9 Å²	63.9	32%	0.322	32%	0.323	S	S	.	.	H	α-helix	trans	-65.1	-50.2	177.1	-175.3	-107.1	0	0	0	111.2	D213 S216 Q223 S242 R246 S247 I248	D213-Y244 WeakPolarHBondContact OD2-CD1 3.42Å; S216-Y244 VanDerWaalsContact CB-CE1 3.49Å; Q223-Y244 VanDerWaalsContact CD-OH 3.24Å; Q223-Y244 PolarHBondContact NE2-OH 3.4Å; Q223-Y244 PolarHBondContact OE1-OH 2.76Å; S242-Y244 PolarHBondContact O-N 3.25Å; S242-Y244 PolarHBondContact OG-N 3.35Å; Y244-R246 VanDerWaalsContact C-N 3.28Å; Y244-R246 PolarHBondContact O-N 2.96Å; Y244-S247 WeakPolarHBondContact O-CA 3.25Å; Y244-S247 WeakPolarHBondContact O-CB 3.41Å; Y244-S247 PolarHBondContact O-N 3.47Å; Y244-I248 HydrophobicContact CD1-CD1 3.97Å; Y244-I248 HydrophobicContact CE1-CD1 3.55Å; Y244-I248 HydrophobicContact CE1-CG1 4.25Å; Y244-I248 PolarHBondContact O-N 2.89Å; Y244-I248 VanDerWaalsContact O-N 3.07Å
245	W	90.9	Very high	88.9	Confident	57 Å²	57	65.2 Å²	65.2	22%	0.216	33%	0.327	C	S	.	.	H	α-helix	trans	-62	-37.8	176.8	-77.6	41.8	0	0	0	111.8	D213 L215 F227 A238 I241 S242 S247 I248 V249	D213-W245 PolarHBondContact OD1-NE1 3.49Å; D213-W245 PolarHBondContact OD2-NE1 2.92Å; L215-W245 HydrophobicContact CD2-CZ2 4.21Å; F227-W245 HydrophobicContact CE1-CD2 4.42Å; F227-W245 HydrophobicContact CE1-CE3 4.08Å; F227-W245 AromaticContact CZ-CD2 3.74Å; F227-W245 HydrophobicContact CZ-CD2 3.74Å; F227-W245 AromaticContact CZ-CE3 3.57Å; F227-W245 HydrophobicContact CZ-CE3 3.57Å; F227-W245 HydrophobicContact CZ-CG 4.23Å; F227-W245 HydrophobicContact CZ-CH2 4.37Å; F227-W245 AromaticContact CZ-CZ3 3.89Å; F227-W245 HydrophobicContact CZ-CZ3 3.89Å; A238-W245 HydrophobicContact CB-CE3 3.76Å; A238-W245 HydrophobicContact CB-CZ3 4.11Å; A238-W245 WeakPolarHBondContact O-CB 3.38Å; I241-W245 HydrophobicContact CB-CD2 4.28Å; I241-W245 HydrophobicContact CB-CE3 4.1Å; I241-W245 HydrophobicContact CD1-CD2 4.42Å; I241-W245 HydrophobicContact CD1-CE3 3.55Å; I241-W245 HydrophobicContact CD1-CH2 4.17Å; I241-W245 HydrophobicContact CD1-CZ3 3.41Å; I241-W245 VanDerWaalsContact CD1-CZ3 3.41Å; I241-W245 HydrophobicContact CG1-CE3 4.31Å; I241-W245 HydrophobicContact CG2-CD2 4.22Å; I241-W245 HydrophobicContact CG2-CE3 4.35Å; S242-W245 PolarHBondContact O-N 3.2Å; S242-W245 VanDerWaalsContact OG-CD1 3.28Å; S242-W245 PolarHBondContact OG-N 3.34Å; W245-S247 VanDerWaalsContact C-N 3.3Å; W245-S247 PolarHBondContact O-N 3.03Å; W245-I248 PolarHBondContact O-N 3.35Å; W245-V249 WeakPolarHBondContact O-CG2 3.12Å; W245-V249 PolarHBondContact O-N 3.07Å
246	R	92	Very high	89	Confident	110 Å²	110	67.3 Å²	67.3	42%	0.415	34%	0.338	S	S	.	.	H	α-helix	trans	-60.4	-38.8	171.8	-175.5	172	-67.7	163	-0.4	112.2	A239 S242 H243 Y244 V249 N250	A239-R246 HydrophobicContact CB-CB 4.39Å; A239-R246 HydrophobicContact CB-CG 4.35Å; A239-R246 VanDerWaalsContact O-CZ 3.27Å; A239-R246 PolarHBondContact O-NE 3.01Å; A239-R246 PolarHBondContact O-NH2 3.07Å; S242-R246 WeakPolarHBondContact O-CB 3.32Å; S242-R246 PolarHBondContact O-N 2.9Å; H243-R246 PolarHBondContact O-N 3.43Å; Y244-R246 VanDerWaalsContact C-N 3.28Å; Y244-R246 PolarHBondContact O-N 2.96Å; R246-V249 PolarHBondContact O-N 3.32Å; R246-N250 WeakPolarHBondContact O-CB 3.43Å; R246-N250 PolarHBondContact O-N 2.96Å; R246-N250 PolarHBondContact O-ND2 3.38Å; R246-N250 PolarHBondContact O-OD1 3.45Å
247	S	91.2	Very high	89.2	Confident	64 Å²	64	66.8 Å²	66.8	45%	0.448	33%	0.329	S	S	.	.	H	α-helix	trans	-60.7	-46.1	173.9	-167.2	0	0	0	0	111.4	H243 Y244 W245 V249 N250 E251	H243-S247 PolarHBondContact O-N 3.29Å; Y244-S247 WeakPolarHBondContact O-CA 3.25Å; Y244-S247 WeakPolarHBondContact O-CB 3.41Å; Y244-S247 PolarHBondContact O-N 3.47Å; W245-S247 VanDerWaalsContact C-N 3.3Å; W245-S247 PolarHBondContact O-N 3.03Å; S247-V249 VanDerWaalsContact C-N 3.34Å; S247-V249 PolarHBondContact O-N 2.6Å; S247-N250 WeakPolarHBondContact O-CB 3.19Å; S247-N250 PolarHBondContact O-N 3.26Å; S247-E251 PolarHBondContact O-N 3.07Å; S247-E251 VanDerWaalsContact O-N 3.11Å
248	I	91.2	Very high	89.3	Confident	5 Å²	5	59.6 Å²	59.6	3%	0.026	30%	0.302	C	S	.	.	H	α-helix	trans	-60.7	-44	175.8	-57.3	172.1	0	0	0	111	L215 Q223 Y224 F227 Y244 W245 N250 E251 M252	L215-I248 HydrophobicContact CD2-CD1 3.56Å; Q223-I248 HydrophobicContact CB-CD1 4.45Å; Q223-I248 VanDerWaalsContact OE1-CD1 3.26Å; Y224-I248 HydrophobicContact CD1-CG2 3.94Å; Y224-I248 HydrophobicContact CE1-CG2 4.17Å; F227-I248 HydrophobicContact CB-CG2 4.14Å; F227-I248 HydrophobicContact CD1-CB 4.25Å; F227-I248 HydrophobicContact CD1-CG2 3.6Å; F227-I248 HydrophobicContact CD2-CG2 4.05Å; F227-I248 HydrophobicContact CE1-CB 4.19Å; F227-I248 HydrophobicContact CE1-CG2 3.95Å; F227-I248 HydrophobicContact CE2-CD1 4.47Å; F227-I248 HydrophobicContact CE2-CG2 4.41Å; F227-I248 HydrophobicContact CG-CG2 3.65Å; F227-I248 HydrophobicContact CZ-CD1 4.26Å; F227-I248 HydrophobicContact CZ-CG2 4.35Å; Y244-I248 HydrophobicContact CD1-CD1 3.97Å; Y244-I248 HydrophobicContact CE1-CD1 3.55Å; Y244-I248 HydrophobicContact CE1-CG1 4.25Å; Y244-I248 PolarHBondContact O-N 2.89Å; Y244-I248 VanDerWaalsContact O-N 3.07Å; W245-I248 PolarHBondContact O-N 3.35Å; I248-N250 VanDerWaalsContact C-N 3.33Å; I248-N250 PolarHBondContact O-N 3.38Å; I248-E251 WeakPolarHBondContact O-CB 3.3Å; I248-E251 PolarHBondContact O-N 2.98Å; I248-M252 PolarHBondContact O-N 2.96Å
249	V	90.9	Very high	89.3	Confident	18 Å²	18	63 Å²	63	11%	0.109	32%	0.32	C	S	.	.	H	α-helix	trans	-64.4	-38	177.7	174	0	0	0	0	111.5	F227 L235 A238 A239 W245 R246 S247 E251 M252	F227-V249 HydrophobicContact CD1-CG2 3.92Å; F227-V249 HydrophobicContact CE1-CG2 3.93Å; L235-V249 HydrophobicContact CB-CG1 4.13Å; L235-V249 HydrophobicContact CB-CG2 4.44Å; L235-V249 HydrophobicContact CD2-CG2 4Å; L235-V249 WeakPolarHBondContact O-CG2 3.35Å; A238-V249 HydrophobicContact CB-CG2 4.13Å; A239-V249 HydrophobicContact CB-CB 4.1Å; A239-V249 HydrophobicContact CB-CG1 4.07Å; A239-V249 HydrophobicContact CB-CG2 4.09Å; W245-V249 WeakPolarHBondContact O-CG2 3.12Å; W245-V249 PolarHBondContact O-N 3.07Å; R246-V249 PolarHBondContact O-N 3.32Å; S247-V249 VanDerWaalsContact C-N 3.34Å; S247-V249 PolarHBondContact O-N 2.6Å; V249-E251 VanDerWaalsContact C-N 3.27Å; V249-E251 PolarHBondContact O-N 3.34Å; V249-M252 WeakPolarHBondContact O-CA 3.32Å; V249-M252 WeakPolarHBondContact O-CB 3.39Å; V249-M252 PolarHBondContact O-N 3.46Å
250	N	90.6	Very high	89.3	Confident	75 Å²	75	62.3 Å²	62.3	40%	0.401	32%	0.315	S	S	.	.	H	α-helix	trans	-62.8	-35.3	175.4	-69.4	-22.1	0	0	0	111.7	R246 S247 I248 M252 D253	R246-N250 WeakPolarHBondContact O-CB 3.43Å; R246-N250 PolarHBondContact O-N 2.96Å; R246-N250 PolarHBondContact O-ND2 3.38Å; R246-N250 PolarHBondContact O-OD1 3.45Å; S247-N250 WeakPolarHBondContact O-CB 3.19Å; S247-N250 PolarHBondContact O-N 3.26Å; I248-N250 VanDerWaalsContact C-N 3.33Å; I248-N250 PolarHBondContact O-N 3.38Å; N250-M252 PolarHBondContact O-N 3.06Å; N250-D253 WeakPolarHBondContact O-CB 3.19Å; N250-D253 PolarHBondContact O-N 3.45Å
251	E	90	Very high	89	Confident	61 Å²	61	59.7 Å²	59.7	29%	0.285	30%	0.297	S	S	.	.	H	α-helix	trans	-63.2	-25.7	172.4	-71	-62.1	131.8	0	0	112.3	Y224 S247 I248 V249 D253 K254	Y224-E251 HydrophobicContact CD1-CB 4.36Å; Y224-E251 HydrophobicContact CE1-CB 3.83Å; Y224-E251 HydrophobicContact CE1-CG 4.02Å; S247-E251 PolarHBondContact O-N 3.07Å; S247-E251 VanDerWaalsContact O-N 3.11Å; I248-E251 WeakPolarHBondContact O-CB 3.3Å; I248-E251 PolarHBondContact O-N 2.98Å; V249-E251 VanDerWaalsContact C-N 3.27Å; V249-E251 PolarHBondContact O-N 3.34Å; E251-D253 PolarHBondContact O-N 3.22Å; E251-K254 WeakPolarHBondContact O-CB 3.1Å; E251-K254 PolarHBondContact O-N 3.43Å; E251-K254 VanDerWaalsContact O-N 3.13Å; E251-K254 IonicContact OE1-NZ 3.63Å; E251-K254 PolarHBondContact OE1-NZ 3.42Å; E251-K254 WeakPolarHBondContact OE2-CD 3.44Å; E251-K254 WeakPolarHBondContact OE2-CE 3.42Å; E251-K254 IonicContact OE2-NZ 3.66Å; E251-K254 PolarHBondContact OE2-NZ 3.39Å
252	M	86.7	Confident	88.8	Confident	15 Å²	15	57 Å²	57	7%	0.074	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-66	-19.1	174.4	-57.7	-62.4	95.2	0	0	112.8	Y224 F227 L235 I248 V249 N250 K254 K255 R279	Y224-M252 HydrophobicContact CD1-CE 3.7Å; Y224-M252 HydrophobicContact CG-CE 3.96Å; F227-M252 HydrophobicContact CB-CG 4.49Å; F227-M252 HydrophobicContact CB-SD 4.07Å; L235-M252 HydrophobicContact CD1-CB 4.38Å; L235-M252 HydrophobicContact CD1-CG 4.3Å; L235-M252 HydrophobicContact CD2-CG 4.05Å; I248-M252 PolarHBondContact O-N 2.96Å; V249-M252 WeakPolarHBondContact O-CA 3.32Å; V249-M252 WeakPolarHBondContact O-CB 3.39Å; V249-M252 PolarHBondContact O-N 3.46Å; N250-M252 PolarHBondContact O-N 3.06Å; M252-K254 PolarHBondContact O-N 2.94Å; M252-K255 WeakPolarHBondContact O-CB 3.49Å; M252-K255 PolarHBondContact O-N 2.91Å; M252-R279 PolarHBondContact O-NH1 3.45Å; M252-R279 PolarHBondContact O-NH2 3.08Å
253	D	84.7	Confident	88.6	Confident	23 Å²	23	56.2 Å²	56.2	12%	0.123	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-68.4	-14.7	174.7	-70.6	-21.7	0	0	0	113	N250 E251 K255 R278 R279	N250-D253 WeakPolarHBondContact O-CB 3.19Å; N250-D253 PolarHBondContact O-N 3.45Å; E251-D253 PolarHBondContact O-N 3.22Å; D253-K255 VanDerWaalsContact C-N 3.33Å; D253-R278 HydrophobicContact CB-CB 4.39Å; D253-R278 VanDerWaalsContact OD2-CD 3.23Å; D253-R278 WeakPolarHBondContact OD2-CD 3.23Å; D253-R278 IonicContact OD2-NH1 2.57Å; D253-R279 HydrophobicContact CB-CG 4.32Å; D253-R279 WeakPolarHBondContact O-CG 3.38Å; D253-R279 IonicContact OD1-CZ 3.02Å; D253-R279 IonicContact OD1-NE 3.35Å; D253-R279 PolarHBondContact OD1-NE 3.42Å; D253-R279 IonicContact OD1-NH2 3Å; D253-R279 PolarHBondContact OD1-NH2 2.93Å
254	K	86.3	Confident	88.1	Confident	106 Å²	106	49.1 Å²	49.1	46%	0.461	25%	0.25	S	C	.	.	G	3₁₀ helix	trans	-84.6	-6.9	171.5	-58.1	176	-169.1	162.6	0	112.9	E251 M252 Y282	E251-K254 WeakPolarHBondContact O-CB 3.1Å; E251-K254 PolarHBondContact O-N 3.43Å; E251-K254 VanDerWaalsContact O-N 3.13Å; E251-K254 IonicContact OE1-NZ 3.63Å; E251-K254 PolarHBondContact OE1-NZ 3.42Å; E251-K254 WeakPolarHBondContact OE2-CD 3.44Å; E251-K254 WeakPolarHBondContact OE2-CE 3.42Å; E251-K254 IonicContact OE2-NZ 3.66Å; E251-K254 PolarHBondContact OE2-NZ 3.39Å; M252-K254 PolarHBondContact O-N 2.94Å; K254-Y282 HydrophobicContact CG-CE2 4.16Å
255	K	87.7	Confident	87.5	Confident	84 Å²	84	52.7 Å²	52.7	37%	0.365	27%	0.267	S	S	.	.			trans	-68.2	133.8	176.4	-161.6	-178.5	-174	-172.7	0	109.7	G228 M252 D253 T257 R279	G228-K255 PolarHBondContact O-NZ 2.78Å; M252-K255 WeakPolarHBondContact O-CB 3.49Å; M252-K255 PolarHBondContact O-N 2.91Å; D253-K255 VanDerWaalsContact C-N 3.33Å; K255-T257 WeakPolarHBondContact CD-OG1 3.28Å; K255-T257 WeakPolarHBondContact CE-OG1 3.31Å; K255-T257 PolarHBondContact O-N 3.08Å; K255-R279 PolarHBondContact O-NH1 3.11Å
256	N	91	Very high	87.1	Confident	62 Å²	62	58.1 Å²	58.1	33%	0.332	29%	0.287	S	S	.	.	S	Bend	trans	-76.5	-4.1	-179.8	64.9	-12.9	0	0	0	114.3	Y282 R284 H285	N256-Y282 VanDerWaalsContact CA-O 3.27Å; N256-Y282 WeakPolarHBondContact CA-O 3.5Å; N256-Y282 VanDerWaalsContact CB-O 3.29Å; N256-Y282 WeakPolarHBondContact CB-O 3.38Å; N256-R284 HydrophobicContact CB-CB 4.24Å; N256-R284 HydrophobicContact CB-CG 4.15Å; N256-R284 PolarHBondContact O-N 2.95Å; N256-H285 PolarHBondContact O-N 3.01Å
257	T	91.2	Very high	86.7	Confident	48 Å²	48	53 Å²	53	29%	0.294	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	139.1	178.1	63.8	0	0	0	0	110.6	K255 H285	K255-T257 WeakPolarHBondContact CD-OG1 3.28Å; K255-T257 WeakPolarHBondContact CE-OG1 3.31Å; K255-T257 PolarHBondContact O-N 3.08Å; T257-H285 CarbonylContact C-O 3.51Å; T257-H285 WeakPolarHBondContact CA-O 3.16Å; T257-H285 HydrophobicContact CG2-CB 4.03Å
258	L	90.5	Very high	86.5	Confident	10 Å²	10	53.5 Å²	53.5	5%	0.052	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	112.3	171.1	-176.6	64.6	0	0	0	110.1	P232 L260 L275 L283 H285 I286 N287	P232-L258 HydrophobicContact CG-CD1 4.4Å; L258-L260 HydrophobicContact CD1-CD2 3.91Å; L258-L260 HydrophobicContact CD1-CG 4.49Å; L258-L260 HydrophobicContact CD2-CD1 3.9Å; L258-L260 HydrophobicContact CD2-CD2 4.12Å; L258-L260 HydrophobicContact CD2-CG 4.11Å; L258-L260 HydrophobicContact CG-CD1 4.24Å; L258-L260 HydrophobicContact CG-CD2 3.83Å; L258-L260 HydrophobicContact CG-CG 3.88Å; L258-L275 HydrophobicContact CD2-CB 4.27Å; L258-L283 HydrophobicContact CB-CD1 3.51Å; L258-H285 PolarHBondContact N-O 3.24Å; L258-I286 WeakPolarHBondContact O-CA 3.41Å; L258-N287 PolarHBondContact O-N 3.2Å
259	D	89.3	Confident	86.2	Confident	76 Å²	76	55.4 Å²	55.4	41%	0.406	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	112.8	175.7	-167.6	-13.4	0	0	0	111	P232 S261 N287	P232-D259 WeakPolarHBondContact CD-O 3.28Å; P232-D259 WeakPolarHBondContact CG-O 3.17Å; D259-S261 WeakPolarHBondContact OD1-CB 3.36Å; D259-S261 PolarHBondContact OD1-N 3.28Å; D259-S261 PolarHBondContact OD1-OG 2.73Å; D259-S261 VanDerWaalsContact OD1-OG 3.06Å; D259-N287 HydrophobicContact CB-CB 4.35Å; D259-N287 WeakPolarHBondContact OD1-CB 3.04Å; D259-N287 PolarHBondContact OD1-ND2 2.82Å; D259-N287 VanDerWaalsContact OD1-ND2 3.08Å; D259-N287 PolarHBondContact OD2-ND2 2.74Å
260	L	90.2	Very high	86	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.301	C	S	.	.			trans	-109.8	6.4	-179.2	-56.6	177.2	0	0	0	112.4	P232 L258 C262 F263 L267 L272 L275 N287 L288	P232-L260 HydrophobicContact CG-CD2 4.19Å; L258-L260 HydrophobicContact CD1-CD2 3.91Å; L258-L260 HydrophobicContact CD1-CG 4.49Å; L258-L260 HydrophobicContact CD2-CD1 3.9Å; L258-L260 HydrophobicContact CD2-CD2 4.12Å; L258-L260 HydrophobicContact CD2-CG 4.11Å; L258-L260 HydrophobicContact CG-CD1 4.24Å; L258-L260 HydrophobicContact CG-CD2 3.83Å; L258-L260 HydrophobicContact CG-CG 3.88Å; L260-C262 PolarHBondContact O-N 2.77Å; L260-C262 VanDerWaalsContact O-N 3.11Å; L260-F263 HydrophobicContact CB-CD2 4.1Å; L260-F263 HydrophobicContact CD2-CD2 4Å; L260-F263 HydrophobicContact CD2-CE2 3.69Å; L260-F263 PolarHBondContact O-N 3.13Å; L260-L267 HydrophobicContact CB-CD1 4.44Å; L260-L267 HydrophobicContact CB-CD2 4.15Å; L260-L267 HydrophobicContact CD1-CD1 4.23Å; L260-L267 HydrophobicContact CD1-CD2 4.17Å; L260-L272 HydrophobicContact CD1-CD1 3.62Å; L260-L275 HydrophobicContact CD2-CD1 3.77Å; L260-N287 WeakPolarHBondContact CA-O 3.43Å; L260-N287 PolarHBondContact N-O 3.41Å; L260-L288 HydrophobicContact CB-CD2 4.06Å; L260-L288 HydrophobicContact CD1-CD2 3.75Å; L260-L288 HydrophobicContact CG-CD2 4.46Å
261	S	84.6	Confident	85.9	Confident	45 Å²	45	59.4 Å²	59.4	32%	0.315	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.7	-178.3	72.6	0	0	0	0	112.5	D259 F263 G264	D259-S261 WeakPolarHBondContact OD1-CB 3.36Å; D259-S261 PolarHBondContact OD1-N 3.28Å; D259-S261 PolarHBondContact OD1-OG 2.73Å; D259-S261 VanDerWaalsContact OD1-OG 3.06Å; S261-F263 PolarHBondContact O-N 2.8Å; S261-G264 PolarHBondContact O-N 3.2Å
262	C	82.2	Confident	85.8	Confident	53 Å²	53	56.6 Å²	56.6	36%	0.358	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-19.1	175.6	65.4	0	0	0	0	114.1	I233 L260	I233-C262 HydrophobicContact CD1-CB 4.27Å; L260-C262 PolarHBondContact O-N 2.77Å; L260-C262 VanDerWaalsContact O-N 3.11Å
263	F	82.6	Confident	85.9	Confident	25 Å²	25	59.9 Å²	59.9	11%	0.11	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-31.5	178	-70.6	-87.6	0	0	0	112.3	P232 I233 L260 S261 K265 R266 L267 L271	P232-F263 HydrophobicContact CB-CE2 3.8Å; P232-F263 HydrophobicContact CB-CZ 4.05Å; P232-F263 HydrophobicContact CG-CE2 4.27Å; I233-F263 HydrophobicContact CD1-CD1 4.28Å; I233-F263 HydrophobicContact CD1-CE1 4.27Å; I233-F263 HydrophobicContact CG1-CD1 4.16Å; I233-F263 HydrophobicContact CG1-CE1 3.66Å; I233-F263 HydrophobicContact CG1-CE2 4.21Å; I233-F263 HydrophobicContact CG1-CZ 3.68Å; L260-F263 HydrophobicContact CB-CD2 4.1Å; L260-F263 HydrophobicContact CD2-CD2 4Å; L260-F263 HydrophobicContact CD2-CE2 3.69Å; L260-F263 PolarHBondContact O-N 3.13Å; S261-F263 PolarHBondContact O-N 2.8Å; F263-K265 PolarHBondContact O-N 3.31Å; F263-R266 VanDerWaalsContact O-CB 3.27Å; F263-R266 WeakPolarHBondContact O-CB 3.37Å; F263-R266 PolarHBondContact O-N 3.39Å; F263-L267 HydrophobicContact CB-CB 3.83Å; F263-L267 HydrophobicContact CB-CD1 4.06Å; F263-L267 HydrophobicContact CB-CG 4.46Å; F263-L267 HydrophobicContact CD1-CD1 4.44Å; F263-L267 HydrophobicContact CD2-CD1 4.02Å; F263-L267 HydrophobicContact CG-CD1 3.93Å; F263-L271 HydrophobicContact CD1-CD2 4.13Å; F263-L271 HydrophobicContact CE1-CD2 3.81Å; F263-L271 HydrophobicContact CZ-CD2 4.35Å
264	G	77.3	Confident	86	Confident	13 Å²	13	64.4 Å²	64.4	13%	0.134	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	49.1	-120.5	-174	0	0	0	0	0	111.8	S261 R266	S261-G264 PolarHBondContact O-N 3.2Å; G264-R266 VanDerWaalsContact C-N 3.25Å; G264-R266 PolarHBondContact O-N 3.39Å
265	K	77.3	Confident	86.1	Confident	156 Å²	156	61 Å²	61	68%	0.678	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-70.8	-11.4	178.5	-61.5	-176.8	-178.5	178.2	0	114.8	F263 L267	F263-K265 PolarHBondContact O-N 3.31Å; K265-L267 VanDerWaalsContact C-N 3.31Å
266	R	81.6	Confident	86.2	Confident	172 Å²	172	57 Å²	57	65%	0.649	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-82.4	-8.5	-178.5	-60.9	172.5	61.4	-168	-0.9	113.4	F263 G264	F263-R266 VanDerWaalsContact O-CB 3.27Å; F263-R266 WeakPolarHBondContact O-CB 3.37Å; F263-R266 PolarHBondContact O-N 3.39Å; G264-R266 VanDerWaalsContact C-N 3.25Å; G264-R266 PolarHBondContact O-N 3.39Å
267	L	84.9	Confident	86.1	Confident	3 Å²	3	61.7 Å²	61.7	2%	0.016	31%	0.305	C	S	.	.			trans	-76.9	124.1	-178.9	-163.3	67.2	0	0	0	109.2	L260 F263 K265 L271 L288 L293	L260-L267 HydrophobicContact CB-CD1 4.44Å; L260-L267 HydrophobicContact CB-CD2 4.15Å; L260-L267 HydrophobicContact CD1-CD1 4.23Å; L260-L267 HydrophobicContact CD1-CD2 4.17Å; F263-L267 HydrophobicContact CB-CB 3.83Å; F263-L267 HydrophobicContact CB-CD1 4.06Å; F263-L267 HydrophobicContact CB-CG 4.46Å; F263-L267 HydrophobicContact CD1-CD1 4.44Å; F263-L267 HydrophobicContact CD2-CD1 4.02Å; F263-L267 HydrophobicContact CG-CD1 3.93Å; K265-L267 VanDerWaalsContact C-N 3.31Å; L267-L271 HydrophobicContact CD1-CD2 4.12Å; L267-L271 HydrophobicContact CD1-CG 4.43Å; L267-L288 HydrophobicContact CD2-CD2 3.45Å; L267-L288 VanDerWaalsContact CD2-CD2 3.45Å; L267-L293 HydrophobicContact CB-CD1 3.95Å; L267-L293 HydrophobicContact CB-CG 4.19Å; L267-L293 HydrophobicContact CD2-CD1 3.63Å; L267-L293 HydrophobicContact CD2-CG 4.28Å; L267-L293 HydrophobicContact CG-CD1 3.43Å; L267-L293 VanDerWaalsContact CG-CD1 3.43Å; L267-L293 HydrophobicContact CG-CG 4.17Å; L267-L293 VanDerWaalsContact O-CD2 3.27Å; L267-L293 WeakPolarHBondContact O-CD2 3.26Å; L267-L293 VanDerWaalsContact O-CG 3.22Å; L267-L293 WeakPolarHBondContact O-CG 3.5Å
268	T	85.9	Confident	85.9	Confident	73 Å²	73	67.1 Å²	67.1	45%	0.448	32%	0.32	S	S	.	.			trans	-110.1	155.7	177.9	63.6	0	0	0	0	111.1	E270 L271 L272 L293	T268-E270 PolarHBondContact O-N 3.35Å; T268-L271 PolarHBondContact O-N 3.19Å; T268-L271 VanDerWaalsContact O-N 3.14Å; T268-L271 WeakPolarHBondContact OG1-CB 3.18Å; T268-L271 PolarHBondContact OG1-N 3.15Å; T268-L272 PolarHBondContact O-N 3.2Å; T268-L293 WeakPolarHBondContact O-CD1 3.48Å
269	D	85	Confident	85.9	Confident	45 Å²	45	67.2 Å²	67.2	24%	0.241	32%	0.32	C	S	.	.	H	α-helix	trans	-55.7	-39.3	177.4	-77.5	-21.1	0	0	0	111.4	L272 L273 L293 T295 S298	D269-L272 PolarHBondContact O-N 2.74Å; D269-L273 WeakPolarHBondContact O-CB 3.46Å; D269-L273 PolarHBondContact O-N 2.97Å; D269-L293 WeakPolarHBondContact OD1-CD2 3.47Å; D269-T295 VanDerWaalsContact CG-OG1 3.27Å; D269-T295 PolarHBondContact OD1-OG1 3.47Å; D269-T295 VanDerWaalsContact OD1-OG1 3.06Å; D269-T295 PolarHBondContact OD2-OG1 3.17Å; D269-S298 WeakPolarHBondContact OD1-CA 3.48Å; D269-S298 WeakPolarHBondContact OD1-CB 3.48Å; D269-S298 PolarHBondContact OD1-N 3.33Å; D269-S298 PolarHBondContact OD1-OG 2.94Å
270	E	87.4	Confident	85.9	Confident	123 Å²	123	70.6 Å²	70.6	58%	0.575	33%	0.327	S	S	*	.	H	α-helix	trans	-64.9	-43.4	178.3	-166.6	-164.8	154.4	0	0	112.3	T268 L273 K274	T268-E270 PolarHBondContact O-N 3.35Å; E270-L273 PolarHBondContact O-N 3.32Å; E270-K274 WeakPolarHBondContact O-CG 3.5Å; E270-K274 PolarHBondContact O-N 2.94Å; E270-K274 WeakPolarHBondContact OE1-CE 3.4Å; E270-K274 IonicContact OE1-NZ 2.92Å; E270-K274 PolarHBondContact OE1-NZ 3.31Å
271	L	86.9	Confident	85.9	Confident	55 Å²	55	75.1 Å²	75.1	29%	0.288	35%	0.354	S	S	.	.	H	α-helix	trans	-66.7	-43.2	178.1	-179.2	59.9	0	0	0	110.6	F263 L267 T268 L273 K274 L275	F263-L271 HydrophobicContact CD1-CD2 4.13Å; F263-L271 HydrophobicContact CE1-CD2 3.81Å; F263-L271 HydrophobicContact CZ-CD2 4.35Å; L267-L271 HydrophobicContact CD1-CD2 4.12Å; L267-L271 HydrophobicContact CD1-CG 4.43Å; T268-L271 PolarHBondContact O-N 3.19Å; T268-L271 VanDerWaalsContact O-N 3.14Å; T268-L271 WeakPolarHBondContact OG1-CB 3.18Å; T268-L271 PolarHBondContact OG1-N 3.15Å; L271-L273 PolarHBondContact O-N 3.44Å; L271-K274 PolarHBondContact O-N 3.06Å; L271-L275 HydrophobicContact CD1-CD1 4.18Å; L271-L275 HydrophobicContact CD1-CG 4.3Å; L271-L275 HydrophobicContact CG-CD1 4.06Å; L271-L275 VanDerWaalsContact O-CG 3.31Å; L271-L275 WeakPolarHBondContact O-CG 3.41Å; L271-L275 PolarHBondContact O-N 3.13Å
272	L	89.3	Confident	86.2	Confident	1 Å²	1	78 Å²	78	1%	0.005	36%	0.359	C	S	.	.	H	α-helix	trans	-59.9	-47.6	176.8	-177.2	62.3	0	0	0	110.9	L260 T268 D269 K274 L275 T276 I286 L288 L293 C301 V302	L260-L272 HydrophobicContact CD1-CD1 3.62Å; T268-L272 PolarHBondContact O-N 3.2Å; D269-L272 PolarHBondContact O-N 2.74Å; L272-K274 VanDerWaalsContact C-N 3.34Å; L272-K274 PolarHBondContact O-N 3.42Å; L272-L275 PolarHBondContact O-N 3.24Å; L272-T276 HydrophobicContact CD1-CG2 3.86Å; L272-T276 HydrophobicContact CG-CG2 4.24Å; L272-T276 WeakPolarHBondContact O-CG2 3.49Å; L272-T276 PolarHBondContact O-N 2.71Å; L272-T276 PolarHBondContact O-OG1 2.99Å; L272-T276 VanDerWaalsContact O-OG1 3.11Å; L272-I286 HydrophobicContact CD1-CD1 4.49Å; L272-L288 HydrophobicContact CD1-CD2 4.22Å; L272-L293 HydrophobicContact CB-CD1 3.94Å; L272-L293 HydrophobicContact CD2-CD1 3.87Å; L272-C301 HydrophobicContact CD2-CB 4.24Å; L272-C301 HydrophobicContact CG-CB 4.15Å; L272-V302 HydrophobicContact CD2-CG2 4Å
273	L	88.9	Confident	86.7	Confident	85 Å²	85	75.5 Å²	75.5	45%	0.445	34%	0.342	S	S	.	.	H	α-helix	trans	-57.7	-45.3	176.7	179.7	62.1	0	0	0	112.1	D269 E270 L271 L275 T276 K277 C301	D269-L273 WeakPolarHBondContact O-CB 3.46Å; D269-L273 PolarHBondContact O-N 2.97Å; E270-L273 PolarHBondContact O-N 3.32Å; L271-L273 PolarHBondContact O-N 3.44Å; L273-L275 VanDerWaalsContact C-N 3.32Å; L273-L275 PolarHBondContact O-N 3.36Å; L273-T276 PolarHBondContact O-OG1 2.93Å; L273-K277 WeakPolarHBondContact O-CB 3.39Å; L273-K277 PolarHBondContact O-N 3.32Å; L273-C301 HydrophobicContact CD1-CB 4.45Å
274	K	86.9	Confident	87.3	Confident	118 Å²	118	80 Å²	80	51%	0.513	36%	0.358	S	S	.	.	H	α-helix	trans	-60.6	-42.6	178	-79.4	171.6	172.9	167.5	0	111.5	E270 L271 L272 R278	E270-K274 WeakPolarHBondContact O-CG 3.5Å; E270-K274 PolarHBondContact O-N 2.94Å; E270-K274 WeakPolarHBondContact OE1-CE 3.4Å; E270-K274 IonicContact OE1-NZ 2.92Å; E270-K274 PolarHBondContact OE1-NZ 3.31Å; L271-K274 PolarHBondContact O-N 3.06Å; L272-K274 VanDerWaalsContact C-N 3.34Å; L272-K274 PolarHBondContact O-N 3.42Å; K274-R278 WeakPolarHBondContact O-CG 3.45Å
275	L	88	Confident	88.2	Confident	34 Å²	34	82.1 Å²	82.1	18%	0.178	36%	0.364	C	S	.	.	H	α-helix	trans	-72.5	-44.3	-179.1	-67.6	173.4	0	0	0	112.5	L258 L260 L271 L272 L273 R279	L258-L275 HydrophobicContact CD2-CB 4.27Å; L260-L275 HydrophobicContact CD2-CD1 3.77Å; L271-L275 HydrophobicContact CD1-CD1 4.18Å; L271-L275 HydrophobicContact CD1-CG 4.3Å; L271-L275 HydrophobicContact CG-CD1 4.06Å; L271-L275 VanDerWaalsContact O-CG 3.31Å; L271-L275 WeakPolarHBondContact O-CG 3.41Å; L271-L275 PolarHBondContact O-N 3.13Å; L272-L275 PolarHBondContact O-N 3.24Å; L273-L275 VanDerWaalsContact C-N 3.32Å; L273-L275 PolarHBondContact O-N 3.36Å; L275-R279 WeakPolarHBondContact O-CG 3.5Å
276	T	89.1	Confident	89	Confident	0 Å²	0	74.8 Å²	74.8	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-71.7	-37.7	-179.5	59.9	0	0	0	0	111.8	L272 L273 R278 R279 R280 I286 C301	L272-T276 HydrophobicContact CD1-CG2 3.86Å; L272-T276 HydrophobicContact CG-CG2 4.24Å; L272-T276 WeakPolarHBondContact O-CG2 3.49Å; L272-T276 PolarHBondContact O-N 2.71Å; L272-T276 PolarHBondContact O-OG1 2.99Å; L272-T276 VanDerWaalsContact O-OG1 3.11Å; L273-T276 PolarHBondContact O-OG1 2.93Å; T276-R278 VanDerWaalsContact C-N 3.29Å; T276-R278 PolarHBondContact O-N 2.88Å; T276-R279 CarbonylContact O-C 3.49Å; T276-R279 PolarHBondContact O-N 3.45Å; T276-R280 WeakPolarHBondContact O-CA 3.08Å; T276-R280 PolarHBondContact O-N 3.03Å; T276-I286 HydrophobicContact CG2-CD1 4.46Å; T276-C301 WeakPolarHBondContact CB-O 3.44Å; T276-C301 PolarHBondContact OG1-O 2.84Å; T276-C301 VanDerWaalsContact OG1-O 3.1Å
277	K	89.5	Confident	89.5	Confident	160 Å²	160	68.2 Å²	68.2	70%	0.696	31%	0.31	S	S	*	.	H	α-helix	trans	-57.8	-40.5	178.6	-175.7	176.3	-178.6	178.9	0	112.5	L273 R279	L273-K277 WeakPolarHBondContact O-CB 3.39Å; L273-K277 PolarHBondContact O-N 3.32Å; K277-R279 VanDerWaalsContact C-N 3.29Å; K277-R279 PolarHBondContact O-N 3.47Å
278	R	87	Confident	89.8	Confident	162 Å²	162	68.3 Å²	68.3	61%	0.611	31%	0.311	S	S	*	.	H	α-helix	trans	-70.9	-25.3	177.5	-67.5	-175.4	-179.6	-166.9	-1.5	113.2	D253 K274 T276	D253-R278 HydrophobicContact CB-CB 4.39Å; D253-R278 VanDerWaalsContact OD2-CD 3.23Å; D253-R278 WeakPolarHBondContact OD2-CD 3.23Å; D253-R278 IonicContact OD2-NH1 2.57Å; K274-R278 WeakPolarHBondContact O-CG 3.45Å; T276-R278 VanDerWaalsContact C-N 3.29Å; T276-R278 PolarHBondContact O-N 2.88Å
279	R	90.1	Very high	90	Very high	13 Å²	13	69.3 Å²	69.3	5%	0.049	31%	0.306	C	S	.	.	H	α-helix	trans	-105.3	3	-173.7	-64	174.8	175.3	-91.6	-7.8	113.8	M252 D253 K255 L275 T276 K277 V281 Y282 L283	M252-R279 PolarHBondContact O-NH1 3.45Å; M252-R279 PolarHBondContact O-NH2 3.08Å; D253-R279 HydrophobicContact CB-CG 4.32Å; D253-R279 WeakPolarHBondContact O-CG 3.38Å; D253-R279 IonicContact OD1-CZ 3.02Å; D253-R279 IonicContact OD1-NE 3.35Å; D253-R279 PolarHBondContact OD1-NE 3.42Å; D253-R279 IonicContact OD1-NH2 3Å; D253-R279 PolarHBondContact OD1-NH2 2.93Å; K255-R279 PolarHBondContact O-NH1 3.11Å; L275-R279 WeakPolarHBondContact O-CG 3.5Å; T276-R279 CarbonylContact O-C 3.49Å; T276-R279 PolarHBondContact O-N 3.45Å; K277-R279 VanDerWaalsContact C-N 3.29Å; K277-R279 PolarHBondContact O-N 3.47Å; R279-V281 VanDerWaalsContact C-N 3.29Å; R279-V281 PolarHBondContact O-N 3.33Å; R279-Y282 PolarHBondContact O-N 3.07Å; R279-L283 HydrophobicContact CB-CB 4.21Å; R279-L283 WeakPolarHBondContact O-CB 3.4Å; R279-L283 PolarHBondContact O-N 3.2Å
280	R	89.8	Confident	90	Very high	147 Å²	147	71.4 Å²	71.4	56%	0.555	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	-42.4	-164.7	-167.2	179.2	-179.3	175.2	-1.3	115.1	T276 S304	T276-R280 WeakPolarHBondContact O-CA 3.08Å; T276-R280 PolarHBondContact O-N 3.03Å; R280-S304 WeakPolarHBondContact CG-O 3.49Å; R280-S304 PolarHBondContact NE-O 3.18Å
281	V	90.3	Very high	89.7	Confident	94 Å²	94	65.8 Å²	65.8	57%	0.57	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-19.2	-177.9	-64.5	0	0	0	0	113.7	R279 N307	R279-V281 VanDerWaalsContact C-N 3.29Å; R279-V281 PolarHBondContact O-N 3.33Å; V281-N307 PolarHBondContact O-ND2 2.94Å
282	Y	91.4	Very high	89	Confident	107 Å²	107	66.6 Å²	66.6	42%	0.42	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	-29.9	-173.3	-55.9	-64.9	0	0	0	113.1	K254 N256 R279 R284	K254-Y282 HydrophobicContact CG-CE2 4.16Å; N256-Y282 VanDerWaalsContact CA-O 3.27Å; N256-Y282 WeakPolarHBondContact CA-O 3.5Å; N256-Y282 VanDerWaalsContact CB-O 3.29Å; N256-Y282 WeakPolarHBondContact CB-O 3.38Å; R279-Y282 PolarHBondContact O-N 3.07Å; Y282-R284 PolarHBondContact O-N 3.36Å
283	L	92.9	Very high	88	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	31%	0.306	C	S	.	.			trans	-67.9	125.4	-169.7	-163.7	65.3	0	0	0	111.4	L258 R279 H285 I286 C305 N307 L308	L258-L283 HydrophobicContact CB-CD1 3.51Å; R279-L283 HydrophobicContact CB-CB 4.21Å; R279-L283 WeakPolarHBondContact O-CB 3.4Å; R279-L283 PolarHBondContact O-N 3.2Å; L283-H285 WeakPolarHBondContact CD1-O 3.35Å; L283-I286 HydrophobicContact CD2-CB 4.25Å; L283-I286 HydrophobicContact CD2-CD1 4.15Å; L283-I286 HydrophobicContact CD2-CG1 4.45Å; L283-C305 HydrophobicContact CB-CB 4.3Å; L283-C305 HydrophobicContact CD2-CB 4.37Å; L283-N307 CarbonylContact O-C 3.33Å; L283-L308 HydrophobicContact CB-CD2 4.5Å; L283-L308 HydrophobicContact CD2-CD2 4.02Å; L283-L308 HydrophobicContact CG-CD2 3.84Å
284	R	95.1	Very high	86.8	Confident	119 Å²	119	64 Å²	64	45%	0.449	29%	0.29	S	S	.	.			trans	-120.6	-33.3	175.5	-64	-175	-174.2	-172.2	-1.3	112.1	N256 Y282 Q309 D310	N256-R284 HydrophobicContact CB-CB 4.24Å; N256-R284 HydrophobicContact CB-CG 4.15Å; N256-R284 PolarHBondContact O-N 2.95Å; Y282-R284 PolarHBondContact O-N 3.36Å; R284-Q309 PolarHBondContact O-N 3.25Å; R284-D310 PolarHBondContact O-N 3.43Å
285	H	95.2	Very high	86.2	Confident	57 Å²	57	61.4 Å²	61.4	26%	0.264	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	127.1	-178.7	-48.1	-95	0	0	0	110	N256 T257 L258 L283 D310	N256-H285 PolarHBondContact O-N 3.01Å; T257-H285 CarbonylContact C-O 3.51Å; T257-H285 WeakPolarHBondContact CA-O 3.16Å; T257-H285 HydrophobicContact CG2-CB 4.03Å; L258-H285 PolarHBondContact N-O 3.24Å; L283-H285 WeakPolarHBondContact CD1-O 3.35Å; H285-D310 WeakPolarHBondContact CA-O 3.17Å; H285-D310 HydrophobicContact CB-CB 4.08Å; H285-D310 IonicContact CE1-OD2 3.27Å; H285-D310 IonicContact CG-OD2 3.85Å; H285-D310 WeakPolarHBondContact ND1-CB 3.5Å; H285-D310 IonicContact ND1-OD2 3.42Å; H285-D310 PolarHBondContact ND1-OD2 3.36Å
286	I	94	Very high	85.7	Confident	3 Å²	3	63.6 Å²	63.6	2%	0.015	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	127.8	174.1	-164.8	175.8	0	0	0	110.5	L258 L272 T276 L283 L288 V302 L308 D310 I311 N312	L258-I286 WeakPolarHBondContact O-CA 3.41Å; L272-I286 HydrophobicContact CD1-CD1 4.49Å; T276-I286 HydrophobicContact CG2-CD1 4.46Å; L283-I286 HydrophobicContact CD2-CB 4.25Å; L283-I286 HydrophobicContact CD2-CD1 4.15Å; L283-I286 HydrophobicContact CD2-CG1 4.45Å; I286-L288 HydrophobicContact CD1-CD1 3.93Å; I286-L288 HydrophobicContact CD1-CG 4.16Å; I286-L288 HydrophobicContact CG1-CD1 4.33Å; I286-L288 HydrophobicContact CG1-CG 4.15Å; I286-V302 HydrophobicContact CD1-CG1 4.33Å; I286-V302 HydrophobicContact CD1-CG2 4.16Å; I286-V302 HydrophobicContact CG2-CG1 4.16Å; I286-L308 HydrophobicContact CB-CD2 4.12Å; I286-L308 HydrophobicContact CG2-CD1 4.34Å; I286-L308 HydrophobicContact CG2-CD2 3.83Å; I286-D310 PolarHBondContact N-O 3.04Å; I286-I311 HydrophobicContact CG2-CB 4.37Å; I286-I311 HydrophobicContact CG2-CG1 3.97Å; I286-I311 HydrophobicContact CG2-CG2 4.3Å; I286-N312 PolarHBondContact O-N 3.07Å
287	N	92.2	Very high	85.5	Confident	34 Å²	34	68.2 Å²	68.2	18%	0.182	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	115.2	174.7	-178.1	11.7	0	0	0	109.8	L258 D259 L260 R289 N312	L258-N287 PolarHBondContact O-N 3.2Å; D259-N287 HydrophobicContact CB-CB 4.35Å; D259-N287 WeakPolarHBondContact OD1-CB 3.04Å; D259-N287 PolarHBondContact OD1-ND2 2.82Å; D259-N287 VanDerWaalsContact OD1-ND2 3.08Å; D259-N287 PolarHBondContact OD2-ND2 2.74Å; L260-N287 WeakPolarHBondContact CA-O 3.43Å; L260-N287 PolarHBondContact N-O 3.41Å; N287-R289 VanDerWaalsContact OD1-CB 3.27Å; N287-R289 WeakPolarHBondContact OD1-CB 3.38Å; N287-R289 PolarHBondContact OD1-N 2.92Å; N287-R289 VanDerWaalsContact OD1-N 3.09Å; N287-N312 HydrophobicContact CB-CB 4.47Å
288	L	91.9	Very high	85.3	Confident	4 Å²	4	60.7 Å²	60.7	2%	0.021	29%	0.287	C	S	.	.			trans	-119.6	18.3	-179.5	-75.9	167.4	0	0	0	111.2	L260 L267 L272 I286 N290 S291 V302 N312 L313 C316	L260-L288 HydrophobicContact CB-CD2 4.06Å; L260-L288 HydrophobicContact CD1-CD2 3.75Å; L260-L288 HydrophobicContact CG-CD2 4.46Å; L267-L288 HydrophobicContact CD2-CD2 3.45Å; L267-L288 VanDerWaalsContact CD2-CD2 3.45Å; L272-L288 HydrophobicContact CD1-CD2 4.22Å; I286-L288 HydrophobicContact CD1-CD1 3.93Å; I286-L288 HydrophobicContact CD1-CG 4.16Å; I286-L288 HydrophobicContact CG1-CD1 4.33Å; I286-L288 HydrophobicContact CG1-CG 4.15Å; L288-N290 PolarHBondContact O-N 3.46Å; L288-S291 WeakPolarHBondContact O-CB 3.3Å; L288-S291 PolarHBondContact O-N 3.03Å; L288-S291 PolarHBondContact O-OG 3.28Å; L288-V302 HydrophobicContact CD1-CG2 3.67Å; L288-N312 CarbonylContact C-O 3.4Å; L288-N312 WeakPolarHBondContact CA-O 3.36Å; L288-N312 PolarHBondContact N-O 2.94Å; L288-L313 HydrophobicContact CB-CD2 3.86Å; L288-L313 HydrophobicContact CD1-CD2 3.91Å; L288-C316 PolarHBondContact O-SG 3.42Å
289	R	88.6	Confident	85.4	Confident	94 Å²	94	53.1 Å²	53.1	36%	0.355	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	133.4	-177.5	172.1	176.4	179.9	102.9	-13.8	111.8	N287 S291 N312 S314	N287-R289 VanDerWaalsContact OD1-CB 3.27Å; N287-R289 WeakPolarHBondContact OD1-CB 3.38Å; N287-R289 PolarHBondContact OD1-N 2.92Å; N287-R289 VanDerWaalsContact OD1-N 3.09Å; R289-S291 PolarHBondContact O-N 2.82Å; R289-N312 PolarHBondContact N-O 3.43Å; R289-S314 CarbonylContact C-O 3.53Å; R289-S314 VanDerWaalsContact CA-O 3.27Å; R289-S314 WeakPolarHBondContact CA-O 3.47Å; R289-S314 WeakPolarHBondContact CD-OG 3.49Å; R289-S314 VanDerWaalsContact CG-OG 3.29Å; R289-S314 WeakPolarHBondContact CG-OG 3.47Å; R289-S314 PolarHBondContact NH1-OG 3.07Å
290	N	84.9	Confident	85.3	Confident	89 Å²	89	59.4 Å²	59.4	48%	0.476	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	29	176.8	-165.5	49.6	0	0	0	113.1	L288 S314 K315	L288-N290 PolarHBondContact O-N 3.46Å; N290-S314 PolarHBondContact N-O 3.14Å; N290-K315 HydrophobicContact CB-CB 4.15Å
291	S	82.2	Confident	85.2	Confident	5 Å²	5	53.1 Å²	53.1	4%	0.035	26%	0.261	C	S	.	.			trans	-83.7	143.6	170.6	64.6	0	0	0	0	109.9	L288 R289 L293 C316	L288-S291 WeakPolarHBondContact O-CB 3.3Å; L288-S291 PolarHBondContact O-N 3.03Å; L288-S291 PolarHBondContact O-OG 3.28Å; R289-S291 PolarHBondContact O-N 2.82Å; S291-L293 PolarHBondContact O-N 3.41Å; S291-C316 PolarHBondContact OG-SG 3.43Å
292	S	72.4	Confident	85.2	Confident	73 Å²	73	48.8 Å²	48.8	51%	0.51	24%	0.235	S	C	.	.	S	Bend	trans	-78.7	-1.8	172.8	51.1	0	0	0	0	112.8	C294	S292-C294 PolarHBondContact O-N 3.34Å
293	L	67.2	Low	85.2	Confident	14 Å²	14	44.1 Å²	44.1	7%	0.073	22%	0.217	C	C	.	.			trans	-84	96.6	-178.5	-73	-168.3	0	0	0	111	L267 T268 D269 L272 S291	L267-L293 HydrophobicContact CB-CD1 3.95Å; L267-L293 HydrophobicContact CB-CG 4.19Å; L267-L293 HydrophobicContact CD2-CD1 3.63Å; L267-L293 HydrophobicContact CD2-CG 4.28Å; L267-L293 HydrophobicContact CG-CD1 3.43Å; L267-L293 VanDerWaalsContact CG-CD1 3.43Å; L267-L293 HydrophobicContact CG-CG 4.17Å; L267-L293 VanDerWaalsContact O-CD2 3.27Å; L267-L293 WeakPolarHBondContact O-CD2 3.26Å; L267-L293 VanDerWaalsContact O-CG 3.22Å; L267-L293 WeakPolarHBondContact O-CG 3.5Å; T268-L293 WeakPolarHBondContact O-CD1 3.48Å; D269-L293 WeakPolarHBondContact OD1-CD2 3.47Å; L272-L293 HydrophobicContact CB-CD1 3.94Å; L272-L293 HydrophobicContact CD2-CD1 3.87Å; S291-L293 PolarHBondContact O-N 3.41Å
294	C	64.3	Low	85.1	Confident	16 Å²	16	45.6 Å²	45.6	11%	0.108	23%	0.228	C	C	.	.			trans	-135.6	21.3	172.3	-48	0	0	0	0	112.2	S292 G318 I319	S292-C294 PolarHBondContact O-N 3.34Å; C294-G318 VanDerWaalsContact CB-CA 3.47Å; C294-G318 WeakPolarHBondContact CB-O 3.3Å; C294-I319 HydrophobicContact CB-CD1 4.04Å; C294-I319 HydrophobicContact CB-CG1 4.35Å
295	T	73.5	Confident	84.9	Confident	64 Å²	64	39.9 Å²	39.9	39%	0.393	21%	0.206	S	C	.	.	S	Bend	trans	-66.9	152.3	170.9	65.7	0	0	0	0	108.7	D269 N297 S298 I299	D269-T295 VanDerWaalsContact CG-OG1 3.27Å; D269-T295 PolarHBondContact OD1-OG1 3.47Å; D269-T295 VanDerWaalsContact OD1-OG1 3.06Å; D269-T295 PolarHBondContact OD2-OG1 3.17Å; T295-N297 PolarHBondContact O-N 3.25Å; T295-N297 VanDerWaalsContact O-N 3.08Å; T295-S298 PolarHBondContact N-OG 3.46Å; T295-S298 PolarHBondContact O-N 2.92Å; T295-S298 VanDerWaalsContact O-N 3.09Å; T295-S298 PolarHBondContact O-OG 3.02Å; T295-S298 PolarHBondContact OG1-N 3.06Å; T295-S298 VanDerWaalsContact OG1-N 3.17Å; T295-S298 PolarHBondContact OG1-OG 2.97Å; T295-I299 PolarHBondContact O-N 3.06Å
296	L	78.2	Confident	84.6	Confident	81 Å²	81	39.7 Å²	39.7	42%	0.424	22%	0.215	S	C	.	.	H	α-helix	trans	-56.3	-29.7	174.7	-171.9	65.4	0	0	0	111.7	I299 R300 L326	L296-I299 PolarHBondContact O-N 3.46Å; L296-R300 VanDerWaalsContact O-CG 3.31Å; L296-R300 WeakPolarHBondContact O-CG 3.4Å; L296-R300 PolarHBondContact O-N 3.21Å; L296-L326 HydrophobicContact CD1-CD2 4.11Å
297	N	84.6	Confident	84.5	Confident	97 Å²	97	42.9 Å²	42.9	52%	0.519	23%	0.231	S	C	.	.	H	α-helix	trans	-67.5	-44.1	176.1	-71.8	-20	0	0	0	112.9	T295 I299 R300 C301	T295-N297 PolarHBondContact O-N 3.25Å; T295-N297 VanDerWaalsContact O-N 3.08Å; N297-I299 VanDerWaalsContact C-N 3.3Å; N297-I299 PolarHBondContact O-N 2.97Å; N297-R300 WeakPolarHBondContact O-CB 3.22Å; N297-R300 PolarHBondContact O-N 3.43Å; N297-C301 PolarHBondContact O-N 3.32Å; N297-C301 PolarHBondContact O-SG 2.93Å
298	S	84.9	Confident	84.6	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.007	22%	0.223	C	C	.	.	H	α-helix	trans	-60.7	-42.6	174.8	19.7	0	0	0	0	111.1	D269 T295 R300 C301 V302	D269-S298 WeakPolarHBondContact OD1-CA 3.48Å; D269-S298 WeakPolarHBondContact OD1-CB 3.48Å; D269-S298 PolarHBondContact OD1-N 3.33Å; D269-S298 PolarHBondContact OD1-OG 2.94Å; T295-S298 PolarHBondContact N-OG 3.46Å; T295-S298 PolarHBondContact O-N 2.92Å; T295-S298 VanDerWaalsContact O-N 3.09Å; T295-S298 PolarHBondContact O-OG 3.02Å; T295-S298 PolarHBondContact OG1-N 3.06Å; T295-S298 VanDerWaalsContact OG1-N 3.17Å; T295-S298 PolarHBondContact OG1-OG 2.97Å; S298-R300 VanDerWaalsContact C-N 3.35Å; S298-R300 PolarHBondContact O-N 3.31Å; S298-C301 WeakPolarHBondContact O-CA 3.48Å; S298-C301 VanDerWaalsContact O-CB 3.28Å; S298-C301 WeakPolarHBondContact O-CB 3.47Å; S298-C301 PolarHBondContact O-N 3.07Å; S298-V302 WeakPolarHBondContact O-CG2 3.45Å; S298-V302 PolarHBondContact O-N 3.23Å
299	I	89.2	Confident	84.8	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.015	23%	0.232	C	C	.	.	H	α-helix	trans	-65.9	-38.1	179.1	-55.1	-62	0	0	0	111.4	T295 L296 N297 C301 V302 T303 I319 A323 L326 I327	T295-I299 PolarHBondContact O-N 3.06Å; L296-I299 PolarHBondContact O-N 3.46Å; N297-I299 VanDerWaalsContact C-N 3.3Å; N297-I299 PolarHBondContact O-N 2.97Å; I299-C301 VanDerWaalsContact C-N 3.28Å; I299-C301 PolarHBondContact O-N 3.28Å; I299-V302 PolarHBondContact O-N 3.42Å; I299-T303 HydrophobicContact CG2-CG2 4.11Å; I299-T303 WeakPolarHBondContact O-CB 3.43Å; I299-T303 WeakPolarHBondContact O-CG2 3.24Å; I299-T303 PolarHBondContact O-N 3.18Å; I299-T303 PolarHBondContact O-OG1 3.49Å; I299-I319 HydrophobicContact CD1-CD1 3.64Å; I299-A323 HydrophobicContact CD1-CB 4.31Å; I299-A323 HydrophobicContact CG1-CB 3.82Å; I299-A323 HydrophobicContact CG2-CB 4.32Å; I299-L326 HydrophobicContact CG2-CB 4.36Å; I299-L326 HydrophobicContact CG2-CD2 4.02Å; I299-I327 HydrophobicContact CD1-CD1 4.45Å; I299-I327 HydrophobicContact CG2-CD1 4.12Å; I299-I327 HydrophobicContact CG2-CG1 3.73Å
300	R	89	Confident	85.2	Confident	146 Å²	146	40.7 Å²	40.7	55%	0.551	23%	0.225	S	C	*	.	H	α-helix	trans	-59.5	-37.9	170	-76.4	174.4	175.1	-167.6	-1.5	112.5	L296 N297 S298 V302 T303 S304 L326	L296-R300 VanDerWaalsContact O-CG 3.31Å; L296-R300 WeakPolarHBondContact O-CG 3.4Å; L296-R300 PolarHBondContact O-N 3.21Å; N297-R300 WeakPolarHBondContact O-CB 3.22Å; N297-R300 PolarHBondContact O-N 3.43Å; S298-R300 VanDerWaalsContact C-N 3.35Å; S298-R300 PolarHBondContact O-N 3.31Å; R300-V302 VanDerWaalsContact C-N 3.35Å; R300-T303 VanDerWaalsContact CA-OG1 3.28Å; R300-T303 WeakPolarHBondContact CA-OG1 3.36Å; R300-T303 PolarHBondContact O-OG1 3.44Å; R300-S304 WeakPolarHBondContact O-CB 3.42Å; R300-S304 PolarHBondContact O-N 2.97Å; R300-L326 HydrophobicContact CG-CD2 3.6Å
301	C	88.3	Confident	85.7	Confident	14 Å²	14	36.5 Å²	36.5	10%	0.095	20%	0.203	C	C	.	.	H	α-helix	trans	-64.6	-40.5	175.8	-61.6	0	0	0	0	111.8	L272 L273 T276 N297 S298 I299 S304	L272-C301 HydrophobicContact CD2-CB 4.24Å; L272-C301 HydrophobicContact CG-CB 4.15Å; L273-C301 HydrophobicContact CD1-CB 4.45Å; T276-C301 WeakPolarHBondContact CB-O 3.44Å; T276-C301 PolarHBondContact OG1-O 2.84Å; T276-C301 VanDerWaalsContact OG1-O 3.1Å; N297-C301 PolarHBondContact O-N 3.32Å; N297-C301 PolarHBondContact O-SG 2.93Å; S298-C301 WeakPolarHBondContact O-CA 3.48Å; S298-C301 VanDerWaalsContact O-CB 3.28Å; S298-C301 WeakPolarHBondContact O-CB 3.47Å; S298-C301 PolarHBondContact O-N 3.07Å; I299-C301 VanDerWaalsContact C-N 3.28Å; I299-C301 PolarHBondContact O-N 3.28Å; C301-S304 PolarHBondContact O-OG 3.17Å
302	V	90	Very high	86.3	Confident	3 Å²	3	37.4 Å²	37.4	2%	0.018	21%	0.207	C	C	.	.	H	α-helix	trans	-67.4	-53.8	176.6	177.4	0	0	0	0	110.7	L272 I286 L288 S298 I299 R300 S304 C305 L308	L272-V302 HydrophobicContact CD2-CG2 4Å; I286-V302 HydrophobicContact CD1-CG1 4.33Å; I286-V302 HydrophobicContact CD1-CG2 4.16Å; I286-V302 HydrophobicContact CG2-CG1 4.16Å; L288-V302 HydrophobicContact CD1-CG2 3.67Å; S298-V302 WeakPolarHBondContact O-CG2 3.45Å; S298-V302 PolarHBondContact O-N 3.23Å; I299-V302 PolarHBondContact O-N 3.42Å; R300-V302 VanDerWaalsContact C-N 3.35Å; V302-S304 PolarHBondContact O-N 2.83Å; V302-S304 VanDerWaalsContact O-N 3.15Å; V302-C305 WeakPolarHBondContact O-CB 3.49Å; V302-C305 PolarHBondContact O-N 3.33Å; V302-L308 HydrophobicContact CG1-CD1 3.55Å; V302-L308 VanDerWaalsContact O-CD1 3.32Å; V302-L308 WeakPolarHBondContact O-CD1 3.45Å
303	T	90.8	Very high	87.3	Confident	9 Å²	9	34 Å²	34	6%	0.055	18%	0.184	C	C	.	.	H	α-helix	trans	-65.3	-17.3	-177.1	51.6	0	0	0	0	114	I299 R300 C305 L326 I327 E330	I299-T303 HydrophobicContact CG2-CG2 4.11Å; I299-T303 WeakPolarHBondContact O-CB 3.43Å; I299-T303 WeakPolarHBondContact O-CG2 3.24Å; I299-T303 PolarHBondContact O-N 3.18Å; I299-T303 PolarHBondContact O-OG1 3.49Å; R300-T303 VanDerWaalsContact CA-OG1 3.28Å; R300-T303 WeakPolarHBondContact CA-OG1 3.36Å; R300-T303 PolarHBondContact O-OG1 3.44Å; T303-C305 PolarHBondContact O-N 3.31Å; T303-C305 VanDerWaalsContact O-N 3.07Å; T303-L326 HydrophobicContact CG2-CG 4.22Å; T303-I327 HydrophobicContact CG2-CB 4.38Å; T303-I327 HydrophobicContact CG2-CG1 3.92Å; T303-E330 HydrophobicContact CG2-CB 4.16Å
304	S	89.8	Confident	88.5	Confident	31 Å²	31	33.3 Å²	33.3	22%	0.217	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-20.6	168.4	78.6	0	0	0	0	113.6	R280 R300 C301 V302 A306	R280-S304 WeakPolarHBondContact CG-O 3.49Å; R280-S304 PolarHBondContact NE-O 3.18Å; R300-S304 WeakPolarHBondContact O-CB 3.42Å; R300-S304 PolarHBondContact O-N 2.97Å; C301-S304 PolarHBondContact O-OG 3.17Å; V302-S304 PolarHBondContact O-N 2.83Å; V302-S304 VanDerWaalsContact O-N 3.15Å; S304-A306 PolarHBondContact O-N 2.98Å
305	C	92	Very high	89.6	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.			trans	-89.3	78.9	174.3	-54.7	0	0	0	0	110.5	L283 V302 T303 N307 L308	L283-C305 HydrophobicContact CB-CB 4.3Å; L283-C305 HydrophobicContact CD2-CB 4.37Å; V302-C305 WeakPolarHBondContact O-CB 3.49Å; V302-C305 PolarHBondContact O-N 3.33Å; T303-C305 PolarHBondContact O-N 3.31Å; T303-C305 VanDerWaalsContact O-N 3.07Å; C305-N307 PolarHBondContact O-N 3.19Å; C305-L308 HydrophobicContact CB-CD1 3.84Å; C305-L308 HydrophobicContact CB-CG 3.81Å; C305-L308 WeakPolarHBondContact O-CB 3.32Å; C305-L308 VanDerWaalsContact O-CG 3.25Å; C305-L308 WeakPolarHBondContact O-CG 3.45Å; C305-L308 PolarHBondContact O-N 3.13Å
306	A	88.7	Confident	90.2	Very high	53 Å²	53	32 Å²	32	44%	0.438	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-17.1	-174.8	0	0	0	0	0	115.3	S304 L308	S304-A306 PolarHBondContact O-N 2.98Å; A306-L308 VanDerWaalsContact C-N 3.28Å; A306-L308 PolarHBondContact O-N 3.17Å
307	N	92.1	Very high	90.2	Very high	69 Å²	69	32.8 Å²	32.8	37%	0.369	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	5.8	177.6	-70.2	-26.5	0	0	0	113.7	V281 L283 C305 Q309	V281-N307 PolarHBondContact O-ND2 2.94Å; L283-N307 CarbonylContact O-C 3.33Å; C305-N307 PolarHBondContact O-N 3.19Å; N307-Q309 PolarHBondContact O-N 3.4Å
308	L	95	Very high	90	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.168	C	C	.	.			trans	-61.2	132	177	-79.8	171.2	0	0	0	111.4	L283 I286 V302 C305 A306 I311 C331	L283-L308 HydrophobicContact CB-CD2 4.5Å; L283-L308 HydrophobicContact CD2-CD2 4.02Å; L283-L308 HydrophobicContact CG-CD2 3.84Å; I286-L308 HydrophobicContact CB-CD2 4.12Å; I286-L308 HydrophobicContact CG2-CD1 4.34Å; I286-L308 HydrophobicContact CG2-CD2 3.83Å; V302-L308 HydrophobicContact CG1-CD1 3.55Å; V302-L308 VanDerWaalsContact O-CD1 3.32Å; V302-L308 WeakPolarHBondContact O-CD1 3.45Å; C305-L308 HydrophobicContact CB-CD1 3.84Å; C305-L308 HydrophobicContact CB-CG 3.81Å; C305-L308 WeakPolarHBondContact O-CB 3.32Å; C305-L308 VanDerWaalsContact O-CG 3.25Å; C305-L308 WeakPolarHBondContact O-CG 3.45Å; C305-L308 PolarHBondContact O-N 3.13Å; A306-L308 VanDerWaalsContact C-N 3.28Å; A306-L308 PolarHBondContact O-N 3.17Å; L308-I311 HydrophobicContact CB-CD1 4.29Å; L308-I311 HydrophobicContact CB-CG1 4.4Å; L308-I311 HydrophobicContact CD1-CD1 4.09Å; L308-I311 HydrophobicContact CD1-CG1 4.33Å; L308-C331 HydrophobicContact CB-CB 4.41Å
309	Q	95.3	Very high	90.2	Very high	46 Å²	46	29.9 Å²	29.9	22%	0.215	17%	0.168	C	C	.	.			trans	-121.4	-23.1	179.3	-63.4	179.5	1.3	0	0	111.4	R284 N307 L333 L335 Y336	R284-Q309 PolarHBondContact O-N 3.25Å; N307-Q309 PolarHBondContact O-N 3.4Å; Q309-L333 HydrophobicContact CG-CB 4.25Å; Q309-L335 HydrophobicContact CB-CD1 4.38Å; Q309-L335 HydrophobicContact CB-CG 4.25Å; Q309-L335 WeakPolarHBondContact O-CA 3.43Å; Q309-L335 PolarHBondContact O-N 3.27Å; Q309-Y336 PolarHBondContact O-N 2.8Å
310	D	96.8	Very high	90.2	Very high	40 Å²	40	33.3 Å²	33.3	21%	0.214	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	116.9	-173.6	176.2	-10.8	0	0	0	109.8	R284 H285 I286 Y336	R284-D310 PolarHBondContact O-N 3.43Å; H285-D310 WeakPolarHBondContact CA-O 3.17Å; H285-D310 HydrophobicContact CB-CB 4.08Å; H285-D310 IonicContact CE1-OD2 3.27Å; H285-D310 IonicContact CG-OD2 3.85Å; H285-D310 WeakPolarHBondContact ND1-CB 3.5Å; H285-D310 IonicContact ND1-OD2 3.42Å; H285-D310 PolarHBondContact ND1-OD2 3.36Å; I286-D310 PolarHBondContact N-O 3.04Å; D310-Y336 WeakPolarHBondContact CA-O 3.31Å; D310-Y336 HydrophobicContact CB-CD1 4.45Å; D310-Y336 HydrophobicContact CB-CG 4.5Å; D310-Y336 WeakPolarHBondContact OD1-CD1 3.39Å; D310-Y336 WeakPolarHBondContact OD1-CE1 3.43Å
311	I	95.7	Very high	90.3	Very high	1 Å²	1	27.7 Å²	27.7	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	116.9	-178.8	-60.4	175.8	0	0	0	108.6	I286 L308 L313 I327 L334 Y336 L337 N338	I286-I311 HydrophobicContact CG2-CB 4.37Å; I286-I311 HydrophobicContact CG2-CG1 3.97Å; I286-I311 HydrophobicContact CG2-CG2 4.3Å; L308-I311 HydrophobicContact CB-CD1 4.29Å; L308-I311 HydrophobicContact CB-CG1 4.4Å; L308-I311 HydrophobicContact CD1-CD1 4.09Å; L308-I311 HydrophobicContact CD1-CG1 4.33Å; I311-L313 HydrophobicContact CG2-CD1 3.68Å; I311-L313 HydrophobicContact CG2-CD2 4.5Å; I311-L313 HydrophobicContact CG2-CG 3.71Å; I311-I327 HydrophobicContact CD1-CG2 3.62Å; I311-L334 HydrophobicContact CB-CD1 4.25Å; I311-L334 HydrophobicContact CD1-CD1 3.68Å; I311-L334 HydrophobicContact CG1-CD1 3.78Å; I311-Y336 PolarHBondContact N-O 3.19Å; I311-L337 HydrophobicContact CB-CD1 3.94Å; I311-L337 HydrophobicContact CG2-CD1 4.06Å; I311-L337 WeakPolarHBondContact O-CA 3.49Å; I311-N338 PolarHBondContact O-N 2.97Å
312	N	94.7	Very high	90.5	Very high	24 Å²	24	31.1 Å²	31.1	13%	0.128	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	110.2	172.3	-171.9	-16.2	0	0	0	110.7	I286 N287 L288 R289 S314 Y336	I286-N312 PolarHBondContact O-N 3.07Å; N287-N312 HydrophobicContact CB-CB 4.47Å; L288-N312 CarbonylContact C-O 3.4Å; L288-N312 WeakPolarHBondContact CA-O 3.36Å; L288-N312 PolarHBondContact N-O 2.94Å; R289-N312 PolarHBondContact N-O 3.43Å; N312-S314 WeakPolarHBondContact OD1-CB 2.92Å; N312-S314 PolarHBondContact OD1-N 3.28Å; N312-S314 PolarHBondContact OD1-OG 2.9Å; N312-Y336 HydrophobicContact CB-CE1 4.45Å
313	L	94	Very high	90.5	Very high	2 Å²	2	31 Å²	31	1%	0.01	19%	0.187	C	C	.	.			trans	-116.9	23.3	177.8	-67.4	165.3	0	0	0	111.4	L288 I311 K315 C316 I319 I327 N338 L339	L288-L313 HydrophobicContact CB-CD2 3.86Å; L288-L313 HydrophobicContact CD1-CD2 3.91Å; I311-L313 HydrophobicContact CG2-CD1 3.68Å; I311-L313 HydrophobicContact CG2-CD2 4.5Å; I311-L313 HydrophobicContact CG2-CG 3.71Å; L313-K315 PolarHBondContact O-N 3.26Å; L313-C316 HydrophobicContact CB-CB 4.46Å; L313-C316 WeakPolarHBondContact O-CB 3.44Å; L313-C316 PolarHBondContact O-N 3.5Å; L313-C316 PolarHBondContact O-SG 3.05Å; L313-C316 VanDerWaalsContact O-SG 3.37Å; L313-I319 HydrophobicContact CB-CG1 4.41Å; L313-I319 HydrophobicContact CD1-CD1 4.06Å; L313-I319 HydrophobicContact CD2-CD1 4.17Å; L313-I327 HydrophobicContact CD1-CD1 3.52Å; L313-N338 CarbonylContact C-O 3.45Å; L313-N338 WeakPolarHBondContact CA-O 3.43Å; L313-N338 PolarHBondContact N-O 2.78Å; L313-L339 HydrophobicContact CB-CD2 4.3Å; L313-L339 HydrophobicContact CD1-CD2 4.21Å
314	S	91.6	Very high	90.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	139.3	179.7	56.4	0	0	0	0	111.6	R289 N290 N312 C316 N338 S340	R289-S314 CarbonylContact C-O 3.53Å; R289-S314 VanDerWaalsContact CA-O 3.27Å; R289-S314 WeakPolarHBondContact CA-O 3.47Å; R289-S314 WeakPolarHBondContact CD-OG 3.49Å; R289-S314 VanDerWaalsContact CG-OG 3.29Å; R289-S314 WeakPolarHBondContact CG-OG 3.47Å; R289-S314 PolarHBondContact NH1-OG 3.07Å; N290-S314 PolarHBondContact N-O 3.14Å; N312-S314 WeakPolarHBondContact OD1-CB 2.92Å; N312-S314 PolarHBondContact OD1-N 3.28Å; N312-S314 PolarHBondContact OD1-OG 2.9Å; S314-C316 PolarHBondContact O-N 3.48Å; S314-N338 PolarHBondContact N-O 3.18Å; S314-S340 CarbonylContact C-O 3.35Å; S314-S340 VanDerWaalsContact CA-O 3.27Å; S314-S340 WeakPolarHBondContact CA-O 3.47Å; S314-S340 WeakPolarHBondContact CB-OG 3.35Å
315	K	86.7	Confident	90.9	Very high	51 Å²	51	33.8 Å²	33.8	22%	0.222	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.7	18.3	-177.8	-51.7	-172.5	173.4	-160.4	0	114.7	N290 L313 T317 S340 Y341	N290-K315 HydrophobicContact CB-CB 4.15Å; L313-K315 PolarHBondContact O-N 3.26Å; K315-T317 PolarHBondContact O-N 3.13Å; K315-S340 PolarHBondContact N-O 3.33Å; K315-Y341 HydrophobicContact CG-CD2 4.03Å; K315-Y341 HydrophobicContact CG-CG 4.15Å
316	C	87.1	Confident	91	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.198	C	C	.	.			trans	-88.5	83.8	172.8	-64.8	0	0	0	0	110	L288 S291 L313 S314 G318 I319	L288-C316 PolarHBondContact O-SG 3.42Å; S291-C316 PolarHBondContact OG-SG 3.43Å; L313-C316 HydrophobicContact CB-CB 4.46Å; L313-C316 WeakPolarHBondContact O-CB 3.44Å; L313-C316 PolarHBondContact O-N 3.5Å; L313-C316 PolarHBondContact O-SG 3.05Å; L313-C316 VanDerWaalsContact O-SG 3.37Å; S314-C316 PolarHBondContact O-N 3.48Å; C316-G318 PolarHBondContact O-N 2.75Å; C316-I319 HydrophobicContact CB-CG1 3.69Å; C316-I319 WeakPolarHBondContact O-CG1 3.35Å; C316-I319 PolarHBondContact O-N 2.87Å; C316-I319 VanDerWaalsContact O-N 3.1Å
317	T	78.6	Confident	91.2	Very high	98 Å²	98	32.5 Å²	32.5	60%	0.601	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-16.5	-168.9	57.9	0	0	0	0	115.1	K315	K315-T317 PolarHBondContact O-N 3.13Å
318	G	80.9	Confident	91.2	Very high	36 Å²	36	29.3 Å²	29.3	37%	0.371	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-0.2	177.9	0	0	0	0	0	114.7	C294 C316 T320	C294-G318 VanDerWaalsContact CB-CA 3.47Å; C294-G318 WeakPolarHBondContact CB-O 3.3Å; C316-G318 PolarHBondContact O-N 2.75Å; G318-T320 PolarHBondContact O-N 3.25Å
319	I	88.1	Confident	91	Very high	2 Å²	2	32.7 Å²	32.7	1%	0.01	18%	0.181	C	C	.	.			trans	-66.1	123.8	177.2	-67.3	-64.6	0	0	0	109.5	C294 I299 L313 C316 A323 V324 L339 T342 I344	C294-I319 HydrophobicContact CB-CD1 4.04Å; C294-I319 HydrophobicContact CB-CG1 4.35Å; I299-I319 HydrophobicContact CD1-CD1 3.64Å; L313-I319 HydrophobicContact CB-CG1 4.41Å; L313-I319 HydrophobicContact CD1-CD1 4.06Å; L313-I319 HydrophobicContact CD2-CD1 4.17Å; C316-I319 HydrophobicContact CB-CG1 3.69Å; C316-I319 WeakPolarHBondContact O-CG1 3.35Å; C316-I319 PolarHBondContact O-N 2.87Å; C316-I319 VanDerWaalsContact O-N 3.1Å; I319-A323 HydrophobicContact CD1-CB 4.38Å; I319-A323 HydrophobicContact CG2-CB 4.36Å; I319-V324 HydrophobicContact CG2-CG2 3.89Å; I319-L339 HydrophobicContact CG2-CD2 4.36Å; I319-T342 HydrophobicContact CB-CG2 4.21Å; I319-T342 HydrophobicContact CG1-CG2 4.45Å; I319-I344 HydrophobicContact CG2-CG2 3.94Å
320	T	88.1	Confident	90.9	Very high	74 Å²	74	35 Å²	35	45%	0.454	19%	0.192	S	C	.	.			trans	-104.7	166.7	178	62.4	0	0	0	0	111.4	G318 D322 A323 V324	G318-T320 PolarHBondContact O-N 3.25Å; T320-D322 PolarHBondContact O-N 2.64Å; T320-A323 WeakPolarHBondContact O-CB 2.98Å; T320-A323 PolarHBondContact O-N 3.3Å; T320-A323 PolarHBondContact OG1-N 2.57Å; T320-V324 PolarHBondContact O-N 2.9Å; T320-V324 VanDerWaalsContact O-N 3.17Å
321	D	92.6	Very high	90.6	Very high	29 Å²	29	33.1 Å²	33.1	16%	0.155	18%	0.182	C	C	.	.	H	α-helix	trans	-61	-33.8	175.5	-57.4	-46.4	0	0	0	112.3	A323 V324 R325 T345 D347 S348	D321-A323 PolarHBondContact O-N 3.48Å; D321-V324 PolarHBondContact O-N 3.39Å; D321-R325 WeakPolarHBondContact O-CB 3.37Å; D321-R325 PolarHBondContact O-N 3.16Å; D321-T345 VanDerWaalsContact CG-OG1 3.29Å; D321-T345 PolarHBondContact OD1-N 3.4Å; D321-T345 PolarHBondContact OD1-OG1 3Å; D321-T345 WeakPolarHBondContact OD2-CB 3.17Å; D321-T345 PolarHBondContact OD2-OG1 3.19Å; D321-D347 HydrophobicContact CB-CB 4.18Å; D321-S348 WeakPolarHBondContact CA-OG 3.29Å; D321-S348 VanDerWaalsContact OD1-CB 3.28Å; D321-S348 WeakPolarHBondContact OD1-CB 3.48Å; D321-S348 PolarHBondContact OD1-N 3.23Å; D321-S348 PolarHBondContact OD1-OG 2.59Å
322	D	91.1	Very high	90.2	Very high	86 Å²	86	36.9 Å²	36.9	46%	0.46	21%	0.208	S	C	.	.	H	α-helix	trans	-64.2	-36.3	173	-99.7	-39.5	0	0	0	113.5	T320 R325 L326	T320-D322 PolarHBondContact O-N 2.64Å; D322-R325 WeakPolarHBondContact O-CB 3.48Å; D322-R325 PolarHBondContact O-N 3.33Å; D322-R325 IonicContact OD1-CZ 3.68Å; D322-R325 IonicContact OD1-NE 3.48Å; D322-R325 PolarHBondContact OD1-NE 3.18Å; D322-R325 IonicContact OD1-NH2 3.9Å; D322-R325 PolarHBondContact OD1-NH2 3.44Å; D322-L326 PolarHBondContact O-N 2.96Å
323	A	91.6	Very high	90	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.008	22%	0.221	C	C	.	.	H	α-helix	trans	-65.2	-43.7	174.3	0	0	0	0	0	110.7	I299 I319 T320 D321 L326 I327	I299-A323 HydrophobicContact CD1-CB 4.31Å; I299-A323 HydrophobicContact CG1-CB 3.82Å; I299-A323 HydrophobicContact CG2-CB 4.32Å; I319-A323 HydrophobicContact CD1-CB 4.38Å; I319-A323 HydrophobicContact CG2-CB 4.36Å; T320-A323 WeakPolarHBondContact O-CB 2.98Å; T320-A323 PolarHBondContact O-N 3.3Å; T320-A323 PolarHBondContact OG1-N 2.57Å; D321-A323 PolarHBondContact O-N 3.48Å; A323-L326 PolarHBondContact O-N 2.92Å; A323-I327 VanDerWaalsContact O-CG1 3.3Å; A323-I327 WeakPolarHBondContact O-CG1 3.26Å; A323-I327 PolarHBondContact O-N 2.91Å
324	V	94.3	Very high	90	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64.1	-42.5	175.9	178.2	0	0	0	0	110.7	I319 T320 D321 L326 I327 T328 L339 I344 S348 L352	I319-V324 HydrophobicContact CG2-CG2 3.89Å; T320-V324 PolarHBondContact O-N 2.9Å; T320-V324 VanDerWaalsContact O-N 3.17Å; D321-V324 PolarHBondContact O-N 3.39Å; V324-L326 VanDerWaalsContact C-N 3.34Å; V324-L326 PolarHBondContact O-N 2.86Å; V324-I327 PolarHBondContact O-N 3.19Å; V324-T328 HydrophobicContact CG1-CG2 4.06Å; V324-T328 WeakPolarHBondContact O-CB 3.5Å; V324-T328 WeakPolarHBondContact O-CG2 3.37Å; V324-T328 PolarHBondContact O-N 3.36Å; V324-T328 PolarHBondContact O-OG1 3.14Å; V324-L339 HydrophobicContact CG1-CD1 4.4Å; V324-L339 HydrophobicContact CG2-CD1 4.03Å; V324-L339 HydrophobicContact CG2-CD2 4.17Å; V324-I344 HydrophobicContact CG2-CG2 3.97Å; V324-S348 WeakPolarHBondContact CG2-OG 3.25Å; V324-L352 HydrophobicContact CG1-CD1 4.48Å; V324-L352 HydrophobicContact CG1-CD2 4.22Å; V324-L352 HydrophobicContact CG1-CG 4.03Å
325	R	94.1	Very high	90.2	Very high	98 Å²	98	41.7 Å²	41.7	37%	0.37	23%	0.233	S	C	.	.	H	α-helix	trans	-54.2	-50.1	172.9	-175.5	-179.1	63.8	81.2	-0.8	111.5	D321 D322 I327 T328 V329 H351	D321-R325 WeakPolarHBondContact O-CB 3.37Å; D321-R325 PolarHBondContact O-N 3.16Å; D322-R325 WeakPolarHBondContact O-CB 3.48Å; D322-R325 PolarHBondContact O-N 3.33Å; D322-R325 IonicContact OD1-CZ 3.68Å; D322-R325 IonicContact OD1-NE 3.48Å; D322-R325 PolarHBondContact OD1-NE 3.18Å; D322-R325 IonicContact OD1-NH2 3.9Å; D322-R325 PolarHBondContact OD1-NH2 3.44Å; R325-I327 PolarHBondContact O-N 3.26Å; R325-T328 PolarHBondContact O-N 3.49Å; R325-T328 PolarHBondContact O-OG1 2.89Å; R325-V329 HydrophobicContact CG-CG2 4.49Å; R325-V329 WeakPolarHBondContact O-CB 3.35Å; R325-V329 VanDerWaalsContact O-CG2 3.26Å; R325-V329 WeakPolarHBondContact O-CG2 3.28Å; R325-V329 PolarHBondContact O-N 3.04Å; R325-H351 HydrophobicContact CB-CB 4.38Å; R325-H351 VanDerWaalsContact CD-CE1 3.42Å; R325-H351 WeakPolarHBondContact CD-CE1 3.48Å
326	L	93.2	Very high	90.7	Very high	23 Å²	23	41.8 Å²	41.8	12%	0.12	23%	0.232	C	C	.	.	H	α-helix	trans	-63.3	-43.5	-179.8	-171.3	65.8	0	0	0	111.8	L296 I299 R300 T303 D322 A323 V324 T328 V329 E330	L296-L326 HydrophobicContact CD1-CD2 4.11Å; I299-L326 HydrophobicContact CG2-CB 4.36Å; I299-L326 HydrophobicContact CG2-CD2 4.02Å; R300-L326 HydrophobicContact CG-CD2 3.6Å; T303-L326 HydrophobicContact CG2-CG 4.22Å; D322-L326 PolarHBondContact O-N 2.96Å; A323-L326 PolarHBondContact O-N 2.92Å; V324-L326 VanDerWaalsContact C-N 3.34Å; V324-L326 PolarHBondContact O-N 2.86Å; L326-T328 VanDerWaalsContact C-N 3.34Å; L326-T328 PolarHBondContact O-N 3.38Å; L326-V329 PolarHBondContact O-N 3.14Å; L326-E330 HydrophobicContact CD1-CG 3.85Å; L326-E330 HydrophobicContact CG-CG 4.28Å; L326-E330 WeakPolarHBondContact O-CB 3.43Å; L326-E330 VanDerWaalsContact O-CG 3.27Å; L326-E330 WeakPolarHBondContact O-CG 3.47Å; L326-E330 PolarHBondContact O-N 3.22Å
327	I	93.7	Very high	91.1	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-57.7	-49.6	176.3	-70.9	163.4	0	0	0	110.9	I299 T303 I311 L313 A323 V324 R325 V329 C331 L334	I299-I327 HydrophobicContact CD1-CD1 4.45Å; I299-I327 HydrophobicContact CG2-CD1 4.12Å; I299-I327 HydrophobicContact CG2-CG1 3.73Å; T303-I327 HydrophobicContact CG2-CB 4.38Å; T303-I327 HydrophobicContact CG2-CG1 3.92Å; I311-I327 HydrophobicContact CD1-CG2 3.62Å; L313-I327 HydrophobicContact CD1-CD1 3.52Å; A323-I327 VanDerWaalsContact O-CG1 3.3Å; A323-I327 WeakPolarHBondContact O-CG1 3.26Å; A323-I327 PolarHBondContact O-N 2.91Å; V324-I327 PolarHBondContact O-N 3.19Å; R325-I327 PolarHBondContact O-N 3.26Å; I327-V329 PolarHBondContact O-N 2.77Å; I327-C331 WeakPolarHBondContact O-CB 3.33Å; I327-C331 PolarHBondContact O-N 2.87Å; I327-L334 HydrophobicContact CG2-CD2 4.16Å
328	T	91.6	Very high	92	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.012	21%	0.207	C	C	.	.	H	α-helix	trans	-71.4	-31.3	-173.2	58.8	0	0	0	0	112.7	V324 R325 L326 L352 N355 T356	V324-T328 HydrophobicContact CG1-CG2 4.06Å; V324-T328 WeakPolarHBondContact O-CB 3.5Å; V324-T328 WeakPolarHBondContact O-CG2 3.37Å; V324-T328 PolarHBondContact O-N 3.36Å; V324-T328 PolarHBondContact O-OG1 3.14Å; R325-T328 PolarHBondContact O-N 3.49Å; R325-T328 PolarHBondContact O-OG1 2.89Å; L326-T328 VanDerWaalsContact C-N 3.34Å; L326-T328 PolarHBondContact O-N 3.38Å; T328-L352 HydrophobicContact CG2-CD2 3.47Å; T328-L352 VanDerWaalsContact CG2-CD2 3.47Å; T328-L352 HydrophobicContact CG2-CG 4.19Å; T328-N355 WeakPolarHBondContact O-CB 3.27Å; T328-N355 PolarHBondContact OG1-ND2 2.66Å; T328-N355 VanDerWaalsContact OG1-ND2 3.13Å; T328-T356 HydrophobicContact CG2-CG2 3.58Å
329	V	91.8	Very high	92.7	Very high	72 Å²	72	36 Å²	36	44%	0.436	19%	0.19	S	C	.	.	H	α-helix	trans	-72.5	-46.8	174.9	170.8	0	0	0	0	111.8	R325 L326 I327 N355	R325-V329 HydrophobicContact CG-CG2 4.49Å; R325-V329 WeakPolarHBondContact O-CB 3.35Å; R325-V329 VanDerWaalsContact O-CG2 3.26Å; R325-V329 WeakPolarHBondContact O-CG2 3.28Å; R325-V329 PolarHBondContact O-N 3.04Å; L326-V329 PolarHBondContact O-N 3.14Å; I327-V329 PolarHBondContact O-N 2.77Å; V329-N355 WeakPolarHBondContact CG2-ND2 3.41Å
330	E	91.7	Very high	93	Very high	94 Å²	94	36.3 Å²	36.3	44%	0.439	19%	0.192	S	C	.	.	H	α-helix	trans	-84.3	-33.2	-171.3	-61.1	-66.7	159.4	0	0	112.6	T303 L326 S332	T303-E330 HydrophobicContact CG2-CB 4.16Å; L326-E330 HydrophobicContact CD1-CG 3.85Å; L326-E330 HydrophobicContact CG-CG 4.28Å; L326-E330 WeakPolarHBondContact O-CB 3.43Å; L326-E330 VanDerWaalsContact O-CG 3.27Å; L326-E330 WeakPolarHBondContact O-CG 3.47Å; L326-E330 PolarHBondContact O-N 3.22Å; E330-S332 PolarHBondContact O-N 2.85Å
331	C	91.5	Very high	93.1	Very high	1 Å²	1	35 Å²	35	1%	0.007	18%	0.179	C	C	.	.			trans	-95.4	67.2	-179.5	-54.9	0	0	0	0	110.8	L308 I327 L333 L334	L308-C331 HydrophobicContact CB-CB 4.41Å; I327-C331 WeakPolarHBondContact O-CB 3.33Å; I327-C331 PolarHBondContact O-N 2.87Å; C331-L333 PolarHBondContact O-N 3.43Å; C331-L334 WeakPolarHBondContact O-CB 3.31Å; C331-L334 PolarHBondContact O-N 2.64Å; C331-L334 VanDerWaalsContact O-N 3.13Å
332	S	87.2	Confident	93	Very high	80 Å²	80	33.6 Å²	33.6	56%	0.559	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-16.5	-175.4	61	0	0	0	0	115.6	E330	E330-S332 PolarHBondContact O-N 2.85Å
333	L	90.7	Very high	92.7	Very high	75 Å²	75	31.4 Å²	31.4	39%	0.393	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	14.9	179.9	-59.2	-180	0	0	0	113.5	Q309 C331 L335	Q309-L333 HydrophobicContact CG-CB 4.25Å; C331-L333 PolarHBondContact O-N 3.43Å; L333-L335 PolarHBondContact O-N 2.79Å
334	L	93.5	Very high	92.8	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.01	16%	0.158	C	C	.	.			trans	-61.9	122.9	-176.1	-162.8	67	0	0	0	111.9	I311 I327 C331 Y336 L337 T356 M358 L359	I311-L334 HydrophobicContact CB-CD1 4.25Å; I311-L334 HydrophobicContact CD1-CD1 3.68Å; I311-L334 HydrophobicContact CG1-CD1 3.78Å; I327-L334 HydrophobicContact CG2-CD2 4.16Å; C331-L334 WeakPolarHBondContact O-CB 3.31Å; C331-L334 PolarHBondContact O-N 2.64Å; C331-L334 VanDerWaalsContact O-N 3.13Å; L334-Y336 WeakPolarHBondContact CD1-O 3.35Å; L334-L337 HydrophobicContact CD2-CB 4.05Å; L334-L337 HydrophobicContact CD2-CD1 4.33Å; L334-L337 HydrophobicContact CD2-CD2 4.04Å; L334-L337 HydrophobicContact CD2-CG 4.36Å; L334-T356 HydrophobicContact CD2-CG2 4.28Å; L334-M358 CarbonylContact O-C 3.41Å; L334-L359 HydrophobicContact CD2-CD1 4.2Å; L334-L359 HydrophobicContact CG-CD1 4.01Å; L334-L359 WeakPolarHBondContact O-CA 3.4Å; L334-L359 PolarHBondContact O-N 3.09Å
335	L	95.6	Very high	92.8	Very high	49 Å²	49	33.3 Å²	33.3	26%	0.257	17%	0.17	S	C	.	.			trans	-111	-32.9	178.1	-56.5	-177.1	0	0	0	111.8	Q309 L333 M358 Q360 Y361	Q309-L335 HydrophobicContact CB-CD1 4.38Å; Q309-L335 HydrophobicContact CB-CG 4.25Å; Q309-L335 WeakPolarHBondContact O-CA 3.43Å; Q309-L335 PolarHBondContact O-N 3.27Å; L333-L335 PolarHBondContact O-N 2.79Å; L335-M358 HydrophobicContact CD2-CB 3.7Å; L335-M358 WeakPolarHBondContact CD2-O 3.22Å; L335-Q360 WeakPolarHBondContact O-CA 3.38Å; L335-Q360 PolarHBondContact O-N 3.08Å; L335-Y361 PolarHBondContact O-N 3.36Å
336	Y	97.1	Very high	92.8	Very high	53 Å²	53	29.3 Å²	29.3	21%	0.208	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	128	-177.9	177.8	-72.3	0	0	0	110.4	Q309 D310 I311 N312 L334 N338 Y361	Q309-Y336 PolarHBondContact O-N 2.8Å; D310-Y336 WeakPolarHBondContact CA-O 3.31Å; D310-Y336 HydrophobicContact CB-CD1 4.45Å; D310-Y336 HydrophobicContact CB-CG 4.5Å; D310-Y336 WeakPolarHBondContact OD1-CD1 3.39Å; D310-Y336 WeakPolarHBondContact OD1-CE1 3.43Å; I311-Y336 PolarHBondContact N-O 3.19Å; N312-Y336 HydrophobicContact CB-CE1 4.45Å; L334-Y336 WeakPolarHBondContact CD1-O 3.35Å; Y336-N338 HydrophobicContact CE1-CB 3.75Å; Y336-Y361 HydrophobicContact CD1-CD1 4.38Å; Y336-Y361 AromaticContact CD2-CD1 3.28Å; Y336-Y361 HydrophobicContact CD2-CD1 3.28Å; Y336-Y361 AromaticContact CD2-CD2 3.76Å; Y336-Y361 HydrophobicContact CD2-CD2 3.76Å; Y336-Y361 AromaticContact CD2-CE1 3.89Å; Y336-Y361 HydrophobicContact CD2-CE1 3.89Å; Y336-Y361 HydrophobicContact CD2-CE2 4.27Å; Y336-Y361 AromaticContact CD2-CG 3.23Å; Y336-Y361 HydrophobicContact CD2-CG 3.23Å; Y336-Y361 HydrophobicContact CE1-CD1 4.3Å; Y336-Y361 HydrophobicContact CE1-CE1 4.33Å; Y336-Y361 AromaticContact CE2-CD1 3.17Å; Y336-Y361 HydrophobicContact CE2-CD1 3.17Å; Y336-Y361 AromaticContact CE2-CD2 3.66Å; Y336-Y361 HydrophobicContact CE2-CD2 3.66Å; Y336-Y361 AromaticContact CE2-CE1 3.23Å; Y336-Y361 HydrophobicContact CE2-CE1 3.23Å; Y336-Y361 AromaticContact CE2-CE2 3.68Å; Y336-Y361 HydrophobicContact CE2-CE2 3.68Å; Y336-Y361 AromaticContact CE2-CG 3.42Å; Y336-Y361 HydrophobicContact CE2-CG 3.42Å; Y336-Y361 VanDerWaalsContact CE2-CG 3.42Å; Y336-Y361 AromaticContact CE2-CZ 3.48Å; Y336-Y361 VanDerWaalsContact CE2-CZ 3.48Å; Y336-Y361 AromaticContact CG-CD1 3.91Å; Y336-Y361 HydrophobicContact CG-CD1 3.91Å; Y336-Y361 HydrophobicContact CG-CG 4.1Å; Y336-Y361 AromaticContact CZ-CD1 3.72Å; Y336-Y361 AromaticContact CZ-CE1 3.49Å; Y336-Y361 VanDerWaalsContact CZ-CE1 3.49Å; Y336-Y361 AromaticContact CZ-CZ 3.96Å
337	L	96.9	Very high	92.9	Very high	1 Å²	1	30.7 Å²	30.7	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	124	173	-174.4	62.2	0	0	0	110.9	I311 L334 L339 L352 L359 Y361 L362 S363	I311-L337 HydrophobicContact CB-CD1 3.94Å; I311-L337 HydrophobicContact CG2-CD1 4.06Å; I311-L337 WeakPolarHBondContact O-CA 3.49Å; L334-L337 HydrophobicContact CD2-CB 4.05Å; L334-L337 HydrophobicContact CD2-CD1 4.33Å; L334-L337 HydrophobicContact CD2-CD2 4.04Å; L334-L337 HydrophobicContact CD2-CG 4.36Å; L337-L339 HydrophobicContact CD1-CD2 4.18Å; L337-L339 HydrophobicContact CD1-CG 4.34Å; L337-L339 HydrophobicContact CD2-CD1 3.85Å; L337-L339 HydrophobicContact CD2-CD2 4.49Å; L337-L339 HydrophobicContact CD2-CG 4.11Å; L337-L339 HydrophobicContact CG-CD1 4.25Å; L337-L339 HydrophobicContact CG-CD2 4.33Å; L337-L339 HydrophobicContact CG-CG 3.96Å; L337-L352 HydrophobicContact CD2-CD2 3.32Å; L337-L359 HydrophobicContact CB-CD1 4Å; L337-Y361 PolarHBondContact N-O 3.28Å; L337-L362 HydrophobicContact CB-CD1 4.4Å; L337-L362 HydrophobicContact CD2-CD1 4.48Å; L337-L362 WeakPolarHBondContact O-CA 3.42Å; L337-S363 PolarHBondContact O-N 2.85Å
338	N	96.7	Very high	92.9	Very high	13 Å²	13	30.6 Å²	30.6	7%	0.07	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	112.6	173.7	-169.1	-32	0	0	0	110.4	I311 L313 S314 Y336 S340 S363	I311-N338 PolarHBondContact O-N 2.97Å; L313-N338 CarbonylContact C-O 3.45Å; L313-N338 WeakPolarHBondContact CA-O 3.43Å; L313-N338 PolarHBondContact N-O 2.78Å; S314-N338 PolarHBondContact N-O 3.18Å; Y336-N338 HydrophobicContact CE1-CB 3.75Å; N338-S340 VanDerWaalsContact OD1-CB 3.32Å; N338-S340 WeakPolarHBondContact OD1-CB 3.41Å; N338-S340 PolarHBondContact OD1-N 2.87Å; N338-S340 PolarHBondContact OD1-OG 3.14Å; N338-S363 PolarHBondContact OD1-OG 2.87Å
339	L	95.9	Very high	93.1	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.163	C	C	.	.			trans	-112.5	17.5	178.4	-61.6	170.8	0	0	0	111.5	L313 I319 V324 L337 T342 I344 L352 S363 L364 C367	L313-L339 HydrophobicContact CB-CD2 4.3Å; L313-L339 HydrophobicContact CD1-CD2 4.21Å; I319-L339 HydrophobicContact CG2-CD2 4.36Å; V324-L339 HydrophobicContact CG1-CD1 4.4Å; V324-L339 HydrophobicContact CG2-CD1 4.03Å; V324-L339 HydrophobicContact CG2-CD2 4.17Å; L337-L339 HydrophobicContact CD1-CD2 4.18Å; L337-L339 HydrophobicContact CD1-CG 4.34Å; L337-L339 HydrophobicContact CD2-CD1 3.85Å; L337-L339 HydrophobicContact CD2-CD2 4.49Å; L337-L339 HydrophobicContact CD2-CG 4.11Å; L337-L339 HydrophobicContact CG-CD1 4.25Å; L337-L339 HydrophobicContact CG-CD2 4.33Å; L337-L339 HydrophobicContact CG-CG 3.96Å; L339-T342 WeakPolarHBondContact O-CB 3.3Å; L339-T342 WeakPolarHBondContact O-CG2 3.01Å; L339-T342 PolarHBondContact O-N 3.22Å; L339-T342 PolarHBondContact O-OG1 3.49Å; L339-I344 HydrophobicContact CB-CD1 3.9Å; L339-I344 HydrophobicContact CD1-CD1 3.69Å; L339-I344 HydrophobicContact CG-CD1 4.41Å; L339-L352 HydrophobicContact CD1-CD1 4.22Å; L339-S363 PolarHBondContact N-O 3.03Å; L339-L364 HydrophobicContact CB-CD2 4.44Å; L339-L364 HydrophobicContact CD1-CD2 4.23Å; L339-C367 PolarHBondContact O-SG 3.25Å
340	S	94.1	Very high	93.1	Very high	8 Å²	8	31.3 Å²	31.3	6%	0.056	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	145	-175.6	54.9	0	0	0	0	112.4	S314 K315 N338 T342 S363 A365	S314-S340 CarbonylContact C-O 3.35Å; S314-S340 VanDerWaalsContact CA-O 3.27Å; S314-S340 WeakPolarHBondContact CA-O 3.47Å; S314-S340 WeakPolarHBondContact CB-OG 3.35Å; K315-S340 PolarHBondContact N-O 3.33Å; N338-S340 VanDerWaalsContact OD1-CB 3.32Å; N338-S340 WeakPolarHBondContact OD1-CB 3.41Å; N338-S340 PolarHBondContact OD1-N 2.87Å; N338-S340 PolarHBondContact OD1-OG 3.14Å; S340-T342 VanDerWaalsContact C-N 3.26Å; S340-T342 PolarHBondContact O-N 3Å; S340-S363 PolarHBondContact N-O 3.45Å; S340-A365 CarbonylContact C-O 3.4Å; S340-A365 WeakPolarHBondContact CA-O 3.44Å; S340-A365 WeakPolarHBondContact CB-O 3.3Å
341	Y	89.7	Confident	93.1	Very high	45 Å²	45	27.7 Å²	27.7	18%	0.176	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	37.3	-177.1	-57.6	-87.3	0	0	0	113.7	K315 A365 Y366 H465	K315-Y341 HydrophobicContact CG-CD2 4.03Å; K315-Y341 HydrophobicContact CG-CG 4.15Å; Y341-A365 PolarHBondContact N-O 2.84Å; Y341-Y366 HydrophobicContact CD1-CD2 4.27Å; Y341-Y366 HydrophobicContact CD1-CG 4.07Å; Y341-Y366 HydrophobicContact CD2-CD2 4.23Å; Y341-Y366 HydrophobicContact CE1-CD1 4.12Å; Y341-Y366 AromaticContact CE1-CD2 3.56Å; Y341-Y366 HydrophobicContact CE1-CD2 3.56Å; Y341-Y366 HydrophobicContact CE1-CE2 4.22Å; Y341-Y366 AromaticContact CE1-CG 3.48Å; Y341-Y366 HydrophobicContact CE1-CG 3.48Å; Y341-Y366 VanDerWaalsContact CE1-CG 3.48Å; Y341-Y366 AromaticContact CE2-CD2 3.53Å; Y341-Y366 HydrophobicContact CE2-CD2 3.53Å; Y341-Y366 HydrophobicContact CE2-CE2 4.02Å; Y341-Y366 HydrophobicContact CE2-CG 4.28Å; Y341-Y366 AromaticContact CZ-CD2 3.12Å; Y341-Y366 AromaticContact CZ-CE2 3.51Å; Y341-Y366 AromaticContact CZ-CG 3.6Å; Y341-Y366 WeakPolarHBondContact OH-CD2 3.23Å; Y341-Y366 WeakPolarHBondContact OH-CE2 3.49Å; Y341-H465 HydrophobicContact CE1-CB 4.48Å; Y341-H465 AromaticContact CZ-ND1 3.63Å; Y341-H465 PolarHBondContact OH-CE1 2.57Å; Y341-H465 VanDerWaalsContact OH-CE1 3.31Å; Y341-H465 PolarHBondContact OH-ND1 3.23Å
342	T	90.2	Very high	93.2	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.14	C	C	.	.			trans	-107.3	170.7	170.7	64.2	0	0	0	0	110.7	I319 L339 S340 I344	I319-T342 HydrophobicContact CB-CG2 4.21Å; I319-T342 HydrophobicContact CG1-CG2 4.45Å; L339-T342 WeakPolarHBondContact O-CB 3.3Å; L339-T342 WeakPolarHBondContact O-CG2 3.01Å; L339-T342 PolarHBondContact O-N 3.22Å; L339-T342 PolarHBondContact O-OG1 3.49Å; S340-T342 VanDerWaalsContact C-N 3.26Å; S340-T342 PolarHBondContact O-N 3Å; T342-I344 VanDerWaalsContact C-N 3.35Å
343	Q	86.2	Confident	93.2	Very high	40 Å²	40	24 Å²	24	19%	0.187	11%	0.114	C	C	.	.			trans	-100.6	26.7	-178.8	-62	-66.1	-28.4	0	0	112.1	R369	Q343-R369 WeakPolarHBondContact O-CD 3.34Å
344	I	92.4	Very high	93	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	11%	0.114	C	C	.	.			trans	-65.8	152	177.9	62.4	173.4	0	0	0	111.3	I319 V324 L339 T342 S348 L364 C367 R369	I319-I344 HydrophobicContact CG2-CG2 3.94Å; V324-I344 HydrophobicContact CG2-CG2 3.97Å; L339-I344 HydrophobicContact CB-CD1 3.9Å; L339-I344 HydrophobicContact CD1-CD1 3.69Å; L339-I344 HydrophobicContact CG-CD1 4.41Å; T342-I344 VanDerWaalsContact C-N 3.35Å; I344-S348 WeakPolarHBondContact CB-OG 3.45Å; I344-S348 WeakPolarHBondContact CG2-OG 3.36Å; I344-L364 HydrophobicContact CD1-CD2 3.74Å; I344-C367 HydrophobicContact CD1-CB 4.27Å; I344-C367 HydrophobicContact CG1-CB 3.89Å; I344-R369 WeakPolarHBondContact O-CB 3.44Å
345	T	94.4	Very high	92.7	Very high	41 Å²	41	26 Å²	26	25%	0.252	13%	0.125	S	C	.	.	B	Isolated β-bridge	trans	-112.2	-176.5	178.2	76.9	0	0	0	0	110.9	D321 D347 S348 R369 L370	D321-T345 VanDerWaalsContact CG-OG1 3.29Å; D321-T345 PolarHBondContact OD1-N 3.4Å; D321-T345 PolarHBondContact OD1-OG1 3Å; D321-T345 WeakPolarHBondContact OD2-CB 3.17Å; D321-T345 PolarHBondContact OD2-OG1 3.19Å; T345-D347 PolarHBondContact O-N 2.88Å; T345-D347 VanDerWaalsContact O-N 3.1Å; T345-D347 PolarHBondContact OG1-N 2.94Å; T345-S348 WeakPolarHBondContact O-CB 3.16Å; T345-S348 PolarHBondContact O-N 2.68Å; T345-S348 VanDerWaalsContact O-N 3.1Å; T345-R369 HydrophobicContact CG2-CB 4.2Å; T345-L370 WeakPolarHBondContact O-CD2 3.21Å
346	D	94.7	Very high	92.3	Very high	14 Å²	14	24 Å²	24	8%	0.075	12%	0.115	C	C	.	.	H	α-helix	trans	-57.7	-23.2	177.2	-53.5	-45.5	0	0	0	112.5	V349 R350 L370 T371 L373 C374 Y377	D346-V349 WeakPolarHBondContact O-CB 3.42Å; D346-V349 PolarHBondContact O-N 3.24Å; D346-R350 PolarHBondContact O-N 3.4Å; D346-L370 WeakPolarHBondContact OD1-CA 3.48Å; D346-T371 PolarHBondContact OD1-N 3.08Å; D346-T371 PolarHBondContact OD2-OG1 3.03Å; D346-L373 HydrophobicContact CB-CB 4.44Å; D346-L373 HydrophobicContact CB-CD2 4.3Å; D346-L373 HydrophobicContact CB-CG 4.44Å; D346-C374 HydrophobicContact CB-CB 4.17Å; D346-C374 VanDerWaalsContact OD1-CB 3.26Å; D346-C374 WeakPolarHBondContact OD1-CB 3.33Å; D346-C374 PolarHBondContact OD1-N 3.48Å; D346-Y377 HydrophobicContact CB-CE2 3.97Å; D346-Y377 WeakPolarHBondContact O-CD2 3.36Å; D346-Y377 WeakPolarHBondContact O-CE2 3.35Å
347	D	95.2	Very high	91.7	Very high	53 Å²	53	28.6 Å²	28.6	28%	0.283	14%	0.136	S	C	.	.	H	α-helix	trans	-68.2	-33.5	177.4	-163.3	51.2	0	0	0	112.7	D321 T345 V349 R350 H351	D321-D347 HydrophobicContact CB-CB 4.18Å; T345-D347 PolarHBondContact O-N 2.88Å; T345-D347 VanDerWaalsContact O-N 3.1Å; T345-D347 PolarHBondContact OG1-N 2.94Å; D347-V349 VanDerWaalsContact C-N 3.29Å; D347-V349 PolarHBondContact O-N 3.12Å; D347-R350 WeakPolarHBondContact O-CB 3.41Å; D347-R350 PolarHBondContact O-N 2.87Å; D347-R350 IonicContact OD1-CZ 2.81Å; D347-R350 IonicContact OD1-NE 3.21Å; D347-R350 PolarHBondContact OD1-NE 3.11Å; D347-R350 IonicContact OD1-NH2 3.27Å; D347-R350 PolarHBondContact OD1-NH2 3.09Å; D347-R350 IonicContact OD2-NH2 3.75Å; D347-H351 PolarHBondContact O-CD2 3.14Å; D347-H351 PolarHBondContact O-N 3.14Å; D347-H351 IonicContact OD2-CD2 3.8Å; D347-H351 IonicContact OD2-NE2 2.82Å; D347-H351 PolarHBondContact OD2-NE2 3.32Å
348	S	94.9	Very high	91.3	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-59.1	-41.8	169.6	-81.3	0	0	0	0	111.9	D321 V324 I344 T345 R350 H351 L352	D321-S348 WeakPolarHBondContact CA-OG 3.29Å; D321-S348 VanDerWaalsContact OD1-CB 3.28Å; D321-S348 WeakPolarHBondContact OD1-CB 3.48Å; D321-S348 PolarHBondContact OD1-N 3.23Å; D321-S348 PolarHBondContact OD1-OG 2.59Å; V324-S348 WeakPolarHBondContact CG2-OG 3.25Å; I344-S348 WeakPolarHBondContact CB-OG 3.45Å; I344-S348 WeakPolarHBondContact CG2-OG 3.36Å; T345-S348 WeakPolarHBondContact O-CB 3.16Å; T345-S348 PolarHBondContact O-N 2.68Å; T345-S348 VanDerWaalsContact O-N 3.1Å; S348-R350 VanDerWaalsContact C-N 3.34Å; S348-H351 PolarHBondContact O-N 3.03Å; S348-L352 VanDerWaalsContact O-CG 3.31Å; S348-L352 WeakPolarHBondContact O-CG 3.46Å; S348-L352 PolarHBondContact O-N 3.49Å
349	V	93.9	Very high	91.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64.9	-42	177.9	-179.7	0	0	0	0	110.2	D346 D347 H351 L352 V353 L364 L370 C374 F378	D346-V349 WeakPolarHBondContact O-CB 3.42Å; D346-V349 PolarHBondContact O-N 3.24Å; D347-V349 VanDerWaalsContact C-N 3.29Å; D347-V349 PolarHBondContact O-N 3.12Å; V349-H351 VanDerWaalsContact C-N 3.3Å; V349-H351 PolarHBondContact O-N 3.44Å; V349-L352 WeakPolarHBondContact O-CB 3.48Å; V349-L352 PolarHBondContact O-N 2.92Å; V349-V353 HydrophobicContact CG1-CG2 4.36Å; V349-V353 WeakPolarHBondContact O-CG2 3.38Å; V349-V353 PolarHBondContact O-N 3.18Å; V349-L364 HydrophobicContact CG2-CD1 4.18Å; V349-L370 HydrophobicContact CG2-CD2 3.7Å; V349-C374 HydrophobicContact CB-CB 4.22Å; V349-C374 HydrophobicContact CG1-CB 4.26Å; V349-C374 HydrophobicContact CG2-CB 4.06Å; V349-F378 HydrophobicContact CG1-CD2 3.84Å; V349-F378 HydrophobicContact CG1-CE2 3.51Å; V349-F378 HydrophobicContact CG1-CZ 4.4Å
350	R	92.8	Very high	91.1	Very high	89 Å²	89	36.8 Å²	36.8	34%	0.336	18%	0.175	S	C	.	.	H	α-helix	trans	-54.9	-46	173.1	-171.1	-179.2	68.3	102.3	-1	111.6	D346 D347 S348 V353 I354 Y377	D346-R350 PolarHBondContact O-N 3.4Å; D347-R350 WeakPolarHBondContact O-CB 3.41Å; D347-R350 PolarHBondContact O-N 2.87Å; D347-R350 IonicContact OD1-CZ 2.81Å; D347-R350 IonicContact OD1-NE 3.21Å; D347-R350 PolarHBondContact OD1-NE 3.11Å; D347-R350 IonicContact OD1-NH2 3.27Å; D347-R350 PolarHBondContact OD1-NH2 3.09Å; D347-R350 IonicContact OD2-NH2 3.75Å; S348-R350 VanDerWaalsContact C-N 3.34Å; R350-V353 PolarHBondContact O-N 3.1Å; R350-I354 HydrophobicContact CG-CD1 3.91Å; R350-I354 WeakPolarHBondContact O-CD1 3.43Å; R350-I354 VanDerWaalsContact O-CG1 3.23Å; R350-I354 WeakPolarHBondContact O-CG1 3.49Å; R350-I354 PolarHBondContact O-N 3.29Å; R350-I354 VanDerWaalsContact O-N 3.09Å; R350-Y377 HydrophobicContact CB-CD1 3.95Å; R350-Y377 HydrophobicContact CB-CD2 3.96Å; R350-Y377 HydrophobicContact CB-CE1 3.99Å; R350-Y377 HydrophobicContact CB-CE2 4Å; R350-Y377 HydrophobicContact CB-CG 3.95Å; R350-Y377 HydrophobicContact CG-CD1 3.81Å; R350-Y377 HydrophobicContact CG-CE1 3.75Å; R350-Y377 HydrophobicContact CG-CG 4.31Å
351	H	92.1	Very high	91.3	Very high	17 Å²	17	38.7 Å²	38.7	8%	0.079	18%	0.181	C	C	.	.	H	α-helix	trans	-66.3	-39.2	177.6	-72.9	-49.6	0	0	0	113.9	R325 D347 S348 V349 I354 N355	R325-H351 HydrophobicContact CB-CB 4.38Å; R325-H351 VanDerWaalsContact CD-CE1 3.42Å; R325-H351 WeakPolarHBondContact CD-CE1 3.48Å; D347-H351 PolarHBondContact O-CD2 3.14Å; D347-H351 PolarHBondContact O-N 3.14Å; D347-H351 IonicContact OD2-CD2 3.8Å; D347-H351 IonicContact OD2-NE2 2.82Å; D347-H351 PolarHBondContact OD2-NE2 3.32Å; S348-H351 PolarHBondContact O-N 3.03Å; V349-H351 VanDerWaalsContact C-N 3.3Å; V349-H351 PolarHBondContact O-N 3.44Å; H351-I354 PolarHBondContact O-N 3.34Å; H351-N355 PolarHBondContact O-N 2.62Å; H351-N355 VanDerWaalsContact O-N 3.14Å; H351-N355 PolarHBondContact O-ND2 3.46Å
352	L	92.3	Very high	91.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.4	-49.6	175.4	-72.6	164.9	0	0	0	111	V324 T328 L337 L339 S348 V349 I354 N355 T356 L359 L362 F384	V324-L352 HydrophobicContact CG1-CD1 4.48Å; V324-L352 HydrophobicContact CG1-CD2 4.22Å; V324-L352 HydrophobicContact CG1-CG 4.03Å; T328-L352 HydrophobicContact CG2-CD2 3.47Å; T328-L352 VanDerWaalsContact CG2-CD2 3.47Å; T328-L352 HydrophobicContact CG2-CG 4.19Å; L337-L352 HydrophobicContact CD2-CD2 3.32Å; L339-L352 HydrophobicContact CD1-CD1 4.22Å; S348-L352 VanDerWaalsContact O-CG 3.31Å; S348-L352 WeakPolarHBondContact O-CG 3.46Å; S348-L352 PolarHBondContact O-N 3.49Å; V349-L352 WeakPolarHBondContact O-CB 3.48Å; V349-L352 PolarHBondContact O-N 2.92Å; L352-I354 VanDerWaalsContact C-N 3.33Å; L352-I354 PolarHBondContact O-N 3.1Å; L352-N355 PolarHBondContact O-N 3.45Å; L352-T356 HydrophobicContact CD2-CG2 4.2Å; L352-T356 WeakPolarHBondContact O-CB 3.31Å; L352-T356 PolarHBondContact O-N 2.97Å; L352-T356 PolarHBondContact O-OG1 3.35Å; L352-L359 HydrophobicContact CD2-CD2 4.42Å; L352-L362 HydrophobicContact CD1-CD1 4.03Å; L352-L362 HydrophobicContact CD1-CD2 4.29Å; L352-F384 HydrophobicContact CB-CE1 4.25Å; L352-F384 HydrophobicContact CB-CZ 3.86Å
353	V	88	Confident	92	Very high	3 Å²	3	36.7 Å²	36.7	2%	0.018	17%	0.174	C	C	.	.	H	α-helix	trans	-63.9	-38.1	-179.6	-179.9	0	0	0	0	111.2	V349 R350 Q380 L381 S383 F384	V349-V353 HydrophobicContact CG1-CG2 4.36Å; V349-V353 WeakPolarHBondContact O-CG2 3.38Å; V349-V353 PolarHBondContact O-N 3.18Å; R350-V353 PolarHBondContact O-N 3.1Å; V353-Q380 WeakPolarHBondContact CG1-O 3.43Å; V353-L381 HydrophobicContact CG1-CB 3.98Å; V353-L381 HydrophobicContact CG1-CD1 3.86Å; V353-L381 HydrophobicContact CG1-CG 4.43Å; V353-S383 WeakPolarHBondContact O-CB 3.32Å; V353-S383 PolarHBondContact O-OG 2.88Å; V353-F384 HydrophobicContact CG2-CD2 3.79Å; V353-F384 HydrophobicContact CG2-CE1 4.33Å; V353-F384 HydrophobicContact CG2-CE2 3.3Å; V353-F384 HydrophobicContact CG2-CG 4.5Å; V353-F384 HydrophobicContact CG2-CZ 3.62Å
354	I	86.5	Confident	92.5	Very high	73 Å²	73	34.8 Å²	34.8	37%	0.374	17%	0.165	S	C	.	.	H	α-helix	trans	-69.3	-41.5	-178.2	-67.7	165.3	0	0	0	111.9	R350 H351 L352 L381	R350-I354 HydrophobicContact CG-CD1 3.91Å; R350-I354 WeakPolarHBondContact O-CD1 3.43Å; R350-I354 VanDerWaalsContact O-CG1 3.23Å; R350-I354 WeakPolarHBondContact O-CG1 3.49Å; R350-I354 PolarHBondContact O-N 3.29Å; R350-I354 VanDerWaalsContact O-N 3.09Å; H351-I354 PolarHBondContact O-N 3.34Å; L352-I354 VanDerWaalsContact C-N 3.33Å; L352-I354 PolarHBondContact O-N 3.1Å; I354-L381 HydrophobicContact CG1-CD1 3.92Å
355	N	87.5	Confident	92.6	Very high	48 Å²	48	35 Å²	35	26%	0.257	17%	0.166	S	C	.	.	H	α-helix	trans	-105.5	-27.8	-164.2	-63.1	-42.7	0	0	0	114.3	T328 V329 H351 L352 K357	T328-N355 WeakPolarHBondContact O-CB 3.27Å; T328-N355 PolarHBondContact OG1-ND2 2.66Å; T328-N355 VanDerWaalsContact OG1-ND2 3.13Å; V329-N355 WeakPolarHBondContact CG2-ND2 3.41Å; H351-N355 PolarHBondContact O-N 2.62Å; H351-N355 VanDerWaalsContact O-N 3.14Å; H351-N355 PolarHBondContact O-ND2 3.46Å; L352-N355 PolarHBondContact O-N 3.45Å; N355-K357 PolarHBondContact O-N 2.89Å
356	T	87.2	Confident	92.4	Very high	5 Å²	5	34.3 Å²	34.3	3%	0.031	16%	0.16	C	C	.	.			trans	-97.4	87.4	-170.3	66.7	0	0	0	0	112.9	T328 L334 L352	T328-T356 HydrophobicContact CG2-CG2 3.58Å; L334-T356 HydrophobicContact CD2-CG2 4.28Å; L352-T356 HydrophobicContact CD2-CG2 4.2Å; L352-T356 WeakPolarHBondContact O-CB 3.31Å; L352-T356 PolarHBondContact O-N 2.97Å; L352-T356 PolarHBondContact O-OG1 3.35Å
357	K	84.5	Confident	92.2	Very high	150 Å²	150	33.7 Å²	33.7	65%	0.652	16%	0.156	S	C	*	.	S	Bend	trans	-81	-15.4	-176.3	-60.8	-178.2	-178.9	179.6	0	115.2	N355 S386	N355-K357 PolarHBondContact O-N 2.89Å; K357-S386 PolarHBondContact O-OG 3.31Å
358	M	89.1	Confident	91.7	Very high	104 Å²	104	31.8 Å²	31.8	51%	0.512	15%	0.147	S	C	.	.	S	Bend	trans	-116.6	5.9	-174.3	-57.6	-66.7	-91.8	0	0	112	L334 L335 Q360	L334-M358 CarbonylContact O-C 3.41Å; L335-M358 HydrophobicContact CD2-CB 3.7Å; L335-M358 WeakPolarHBondContact CD2-O 3.22Å; M358-Q360 PolarHBondContact O-N 2.52Å
359	L	93.1	Very high	91.3	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.165	C	C	.	.			trans	-64.7	125.1	-175.4	-165	70.2	0	0	0	109.9	L334 L337 L352 L362 F384 S386 L387	L334-L359 HydrophobicContact CD2-CD1 4.2Å; L334-L359 HydrophobicContact CG-CD1 4.01Å; L334-L359 WeakPolarHBondContact O-CA 3.4Å; L334-L359 PolarHBondContact O-N 3.09Å; L337-L359 HydrophobicContact CB-CD1 4Å; L352-L359 HydrophobicContact CD2-CD2 4.42Å; L359-L362 HydrophobicContact CD2-CB 4.03Å; L359-L362 HydrophobicContact CD2-CD1 4.2Å; L359-L362 HydrophobicContact CD2-CD2 4.28Å; L359-L362 HydrophobicContact CD2-CG 4.39Å; L359-F384 HydrophobicContact CD2-CE1 3.98Å; L359-S386 PolarHBondContact N-OG 3.07Å; L359-S386 CarbonylContact O-C 3.5Å; L359-S386 VanDerWaalsContact O-C 3.23Å; L359-S386 PolarHBondContact O-OG 3.46Å; L359-L387 HydrophobicContact CD2-CD1 4.49Å; L359-L387 HydrophobicContact CG-CD1 4.39Å; L359-L387 WeakPolarHBondContact O-CA 3.35Å; L359-L387 PolarHBondContact O-N 3.45Å
360	Q	94.8	Very high	91.2	Very high	82 Å²	82	36.6 Å²	36.6	38%	0.383	17%	0.165	S	C	.	.			trans	-112.1	-31.6	-177.5	-72.7	171.7	15.4	0	0	111.7	L335 M358 S386 I388 Y389	L335-Q360 WeakPolarHBondContact O-CA 3.38Å; L335-Q360 PolarHBondContact O-N 3.08Å; M358-Q360 PolarHBondContact O-N 2.52Å; Q360-S386 WeakPolarHBondContact CG-O 3.35Å; Q360-I388 HydrophobicContact CB-CD1 4.22Å; Q360-I388 HydrophobicContact CB-CG1 4.46Å; Q360-I388 HydrophobicContact CG-CD1 4.03Å; Q360-I388 HydrophobicContact CG-CG1 4.48Å; Q360-I388 WeakPolarHBondContact O-CA 3.27Å; Q360-I388 PolarHBondContact O-N 3.2Å; Q360-Y389 PolarHBondContact O-N 2.94Å
361	Y	97.5	Very high	91.2	Very high	49 Å²	49	35 Å²	35	19%	0.192	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	122.3	179.8	-175.6	-70.4	0	0	0	109.9	L335 Y336 L337 Y389	L335-Y361 PolarHBondContact O-N 3.36Å; Y336-Y361 HydrophobicContact CD1-CD1 4.38Å; Y336-Y361 AromaticContact CD2-CD1 3.28Å; Y336-Y361 HydrophobicContact CD2-CD1 3.28Å; Y336-Y361 AromaticContact CD2-CD2 3.76Å; Y336-Y361 HydrophobicContact CD2-CD2 3.76Å; Y336-Y361 AromaticContact CD2-CE1 3.89Å; Y336-Y361 HydrophobicContact CD2-CE1 3.89Å; Y336-Y361 HydrophobicContact CD2-CE2 4.27Å; Y336-Y361 AromaticContact CD2-CG 3.23Å; Y336-Y361 HydrophobicContact CD2-CG 3.23Å; Y336-Y361 HydrophobicContact CE1-CD1 4.3Å; Y336-Y361 HydrophobicContact CE1-CE1 4.33Å; Y336-Y361 AromaticContact CE2-CD1 3.17Å; Y336-Y361 HydrophobicContact CE2-CD1 3.17Å; Y336-Y361 AromaticContact CE2-CD2 3.66Å; Y336-Y361 HydrophobicContact CE2-CD2 3.66Å; Y336-Y361 AromaticContact CE2-CE1 3.23Å; Y336-Y361 HydrophobicContact CE2-CE1 3.23Å; Y336-Y361 AromaticContact CE2-CE2 3.68Å; Y336-Y361 HydrophobicContact CE2-CE2 3.68Å; Y336-Y361 AromaticContact CE2-CG 3.42Å; Y336-Y361 HydrophobicContact CE2-CG 3.42Å; Y336-Y361 VanDerWaalsContact CE2-CG 3.42Å; Y336-Y361 AromaticContact CE2-CZ 3.48Å; Y336-Y361 VanDerWaalsContact CE2-CZ 3.48Å; Y336-Y361 AromaticContact CG-CD1 3.91Å; Y336-Y361 HydrophobicContact CG-CD1 3.91Å; Y336-Y361 HydrophobicContact CG-CG 4.1Å; Y336-Y361 AromaticContact CZ-CD1 3.72Å; Y336-Y361 AromaticContact CZ-CE1 3.49Å; Y336-Y361 VanDerWaalsContact CZ-CE1 3.49Å; Y336-Y361 AromaticContact CZ-CZ 3.96Å; L337-Y361 PolarHBondContact N-O 3.28Å; Y361-Y389 HydrophobicContact CD1-CD1 4.19Å; Y361-Y389 AromaticContact CD2-CD1 3.48Å; Y361-Y389 HydrophobicContact CD2-CD1 3.48Å; Y361-Y389 VanDerWaalsContact CD2-CD1 3.48Å; Y361-Y389 AromaticContact CD2-CD2 3.95Å; Y361-Y389 HydrophobicContact CD2-CD2 3.95Å; Y361-Y389 HydrophobicContact CD2-CE1 4.08Å; Y361-Y389 HydrophobicContact CD2-CE2 4.5Å; Y361-Y389 AromaticContact CD2-CG 3.41Å; Y361-Y389 HydrophobicContact CD2-CG 3.41Å; Y361-Y389 VanDerWaalsContact CD2-CG 3.41Å; Y361-Y389 AromaticContact CE1-CD1 3.99Å; Y361-Y389 HydrophobicContact CE1-CD1 3.99Å; Y361-Y389 AromaticContact CE1-CE1 3.95Å; Y361-Y389 HydrophobicContact CE1-CE1 3.95Å; Y361-Y389 AromaticContact CE2-CD1 3.26Å; Y361-Y389 HydrophobicContact CE2-CD1 3.26Å; Y361-Y389 AromaticContact CE2-CD2 3.65Å; Y361-Y389 HydrophobicContact CE2-CD2 3.65Å; Y361-Y389 AromaticContact CE2-CE1 3.37Å; Y361-Y389 HydrophobicContact CE2-CE1 3.37Å; Y361-Y389 AromaticContact CE2-CE2 3.74Å; Y361-Y389 HydrophobicContact CE2-CE2 3.74Å; Y361-Y389 AromaticContact CE2-CG 3.42Å; Y361-Y389 HydrophobicContact CE2-CG 3.42Å; Y361-Y389 VanDerWaalsContact CE2-CG 3.42Å; Y361-Y389 AromaticContact CE2-CZ 3.6Å; Y361-Y389 AromaticContact CG-CD1 3.94Å; Y361-Y389 HydrophobicContact CG-CD1 3.94Å; Y361-Y389 HydrophobicContact CG-CG 4.17Å; Y361-Y389 AromaticContact CZ-CD1 3.53Å; Y361-Y389 AromaticContact CZ-CE1 3.27Å; Y361-Y389 AromaticContact CZ-CZ 3.72Å; Y361-Y389 WeakPolarHBondContact OH-CE1 3.46Å; Y361-Y389 PolarHBondContact OH-OH 3.5Å
362	L	96.9	Very high	91.1	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	124	174.2	-178.8	58.5	0	0	0	110.2	L337 L352 L359 L364 F384 L387 Y389 L390 D391	L337-L362 HydrophobicContact CB-CD1 4.4Å; L337-L362 HydrophobicContact CD2-CD1 4.48Å; L337-L362 WeakPolarHBondContact O-CA 3.42Å; L352-L362 HydrophobicContact CD1-CD1 4.03Å; L352-L362 HydrophobicContact CD1-CD2 4.29Å; L359-L362 HydrophobicContact CD2-CB 4.03Å; L359-L362 HydrophobicContact CD2-CD1 4.2Å; L359-L362 HydrophobicContact CD2-CD2 4.28Å; L359-L362 HydrophobicContact CD2-CG 4.39Å; L362-L364 HydrophobicContact CD1-CD2 3.94Å; L362-L364 HydrophobicContact CD1-CG 4.2Å; L362-L364 HydrophobicContact CD2-CD1 4.08Å; L362-L364 HydrophobicContact CD2-CG 4.23Å; L362-L364 HydrophobicContact CG-CD1 4.39Å; L362-L364 HydrophobicContact CG-CD2 4.27Å; L362-L364 HydrophobicContact CG-CG 3.99Å; L362-F384 HydrophobicContact CD2-CE2 4.43Å; L362-F384 HydrophobicContact CD2-CZ 3.94Å; L362-L387 HydrophobicContact CB-CD1 3.78Å; L362-Y389 PolarHBondContact N-O 3.08Å; L362-L390 HydrophobicContact CB-CD1 4.33Å; L362-L390 HydrophobicContact CD2-CD1 4.31Å; L362-L390 HydrophobicContact CG-CD1 4.35Å; L362-L390 WeakPolarHBondContact O-CA 3.43Å; L362-D391 PolarHBondContact O-N 2.62Å; L362-D391 VanDerWaalsContact O-N 3.11Å
363	S	97.7	Very high	91.1	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.014	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	116.1	171.7	166.5	0	0	0	0	110.1	L337 N338 L339 S340	L337-S363 PolarHBondContact O-N 2.85Å; N338-S363 PolarHBondContact OD1-OG 2.87Å; L339-S363 PolarHBondContact N-O 3.03Å; S340-S363 PolarHBondContact N-O 3.45Å
364	L	96.6	Very high	91.3	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	20%	0.201	C	C	.	.			trans	-111.4	14	174.6	-58.5	174.4	0	0	0	111.7	L339 I344 V349 L362 Y366 C367 L370 D391 L392 C395	L339-L364 HydrophobicContact CB-CD2 4.44Å; L339-L364 HydrophobicContact CD1-CD2 4.23Å; I344-L364 HydrophobicContact CD1-CD2 3.74Å; V349-L364 HydrophobicContact CG2-CD1 4.18Å; L362-L364 HydrophobicContact CD1-CD2 3.94Å; L362-L364 HydrophobicContact CD1-CG 4.2Å; L362-L364 HydrophobicContact CD2-CD1 4.08Å; L362-L364 HydrophobicContact CD2-CG 4.23Å; L362-L364 HydrophobicContact CG-CD1 4.39Å; L362-L364 HydrophobicContact CG-CD2 4.27Å; L362-L364 HydrophobicContact CG-CG 3.99Å; L364-Y366 PolarHBondContact O-N 3.31Å; L364-C367 VanDerWaalsContact O-CB 3.22Å; L364-C367 WeakPolarHBondContact O-CB 3.43Å; L364-C367 PolarHBondContact O-N 3.06Å; L364-C367 VanDerWaalsContact O-N 3.08Å; L364-C367 PolarHBondContact O-SG 2.89Å; L364-L370 HydrophobicContact CB-CD1 3.87Å; L364-L370 HydrophobicContact CD1-CD1 3.93Å; L364-L370 HydrophobicContact CG-CD1 4.33Å; L364-D391 PolarHBondContact N-O 3.23Å; L364-L392 HydrophobicContact CB-CD2 4.22Å; L364-L392 HydrophobicContact CD1-CD2 4.03Å; L364-C395 PolarHBondContact O-SG 2.88Å
365	A	94.5	Very high	91.5	Very high	4 Å²	4	39 Å²	39	3%	0.033	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51	128.8	-176.3	0	0	0	0	0	112.4	S340 Y341 C367 D391 S393	S340-A365 CarbonylContact C-O 3.4Å; S340-A365 WeakPolarHBondContact CA-O 3.44Å; S340-A365 WeakPolarHBondContact CB-O 3.3Å; Y341-A365 PolarHBondContact N-O 2.84Å; A365-C367 PolarHBondContact O-N 2.7Å; A365-D391 PolarHBondContact N-O 3.04Å; A365-S393 CarbonylContact C-O 3.56Å; A365-S393 VanDerWaalsContact CA-O 3.23Å; A365-S393 WeakPolarHBondContact CA-O 3.29Å
366	Y	91.1	Very high	91.6	Very high	27 Å²	27	39.1 Å²	39.1	11%	0.106	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.7	29.4	177.6	-48.3	-86.9	0	0	0	113.2	Y341 L364 T368 S393 D420 C487	Y341-Y366 HydrophobicContact CD1-CD2 4.27Å; Y341-Y366 HydrophobicContact CD1-CG 4.07Å; Y341-Y366 HydrophobicContact CD2-CD2 4.23Å; Y341-Y366 HydrophobicContact CE1-CD1 4.12Å; Y341-Y366 AromaticContact CE1-CD2 3.56Å; Y341-Y366 HydrophobicContact CE1-CD2 3.56Å; Y341-Y366 HydrophobicContact CE1-CE2 4.22Å; Y341-Y366 AromaticContact CE1-CG 3.48Å; Y341-Y366 HydrophobicContact CE1-CG 3.48Å; Y341-Y366 VanDerWaalsContact CE1-CG 3.48Å; Y341-Y366 AromaticContact CE2-CD2 3.53Å; Y341-Y366 HydrophobicContact CE2-CD2 3.53Å; Y341-Y366 HydrophobicContact CE2-CE2 4.02Å; Y341-Y366 HydrophobicContact CE2-CG 4.28Å; Y341-Y366 AromaticContact CZ-CD2 3.12Å; Y341-Y366 AromaticContact CZ-CE2 3.51Å; Y341-Y366 AromaticContact CZ-CG 3.6Å; Y341-Y366 WeakPolarHBondContact OH-CD2 3.23Å; Y341-Y366 WeakPolarHBondContact OH-CE2 3.49Å; L364-Y366 PolarHBondContact O-N 3.31Å; Y366-T368 VanDerWaalsContact C-N 3.33Å; Y366-T368 PolarHBondContact O-N 2.95Å; Y366-S393 PolarHBondContact N-O 3.39Å; Y366-D420 HydrophobicContact CE1-CB 4.25Å; Y366-D420 WeakPolarHBondContact CE1-OD2 3.31Å; Y366-D420 PolarHBondContact OH-OD2 2.73Å; Y366-C487 HydrophobicContact CD1-CB 4.19Å; Y366-C487 WeakPolarHBondContact CD1-SG 3.33Å
367	C	91.1	Very high	91.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.195	C	C	.	.			trans	-82	81.1	164.5	-67.1	0	0	0	0	109.1	L339 I344 L364 A365 R369 L370	L339-C367 PolarHBondContact O-SG 3.25Å; I344-C367 HydrophobicContact CD1-CB 4.27Å; I344-C367 HydrophobicContact CG1-CB 3.89Å; L364-C367 VanDerWaalsContact O-CB 3.22Å; L364-C367 WeakPolarHBondContact O-CB 3.43Å; L364-C367 PolarHBondContact O-N 3.06Å; L364-C367 VanDerWaalsContact O-N 3.08Å; L364-C367 PolarHBondContact O-SG 2.89Å; A365-C367 PolarHBondContact O-N 2.7Å; C367-R369 PolarHBondContact O-N 3.06Å; C367-L370 HydrophobicContact CB-CD1 3.68Å; C367-L370 HydrophobicContact CB-CG 3.88Å; C367-L370 WeakPolarHBondContact O-CB 3.37Å; C367-L370 WeakPolarHBondContact O-CG 3.46Å; C367-L370 PolarHBondContact O-N 3.09Å; C367-L370 VanDerWaalsContact O-N 3.09Å
368	T	83.9	Confident	91.8	Very high	14 Å²	14	34.4 Å²	34.4	9%	0.086	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-1.9	-165.1	57	0	0	0	0	115.5	Y366 Y397 L490	Y366-T368 VanDerWaalsContact C-N 3.33Å; Y366-T368 PolarHBondContact O-N 2.95Å; T368-Y397 VanDerWaalsContact O-CD2 3.24Å; T368-Y397 WeakPolarHBondContact O-CD2 3.18Å; T368-L490 HydrophobicContact CG2-CD1 3.24Å
369	R	87	Confident	91.3	Very high	101 Å²	101	34.5 Å²	34.5	38%	0.381	17%	0.168	S	C	.	.	B	Isolated β-bridge	trans	-99.7	0.9	174.1	-56.4	-178.4	-177.2	-158.2	-11.1	113	Q343 I344 T345 C367	Q343-R369 WeakPolarHBondContact O-CD 3.34Å; I344-R369 WeakPolarHBondContact O-CB 3.44Å; T345-R369 HydrophobicContact CG2-CB 4.2Å; C367-R369 PolarHBondContact O-N 3.06Å
370	L	91.4	Very high	90	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.195	C	C	.	.			trans	-74.1	124.3	170.5	-65.2	179.5	0	0	0	109.5	T345 D346 V349 L364 C367 C374 Y397 I398	T345-L370 WeakPolarHBondContact O-CD2 3.21Å; D346-L370 WeakPolarHBondContact OD1-CA 3.48Å; V349-L370 HydrophobicContact CG2-CD2 3.7Å; L364-L370 HydrophobicContact CB-CD1 3.87Å; L364-L370 HydrophobicContact CD1-CD1 3.93Å; L364-L370 HydrophobicContact CG-CD1 4.33Å; C367-L370 HydrophobicContact CB-CD1 3.68Å; C367-L370 HydrophobicContact CB-CG 3.88Å; C367-L370 WeakPolarHBondContact O-CB 3.37Å; C367-L370 WeakPolarHBondContact O-CG 3.46Å; C367-L370 PolarHBondContact O-N 3.09Å; C367-L370 VanDerWaalsContact O-N 3.09Å; L370-C374 HydrophobicContact CD2-CB 4.47Å; L370-Y397 WeakPolarHBondContact O-CB 3.49Å; L370-I398 HydrophobicContact CB-CG1 4.41Å
371	T	91.6	Very high	88.4	Confident	56 Å²	56	41.7 Å²	41.7	34%	0.344	20%	0.204	S	C	.	.			trans	-109.6	178.9	-179.7	75.6	0	0	0	0	110.5	D346 L373 C374 Y397	D346-T371 PolarHBondContact OD1-N 3.08Å; D346-T371 PolarHBondContact OD2-OG1 3.03Å; T371-L373 PolarHBondContact O-N 2.77Å; T371-L373 WeakPolarHBondContact OG1-CB 3.35Å; T371-L373 PolarHBondContact OG1-N 3.34Å; T371-L373 VanDerWaalsContact OG1-N 3.17Å; T371-C374 PolarHBondContact O-N 2.82Å; T371-C374 VanDerWaalsContact O-N 3.14Å; T371-C374 PolarHBondContact O-SG 3.17Å; T371-Y397 CarbonylContact C-O 3.55Å; T371-Y397 WeakPolarHBondContact CA-O 3.16Å
372	Q	91.5	Very high	87	Confident	85 Å²	85	46.1 Å²	46.1	40%	0.397	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-27.2	171.4	-166.5	-176.3	7.1	0	0	112.7	C374 S375 Y397 I398	Q372-C374 VanDerWaalsContact C-N 3.26Å; Q372-C374 PolarHBondContact O-N 3.49Å; Q372-S375 WeakPolarHBondContact O-CB 3.26Å; Q372-S375 PolarHBondContact O-N 3.16Å; Q372-S375 VanDerWaalsContact O-N 3.14Å; Q372-S375 PolarHBondContact O-OG 3.03Å; Q372-Y397 PolarHBondContact N-O 3.46Å; Q372-I398 WeakPolarHBondContact CB-O 3.36Å
373	L	92.2	Very high	85.6	Confident	87 Å²	87	46.8 Å²	46.8	46%	0.455	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-34.6	179.2	-177.5	66.8	0	0	0	112.8	D346 T371 S375 T376 Y377	D346-L373 HydrophobicContact CB-CB 4.44Å; D346-L373 HydrophobicContact CB-CD2 4.3Å; D346-L373 HydrophobicContact CB-CG 4.44Å; T371-L373 PolarHBondContact O-N 2.77Å; T371-L373 WeakPolarHBondContact OG1-CB 3.35Å; T371-L373 PolarHBondContact OG1-N 3.34Å; T371-L373 VanDerWaalsContact OG1-N 3.17Å; L373-S375 PolarHBondContact O-N 3.45Å; L373-S375 VanDerWaalsContact O-N 3.12Å; L373-T376 WeakPolarHBondContact O-CB 3.44Å; L373-T376 PolarHBondContact O-N 3.02Å; L373-T376 PolarHBondContact O-OG1 3.06Å; L373-Y377 HydrophobicContact CG-CE2 4.29Å
374	C	91.7	Very high	84.6	Confident	0 Å²	0	47 Å²	47	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-58	-31.4	180	69.4	0	0	0	0	112.9	D346 V349 L370 T371 Q372 T376 Y377 F378	D346-C374 HydrophobicContact CB-CB 4.17Å; D346-C374 VanDerWaalsContact OD1-CB 3.26Å; D346-C374 WeakPolarHBondContact OD1-CB 3.33Å; D346-C374 PolarHBondContact OD1-N 3.48Å; V349-C374 HydrophobicContact CB-CB 4.22Å; V349-C374 HydrophobicContact CG1-CB 4.26Å; V349-C374 HydrophobicContact CG2-CB 4.06Å; L370-C374 HydrophobicContact CD2-CB 4.47Å; T371-C374 PolarHBondContact O-N 2.82Å; T371-C374 VanDerWaalsContact O-N 3.14Å; T371-C374 PolarHBondContact O-SG 3.17Å; Q372-C374 VanDerWaalsContact C-N 3.26Å; Q372-C374 PolarHBondContact O-N 3.49Å; C374-T376 PolarHBondContact O-N 3.02Å; C374-Y377 WeakPolarHBondContact O-CB 3.42Å; C374-Y377 PolarHBondContact O-N 2.86Å; C374-Y377 VanDerWaalsContact O-N 3.08Å; C374-F378 WeakPolarHBondContact O-CD2 3.28Å; C374-F378 PolarHBondContact O-N 2.74Å
375	S	90.7	Very high	83.9	Confident	3 Å²	3	53.2 Å²	53.2	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-62.1	-28.1	179.8	69.8	0	0	0	0	112.9	Q372 L373 Y377 F378 N379 G402 L405	Q372-S375 WeakPolarHBondContact O-CB 3.26Å; Q372-S375 PolarHBondContact O-N 3.16Å; Q372-S375 VanDerWaalsContact O-N 3.14Å; Q372-S375 PolarHBondContact O-OG 3.03Å; L373-S375 PolarHBondContact O-N 3.45Å; L373-S375 VanDerWaalsContact O-N 3.12Å; S375-Y377 VanDerWaalsContact C-N 3.3Å; S375-Y377 PolarHBondContact O-N 2.7Å; S375-F378 PolarHBondContact O-N 3.33Å; S375-N379 PolarHBondContact O-N 2.9Å; S375-G402 VanDerWaalsContact CB-O 3.23Å; S375-G402 WeakPolarHBondContact CB-O 3.39Å; S375-L405 WeakPolarHBondContact O-CD2 3.22Å; S375-L405 WeakPolarHBondContact OG-CD2 3.37Å
376	T	89.1	Confident	83.6	Confident	52 Å²	52	54.5 Å²	54.5	32%	0.319	27%	0.268	S	S	.	.	H	α-helix	trans	-67.9	-31.9	177.1	67.4	0	0	0	0	112.1	L373 C374 N379 Q380	L373-T376 WeakPolarHBondContact O-CB 3.44Å; L373-T376 PolarHBondContact O-N 3.02Å; L373-T376 PolarHBondContact O-OG1 3.06Å; C374-T376 PolarHBondContact O-N 3.02Å; T376-N379 PolarHBondContact O-N 2.89Å; T376-Q380 WeakPolarHBondContact O-CG 3.42Å
377	Y	89.4	Confident	83.7	Confident	49 Å²	49	53.2 Å²	53.2	19%	0.192	26%	0.263	C	S	.	.	H	α-helix	trans	-73.6	-34.1	176.2	-57.5	-53.5	0	0	0	111.8	D346 R350 L373 C374 S375 N379 Q380	D346-Y377 HydrophobicContact CB-CE2 3.97Å; D346-Y377 WeakPolarHBondContact O-CD2 3.36Å; D346-Y377 WeakPolarHBondContact O-CE2 3.35Å; R350-Y377 HydrophobicContact CB-CD1 3.95Å; R350-Y377 HydrophobicContact CB-CD2 3.96Å; R350-Y377 HydrophobicContact CB-CE1 3.99Å; R350-Y377 HydrophobicContact CB-CE2 4Å; R350-Y377 HydrophobicContact CB-CG 3.95Å; R350-Y377 HydrophobicContact CG-CD1 3.81Å; R350-Y377 HydrophobicContact CG-CE1 3.75Å; R350-Y377 HydrophobicContact CG-CG 4.31Å; L373-Y377 HydrophobicContact CG-CE2 4.29Å; C374-Y377 WeakPolarHBondContact O-CB 3.42Å; C374-Y377 PolarHBondContact O-N 2.86Å; C374-Y377 VanDerWaalsContact O-N 3.08Å; S375-Y377 VanDerWaalsContact C-N 3.3Å; S375-Y377 PolarHBondContact O-N 2.7Å; Y377-N379 PolarHBondContact O-N 2.79Å; Y377-Q380 PolarHBondContact O-N 3.33Å
378	F	86.2	Confident	83.9	Confident	7 Å²	7	56.1 Å²	56.1	3%	0.031	28%	0.278	C	S	.	.	H	α-helix	trans	-60.6	-34	174.4	-86.4	-97.3	0	0	0	112.7	V349 C374 S375 Q380 F384 L390 I406 S409 V410	V349-F378 HydrophobicContact CG1-CD2 3.84Å; V349-F378 HydrophobicContact CG1-CE2 3.51Å; V349-F378 HydrophobicContact CG1-CZ 4.4Å; C374-F378 WeakPolarHBondContact O-CD2 3.28Å; C374-F378 PolarHBondContact O-N 2.74Å; S375-F378 PolarHBondContact O-N 3.33Å; F378-Q380 VanDerWaalsContact C-N 3.33Å; F378-F384 AromaticContact CD1-CD2 3.48Å; F378-F384 HydrophobicContact CD1-CD2 3.48Å; F378-F384 VanDerWaalsContact CD1-CD2 3.48Å; F378-F384 AromaticContact CD1-CE2 3.73Å; F378-F384 HydrophobicContact CD1-CE2 3.73Å; F378-F384 AromaticContact CE1-CD2 3.46Å; F378-F384 HydrophobicContact CE1-CD2 3.46Å; F378-F384 VanDerWaalsContact CE1-CD2 3.46Å; F378-F384 AromaticContact CE1-CE2 3.39Å; F378-F384 HydrophobicContact CE1-CE2 3.39Å; F378-F384 HydrophobicContact CE2-CE2 4.24Å; F378-F384 HydrophobicContact CG-CD2 4.26Å; F378-F384 HydrophobicContact CG-CE2 4.29Å; F378-F384 HydrophobicContact CZ-CD2 4.22Å; F378-F384 AromaticContact CZ-CE2 3.67Å; F378-F384 HydrophobicContact CZ-CE2 3.67Å; F378-L390 HydrophobicContact CE1-CD2 4.16Å; F378-L390 HydrophobicContact CZ-CD1 4.5Å; F378-L390 HydrophobicContact CZ-CD2 4.48Å; F378-I406 HydrophobicContact CB-CG1 4.31Å; F378-I406 HydrophobicContact CD1-CG2 3.88Å; F378-I406 HydrophobicContact CD2-CD1 4.33Å; F378-I406 HydrophobicContact CD2-CG1 3.97Å; F378-I406 HydrophobicContact CE1-CG2 4.01Å; F378-I406 HydrophobicContact CE2-CD1 4.38Å; F378-I406 HydrophobicContact CE2-CG1 4.43Å; F378-I406 HydrophobicContact CG-CG1 4.07Å; F378-I406 HydrophobicContact CG-CG2 4.16Å; F378-I406 HydrophobicContact CZ-CG2 4.39Å; F378-S409 WeakPolarHBondContact O-CB 3.22Å; F378-V410 HydrophobicContact CD1-CG1 3.85Å; F378-V410 HydrophobicContact CD1-CG2 4.43Å; F378-V410 HydrophobicContact CE1-CG1 4.32Å
379	N	78.4	Confident	84.5	Confident	106 Å²	106	57.7 Å²	57.7	57%	0.567	28%	0.282	S	S	*	.	H	α-helix	trans	-78	-18.1	-179.4	-169.8	29.7	0	0	0	113.1	S375 T376 Y377 S409	S375-N379 PolarHBondContact O-N 2.9Å; T376-N379 PolarHBondContact O-N 2.89Å; Y377-N379 PolarHBondContact O-N 2.79Å; N379-S409 WeakPolarHBondContact CA-OG 3.36Å
380	Q	66.1	Low	85	Confident	120 Å²	120	52.9 Å²	52.9	56%	0.561	26%	0.264	S	S	*	.	S	Bend	trans	-99.4	123.8	-179.6	-66.7	-177.6	3.7	0	0	109.1	V353 T376 Y377 F378	V353-Q380 WeakPolarHBondContact CG1-O 3.43Å; T376-Q380 WeakPolarHBondContact O-CG 3.42Å; Y377-Q380 PolarHBondContact O-N 3.33Å; F378-Q380 VanDerWaalsContact C-N 3.33Å
381	L	62.5	Low	85.3	Confident	112 Å²	112	53.8 Å²	53.8	59%	0.586	27%	0.269	S	S	*	.	S	Bend	trans	91.6	148.4	172.3	-48.2	157.2	0	0	0	116.1	V353 I354 S383	V353-L381 HydrophobicContact CG1-CB 3.98Å; V353-L381 HydrophobicContact CG1-CD1 3.86Å; V353-L381 HydrophobicContact CG1-CG 4.43Å; I354-L381 HydrophobicContact CG1-CD1 3.92Å; L381-S383 PolarHBondContact O-N 3.08Å
382	E	66.5	Low	85.5	Confident	142 Å²	142	51.2 Å²	51.2	66%	0.664	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-74.5	-0.4	-179.1	-63.9	-164.7	128.1	0	0	114.4	F384 K385	E382-F384 PolarHBondContact O-N 3.05Å; E382-K385 HydrophobicContact CB-CD 3.99Å; E382-K385 VanDerWaalsContact CD-NZ 3.31Å; E382-K385 HydrophobicContact CG-CD 4.43Å; E382-K385 WeakPolarHBondContact O-CB 3.43Å; E382-K385 WeakPolarHBondContact O-CG 3.42Å; E382-K385 PolarHBondContact O-N 3.29Å; E382-K385 IonicContact OE1-NZ 2.73Å; E382-K385 PolarHBondContact OE1-NZ 2.88Å
383	S	67.8	Low	85.7	Confident	14 Å²	14	47.3 Å²	47.3	10%	0.098	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-71.5	-31.4	-161.4	-52.7	0	0	0	0	114.7	V353 L381 K385	V353-S383 WeakPolarHBondContact O-CB 3.32Å; V353-S383 PolarHBondContact O-OG 2.88Å; L381-S383 PolarHBondContact O-N 3.08Å; S383-K385 VanDerWaalsContact C-N 3.26Å; S383-K385 PolarHBondContact O-N 3.4Å
384	F	77.7	Confident	85.4	Confident	8 Å²	8	43.4 Å²	43.4	4%	0.035	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-85.1	8.7	177.4	-76.7	-16.3	0	0	0	114.3	L352 V353 L359 L362 F378 E382 S386 L387 V410 Q412	L352-F384 HydrophobicContact CB-CE1 4.25Å; L352-F384 HydrophobicContact CB-CZ 3.86Å; V353-F384 HydrophobicContact CG2-CD2 3.79Å; V353-F384 HydrophobicContact CG2-CE1 4.33Å; V353-F384 HydrophobicContact CG2-CE2 3.3Å; V353-F384 HydrophobicContact CG2-CG 4.5Å; V353-F384 HydrophobicContact CG2-CZ 3.62Å; L359-F384 HydrophobicContact CD2-CE1 3.98Å; L362-F384 HydrophobicContact CD2-CE2 4.43Å; L362-F384 HydrophobicContact CD2-CZ 3.94Å; F378-F384 AromaticContact CD1-CD2 3.48Å; F378-F384 HydrophobicContact CD1-CD2 3.48Å; F378-F384 VanDerWaalsContact CD1-CD2 3.48Å; F378-F384 AromaticContact CD1-CE2 3.73Å; F378-F384 HydrophobicContact CD1-CE2 3.73Å; F378-F384 AromaticContact CE1-CD2 3.46Å; F378-F384 HydrophobicContact CE1-CD2 3.46Å; F378-F384 VanDerWaalsContact CE1-CD2 3.46Å; F378-F384 AromaticContact CE1-CE2 3.39Å; F378-F384 HydrophobicContact CE1-CE2 3.39Å; F378-F384 HydrophobicContact CE2-CE2 4.24Å; F378-F384 HydrophobicContact CG-CD2 4.26Å; F378-F384 HydrophobicContact CG-CE2 4.29Å; F378-F384 HydrophobicContact CZ-CD2 4.22Å; F378-F384 AromaticContact CZ-CE2 3.67Å; F378-F384 HydrophobicContact CZ-CE2 3.67Å; E382-F384 PolarHBondContact O-N 3.05Å; F384-S386 PolarHBondContact O-N 3.25Å; F384-L387 HydrophobicContact CB-CB 4.43Å; F384-L387 VanDerWaalsContact O-CB 3.25Å; F384-L387 WeakPolarHBondContact O-CB 3.46Å; F384-L387 PolarHBondContact O-N 2.88Å; F384-V410 HydrophobicContact CB-CG1 3.84Å; F384-V410 HydrophobicContact CD2-CG1 4.43Å; F384-Q412 PolarHBondContact O-NE2 3.42Å
385	K	81.4	Confident	85.4	Confident	130 Å²	130	43.5 Å²	43.5	57%	0.565	22%	0.217	S	C	*	.	G	3₁₀ helix	trans	-59.8	-17.4	174.5	-73.4	-179.5	-178.8	-173.4	0	114.1	E382 S383 Q412	E382-K385 HydrophobicContact CB-CD 3.99Å; E382-K385 VanDerWaalsContact CD-NZ 3.31Å; E382-K385 HydrophobicContact CG-CD 4.43Å; E382-K385 WeakPolarHBondContact O-CB 3.43Å; E382-K385 WeakPolarHBondContact O-CG 3.42Å; E382-K385 PolarHBondContact O-N 3.29Å; E382-K385 IonicContact OE1-NZ 2.73Å; E382-K385 PolarHBondContact OE1-NZ 2.88Å; S383-K385 VanDerWaalsContact C-N 3.26Å; S383-K385 PolarHBondContact O-N 3.4Å; K385-Q412 WeakPolarHBondContact O-CG 3.39Å
386	S	88.4	Confident	85	Confident	31 Å²	31	43.5 Å²	43.5	22%	0.217	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-89.6	-5.8	174.9	57.7	0	0	0	0	114.2	K357 L359 Q360 F384 I388	K357-S386 PolarHBondContact O-OG 3.31Å; L359-S386 PolarHBondContact N-OG 3.07Å; L359-S386 CarbonylContact O-C 3.5Å; L359-S386 VanDerWaalsContact O-C 3.23Å; L359-S386 PolarHBondContact O-OG 3.46Å; Q360-S386 WeakPolarHBondContact CG-O 3.35Å; F384-S386 PolarHBondContact O-N 3.25Å; S386-I388 PolarHBondContact O-N 3.3Å
387	L	92.3	Very high	84.9	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.215	C	C	.	.			trans	-70.6	125.5	-172.2	-163.1	71.5	0	0	0	111.4	L359 L362 F384 L390 Q412 V413	L359-L387 HydrophobicContact CD2-CD1 4.49Å; L359-L387 HydrophobicContact CG-CD1 4.39Å; L359-L387 WeakPolarHBondContact O-CA 3.35Å; L359-L387 PolarHBondContact O-N 3.45Å; L362-L387 HydrophobicContact CB-CD1 3.78Å; F384-L387 HydrophobicContact CB-CB 4.43Å; F384-L387 VanDerWaalsContact O-CB 3.25Å; F384-L387 WeakPolarHBondContact O-CB 3.46Å; F384-L387 PolarHBondContact O-N 2.88Å; L387-L390 HydrophobicContact CD2-CB 4.13Å; L387-L390 HydrophobicContact CD2-CD1 4.26Å; L387-L390 HydrophobicContact CD2-CD2 4.29Å; L387-L390 HydrophobicContact CD2-CG 4.46Å; L387-Q412 WeakPolarHBondContact O-CG 3.23Å; L387-V413 HydrophobicContact CB-CG2 4.15Å; L387-V413 HydrophobicContact CD2-CG2 3.94Å; L387-V413 HydrophobicContact CG-CG2 4.05Å
388	I	95.1	Very high	84.9	Confident	61 Å²	61	42.3 Å²	42.3	31%	0.313	21%	0.206	S	C	.	.			trans	-111.7	-33.2	-177.3	-61.3	171.6	0	0	0	110.8	Q360 S386 E414 H415	Q360-I388 HydrophobicContact CB-CD1 4.22Å; Q360-I388 HydrophobicContact CB-CG1 4.46Å; Q360-I388 HydrophobicContact CG-CD1 4.03Å; Q360-I388 HydrophobicContact CG-CG1 4.48Å; Q360-I388 WeakPolarHBondContact O-CA 3.27Å; Q360-I388 PolarHBondContact O-N 3.2Å; S386-I388 PolarHBondContact O-N 3.3Å; I388-E414 HydrophobicContact CG2-CB 4.05Å; I388-E414 HydrophobicContact CG2-CG 4.1Å; I388-E414 PolarHBondContact O-N 2.64Å; I388-H415 PolarHBondContact O-N 3.39Å
389	Y	97.5	Very high	85	Confident	47 Å²	47	46.4 Å²	46.4	18%	0.184	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	129.1	-178.4	-177.9	-72.8	0	0	0	110.4	Q360 Y361 L362 D391 H415 I417	Q360-Y389 PolarHBondContact O-N 2.94Å; Y361-Y389 HydrophobicContact CD1-CD1 4.19Å; Y361-Y389 AromaticContact CD2-CD1 3.48Å; Y361-Y389 HydrophobicContact CD2-CD1 3.48Å; Y361-Y389 VanDerWaalsContact CD2-CD1 3.48Å; Y361-Y389 AromaticContact CD2-CD2 3.95Å; Y361-Y389 HydrophobicContact CD2-CD2 3.95Å; Y361-Y389 HydrophobicContact CD2-CE1 4.08Å; Y361-Y389 HydrophobicContact CD2-CE2 4.5Å; Y361-Y389 AromaticContact CD2-CG 3.41Å; Y361-Y389 HydrophobicContact CD2-CG 3.41Å; Y361-Y389 VanDerWaalsContact CD2-CG 3.41Å; Y361-Y389 AromaticContact CE1-CD1 3.99Å; Y361-Y389 HydrophobicContact CE1-CD1 3.99Å; Y361-Y389 AromaticContact CE1-CE1 3.95Å; Y361-Y389 HydrophobicContact CE1-CE1 3.95Å; Y361-Y389 AromaticContact CE2-CD1 3.26Å; Y361-Y389 HydrophobicContact CE2-CD1 3.26Å; Y361-Y389 AromaticContact CE2-CD2 3.65Å; Y361-Y389 HydrophobicContact CE2-CD2 3.65Å; Y361-Y389 AromaticContact CE2-CE1 3.37Å; Y361-Y389 HydrophobicContact CE2-CE1 3.37Å; Y361-Y389 AromaticContact CE2-CE2 3.74Å; Y361-Y389 HydrophobicContact CE2-CE2 3.74Å; Y361-Y389 AromaticContact CE2-CG 3.42Å; Y361-Y389 HydrophobicContact CE2-CG 3.42Å; Y361-Y389 VanDerWaalsContact CE2-CG 3.42Å; Y361-Y389 AromaticContact CE2-CZ 3.6Å; Y361-Y389 AromaticContact CG-CD1 3.94Å; Y361-Y389 HydrophobicContact CG-CD1 3.94Å; Y361-Y389 HydrophobicContact CG-CG 4.17Å; Y361-Y389 AromaticContact CZ-CD1 3.53Å; Y361-Y389 AromaticContact CZ-CE1 3.27Å; Y361-Y389 AromaticContact CZ-CZ 3.72Å; Y361-Y389 WeakPolarHBondContact OH-CE1 3.46Å; Y361-Y389 PolarHBondContact OH-OH 3.5Å; L362-Y389 PolarHBondContact N-O 3.08Å; Y389-D391 HydrophobicContact CE1-CB 3.71Å; Y389-H415 HydrophobicContact CD2-CB 3.38Å; Y389-H415 AromaticContact CD2-CG 3.91Å; Y389-H415 HydrophobicContact CE2-CB 4.05Å; Y389-H415 HydrophobicContact CG-CB 4.01Å; Y389-I417 HydrophobicContact CE1-CG1 4.27Å; Y389-I417 HydrophobicContact CE2-CD1 4.36Å; Y389-I417 HydrophobicContact CE2-CG1 4.04Å; Y389-I417 WeakPolarHBondContact OH-CG1 3.49Å
390	L	97.1	Very high	85.6	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	123	176.2	-177	56.9	0	0	0	110.9	L362 F378 L387 L392 I406 V410 V413 H415 W416 I417	L362-L390 HydrophobicContact CB-CD1 4.33Å; L362-L390 HydrophobicContact CD2-CD1 4.31Å; L362-L390 HydrophobicContact CG-CD1 4.35Å; L362-L390 WeakPolarHBondContact O-CA 3.43Å; F378-L390 HydrophobicContact CE1-CD2 4.16Å; F378-L390 HydrophobicContact CZ-CD1 4.5Å; F378-L390 HydrophobicContact CZ-CD2 4.48Å; L387-L390 HydrophobicContact CD2-CB 4.13Å; L387-L390 HydrophobicContact CD2-CD1 4.26Å; L387-L390 HydrophobicContact CD2-CD2 4.29Å; L387-L390 HydrophobicContact CD2-CG 4.46Å; L390-L392 HydrophobicContact CD1-CD2 4Å; L390-L392 HydrophobicContact CD1-CG 4.23Å; L390-L392 HydrophobicContact CD2-CD1 4.13Å; L390-L392 HydrophobicContact CD2-CG 4.31Å; L390-L392 HydrophobicContact CG-CD1 4.36Å; L390-L392 HydrophobicContact CG-CD2 4.32Å; L390-L392 HydrophobicContact CG-CG 4.01Å; L390-I406 HydrophobicContact CD2-CG2 3.9Å; L390-V410 HydrophobicContact CD2-CG2 4.14Å; L390-V413 HydrophobicContact CB-CG1 4Å; L390-V413 HydrophobicContact CB-CG2 4.45Å; L390-H415 PolarHBondContact N-O 3.08Å; L390-W416 HydrophobicContact CD2-CE3 4.5Å; L390-W416 HydrophobicContact CD2-CH2 3.92Å; L390-W416 HydrophobicContact CD2-CZ3 3.8Å; L390-I417 PolarHBondContact O-N 3.03Å; L390-I417 VanDerWaalsContact O-N 3.09Å
391	D	98.1	Very high	86.8	Confident	19 Å²	19	39.6 Å²	39.6	10%	0.102	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	117	174.2	-177.3	-4.3	0	0	0	110.4	L362 L364 A365 Y389 S393 I417	L362-D391 PolarHBondContact O-N 2.62Å; L362-D391 VanDerWaalsContact O-N 3.11Å; L364-D391 PolarHBondContact N-O 3.23Å; A365-D391 PolarHBondContact N-O 3.04Å; Y389-D391 HydrophobicContact CE1-CB 3.71Å; D391-S393 WeakPolarHBondContact OD1-CB 3.36Å; D391-S393 PolarHBondContact OD1-N 3.13Å; D391-S393 PolarHBondContact OD1-OG 3.37Å; D391-I417 HydrophobicContact CB-CB 3.89Å; D391-I417 HydrophobicContact CB-CG1 4.25Å
392	L	96.8	Very high	88.3	Confident	3 Å²	3	34.3 Å²	34.3	2%	0.016	18%	0.175	C	C	.	.			trans	-117.5	17.2	179.4	-61.5	176.1	0	0	0	111.8	L364 L390 G394 C395 I398 L403 I406 W416 I417 L418 I421	L364-L392 HydrophobicContact CB-CD2 4.22Å; L364-L392 HydrophobicContact CD1-CD2 4.03Å; L390-L392 HydrophobicContact CD1-CD2 4Å; L390-L392 HydrophobicContact CD1-CG 4.23Å; L390-L392 HydrophobicContact CD2-CD1 4.13Å; L390-L392 HydrophobicContact CD2-CG 4.31Å; L390-L392 HydrophobicContact CG-CD1 4.36Å; L390-L392 HydrophobicContact CG-CD2 4.32Å; L390-L392 HydrophobicContact CG-CG 4.01Å; L392-G394 PolarHBondContact O-N 3.41Å; L392-C395 VanDerWaalsContact O-CB 3.23Å; L392-C395 WeakPolarHBondContact O-CB 3.45Å; L392-C395 PolarHBondContact O-N 3.13Å; L392-C395 VanDerWaalsContact O-N 3.11Å; L392-C395 PolarHBondContact O-SG 3.48Å; L392-I398 HydrophobicContact CD1-CD1 4.5Å; L392-I398 HydrophobicContact CD2-CD1 4.2Å; L392-L403 HydrophobicContact CD1-CD1 3.94Å; L392-I406 HydrophobicContact CD1-CD1 4.12Å; L392-I406 HydrophobicContact CD1-CG2 4.33Å; L392-W416 HydrophobicContact CD1-CZ3 4.4Å; L392-I417 PolarHBondContact N-O 2.83Å; L392-L418 HydrophobicContact CB-CD2 4.13Å; L392-L418 HydrophobicContact CD1-CD2 4.5Å; L392-I421 WeakPolarHBondContact O-CD1 3.31Å
393	S	94.4	Very high	89.7	Confident	2 Å²	2	27.6 Å²	27.6	1%	0.014	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.9	137.9	-176.6	-56.4	0	0	0	0	111.5	A365 Y366 D391 C395 I417 N419	A365-S393 CarbonylContact C-O 3.56Å; A365-S393 VanDerWaalsContact CA-O 3.23Å; A365-S393 WeakPolarHBondContact CA-O 3.29Å; Y366-S393 PolarHBondContact N-O 3.39Å; D391-S393 WeakPolarHBondContact OD1-CB 3.36Å; D391-S393 PolarHBondContact OD1-N 3.13Å; D391-S393 PolarHBondContact OD1-OG 3.37Å; S393-C395 PolarHBondContact O-N 2.91Å; S393-I417 WeakPolarHBondContact OG-CG2 3.46Å; S393-N419 CarbonylContact C-O 3.43Å; S393-N419 WeakPolarHBondContact CA-O 3.46Å; S393-N419 WeakPolarHBondContact CB-O 3.16Å; S393-N419 WeakPolarHBondContact OG-CB 3.46Å; S393-N419 PolarHBondContact OG-N 2.83Å; S393-N419 VanDerWaalsContact OG-N 3.1Å
394	G	87.3	Confident	91	Very high	5 Å²	5	28.9 Å²	28.9	5%	0.052	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	6.4	179.4	0	0	0	0	0	116.2	L392 I396 N419	L392-G394 PolarHBondContact O-N 3.41Å; G394-I396 PolarHBondContact O-N 3.29Å; G394-N419 PolarHBondContact N-O 3.1Å
395	C	89.8	Confident	91.8	Very high	2 Å²	2	31 Å²	31	1%	0.014	16%	0.16	C	C	.	.			trans	-79.2	61.4	173.2	-65.3	0	0	0	0	111.4	L364 L392 S393 Y397 I398	L364-C395 PolarHBondContact O-SG 2.88Å; L392-C395 VanDerWaalsContact O-CB 3.23Å; L392-C395 WeakPolarHBondContact O-CB 3.45Å; L392-C395 PolarHBondContact O-N 3.13Å; L392-C395 VanDerWaalsContact O-N 3.11Å; L392-C395 PolarHBondContact O-SG 3.48Å; S393-C395 PolarHBondContact O-N 2.91Å; C395-Y397 PolarHBondContact O-N 3.37Å; C395-Y397 VanDerWaalsContact O-N 3.13Å; C395-I398 HydrophobicContact CB-CD1 3.47Å; C395-I398 VanDerWaalsContact CB-CD1 3.47Å; C395-I398 HydrophobicContact CB-CG1 3.95Å; C395-I398 PolarHBondContact O-N 3.05Å
396	I	83.2	Confident	92.4	Very high	4 Å²	4	24.8 Å²	24.8	2%	0.021	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-21	-167	64.4	165.7	0	0	0	114.8	G394 W423 L490	G394-I396 PolarHBondContact O-N 3.29Å; I396-W423 PolarHBondContact O-NE1 2.92Å; I396-L490 HydrophobicContact CD1-CB 3.69Å
397	Y	86.5	Confident	92.7	Very high	72 Å²	72	23.4 Å²	23.4	28%	0.282	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	0.2	-178.6	-64.7	-65.8	0	0	0	114.1	T368 L370 T371 Q372 C395 L490	T368-Y397 VanDerWaalsContact O-CD2 3.24Å; T368-Y397 WeakPolarHBondContact O-CD2 3.18Å; L370-Y397 WeakPolarHBondContact O-CB 3.49Å; T371-Y397 CarbonylContact C-O 3.55Å; T371-Y397 WeakPolarHBondContact CA-O 3.16Å; Q372-Y397 PolarHBondContact N-O 3.46Å; C395-Y397 PolarHBondContact O-N 3.37Å; C395-Y397 VanDerWaalsContact O-N 3.13Å; Y397-L490 HydrophobicContact CE2-CD1 4.35Å; Y397-L490 HydrophobicContact CE2-CD2 3.76Å; Y397-L490 WeakPolarHBondContact OH-CD2 3.43Å
398	I	90.7	Very high	92.7	Very high	3 Å²	3	28.7 Å²	28.7	2%	0.015	15%	0.146	C	C	.	.	S	Bend	trans	-67.3	-34.2	169.6	-66	-179.4	0	0	0	110.4	L370 Q372 L392 C395 G402 L403 I406 W423	L370-I398 HydrophobicContact CB-CG1 4.41Å; Q372-I398 WeakPolarHBondContact CB-O 3.36Å; L392-I398 HydrophobicContact CD1-CD1 4.5Å; L392-I398 HydrophobicContact CD2-CD1 4.2Å; C395-I398 HydrophobicContact CB-CD1 3.47Å; C395-I398 VanDerWaalsContact CB-CD1 3.47Å; C395-I398 HydrophobicContact CB-CG1 3.95Å; C395-I398 PolarHBondContact O-N 3.05Å; I398-G402 WeakPolarHBondContact O-CA 2.99Å; I398-G402 PolarHBondContact O-N 3.37Å; I398-L403 HydrophobicContact CG2-CB 4.41Å; I398-I406 HydrophobicContact CD1-CD1 4.33Å; I398-I406 HydrophobicContact CG2-CD1 3.97Å; I398-W423 HydrophobicContact CB-CZ2 4.45Å
399	E	87.9	Confident	92.5	Very high	93 Å²	93	27.2 Å²	27.2	44%	0.435	14%	0.141	S	C	.	.	H	α-helix	trans	60.1	169.1	-177.4	-56.9	179.9	-176.1	0	0	114	A401 G402 L403 W423	E399-A401 VanDerWaalsContact C-N 3.35Å; E399-A401 PolarHBondContact O-N 3.37Å; E399-G402 PolarHBondContact O-N 3.06Å; E399-L403 PolarHBondContact O-N 3.49Å; E399-W423 VanDerWaalsContact C-CZ2 3.49Å; E399-W423 VanDerWaalsContact C-CZ3 3.44Å; E399-W423 VanDerWaalsContact CA-CE2 3.44Å; E399-W423 VanDerWaalsContact CA-CZ2 3.44Å; E399-W423 VanDerWaalsContact N-CZ2 3.32Å; E399-W423 WeakPolarHBondContact O-CH2 3.13Å
400	S	90.9	Very high	92.2	Very high	31 Å²	31	25 Å²	25	22%	0.217	13%	0.133	C	C	.	.	H	α-helix	trans	-55.9	-47.2	-177.2	166.1	0	0	0	0	112.1	G402 L403 Q404 W423 D428	S400-G402 VanDerWaalsContact C-N 3.34Å; S400-G402 PolarHBondContact O-N 2.95Å; S400-L403 PolarHBondContact O-N 3.26Å; S400-Q404 VanDerWaalsContact O-CG 3.3Å; S400-Q404 WeakPolarHBondContact O-CG 3.47Å; S400-Q404 PolarHBondContact O-N 3.37Å; S400-Q404 PolarHBondContact OG-NE2 3.2Å; S400-W423 VanDerWaalsContact CA-CE3 3.5Å; S400-W423 VanDerWaalsContact N-CE3 3.28Å; S400-D428 WeakPolarHBondContact CB-OD1 3.16Å; S400-D428 PolarHBondContact OG-OD1 2.64Å
401	A	91.7	Very high	91.9	Very high	53 Å²	53	27.8 Å²	27.8	44%	0.438	15%	0.15	S	C	.	.	H	α-helix	trans	-63.8	-37.8	-179.2	0	0	0	0	0	112.8	E399 L405	E399-A401 VanDerWaalsContact C-N 3.35Å; E399-A401 PolarHBondContact O-N 3.37Å; A401-L405 PolarHBondContact O-N 2.87Å
402	G	93.7	Very high	91.6	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-67.4	-44.2	175.7	0	0	0	0	0	112.2	S375 I398 E399 S400 Q404 L405 I406	S375-G402 VanDerWaalsContact CB-O 3.23Å; S375-G402 WeakPolarHBondContact CB-O 3.39Å; I398-G402 WeakPolarHBondContact O-CA 2.99Å; I398-G402 PolarHBondContact O-N 3.37Å; E399-G402 PolarHBondContact O-N 3.06Å; S400-G402 VanDerWaalsContact C-N 3.34Å; S400-G402 PolarHBondContact O-N 2.95Å; G402-Q404 PolarHBondContact O-N 3.13Å; G402-L405 PolarHBondContact O-N 2.57Å; G402-I406 WeakPolarHBondContact O-CG1 3.27Å; G402-I406 PolarHBondContact O-N 3.08Å
403	L	95.4	Very high	91.4	Very high	2 Å²	2	28.9 Å²	28.9	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-63.1	-44.1	178	176.1	64.2	0	0	0	111.9	L392 I398 E399 S400 L405 I406 I407 W416 L418 W423 I424 D428	L392-L403 HydrophobicContact CD1-CD1 3.94Å; I398-L403 HydrophobicContact CG2-CB 4.41Å; E399-L403 PolarHBondContact O-N 3.49Å; S400-L403 PolarHBondContact O-N 3.26Å; L403-L405 VanDerWaalsContact C-N 3.26Å; L403-L405 PolarHBondContact O-N 3.04Å; L403-I406 PolarHBondContact O-N 3.49Å; L403-I406 VanDerWaalsContact O-N 3.14Å; L403-I407 HydrophobicContact CD1-CD1 4.09Å; L403-I407 HydrophobicContact CD1-CG1 4.2Å; L403-I407 HydrophobicContact CD2-CD1 4.4Å; L403-I407 HydrophobicContact CG-CD1 3.79Å; L403-I407 HydrophobicContact CG-CG1 4.35Å; L403-I407 VanDerWaalsContact O-CG1 3.3Å; L403-I407 WeakPolarHBondContact O-CG1 3.41Å; L403-I407 PolarHBondContact O-N 3.26Å; L403-W416 HydrophobicContact CD1-CZ3 4.25Å; L403-L418 HydrophobicContact CD1-CD2 4Å; L403-L418 HydrophobicContact CD2-CD1 4.49Å; L403-W423 HydrophobicContact CB-CH2 3.62Å; L403-W423 HydrophobicContact CB-CZ3 3.89Å; L403-W423 HydrophobicContact CD2-CH2 3.76Å; L403-W423 HydrophobicContact CD2-CZ3 3.64Å; L403-W423 HydrophobicContact CG-CH2 4.28Å; L403-W423 HydrophobicContact CG-CZ3 4.41Å; L403-I424 HydrophobicContact CD2-CD1 3.95Å; L403-I424 HydrophobicContact CD2-CG1 4.02Å; L403-D428 HydrophobicContact CD2-CB 4.44Å
404	Q	95.2	Very high	91.4	Very high	40 Å²	40	30 Å²	30	19%	0.187	16%	0.159	C	C	.	.	H	α-helix	trans	-59.8	-37.3	176.9	-71.3	-179	20.6	0	0	112.2	S400 G402 K408 D428 V431	S400-Q404 VanDerWaalsContact O-CG 3.3Å; S400-Q404 WeakPolarHBondContact O-CG 3.47Å; S400-Q404 PolarHBondContact O-N 3.37Å; S400-Q404 PolarHBondContact OG-NE2 3.2Å; G402-Q404 PolarHBondContact O-N 3.13Å; Q404-K408 WeakPolarHBondContact O-CD 3.39Å; Q404-K408 VanDerWaalsContact O-CG 3.26Å; Q404-K408 WeakPolarHBondContact O-CG 3.42Å; Q404-K408 PolarHBondContact O-N 3.21Å; Q404-K408 VanDerWaalsContact O-N 3.13Å; Q404-D428 WeakPolarHBondContact CG-OD1 3.47Å; Q404-D428 PolarHBondContact NE2-OD1 2.93Å; Q404-V431 HydrophobicContact CB-CG1 4.06Å; Q404-V431 HydrophobicContact CG-CB 4.09Å; Q404-V431 HydrophobicContact CG-CG1 4.11Å; Q404-V431 HydrophobicContact CG-CG2 3.94Å
405	L	94.1	Very high	91.9	Very high	53 Å²	53	32.1 Å²	32.1	28%	0.277	17%	0.168	S	C	.	.	H	α-helix	trans	-68.2	-41.8	175	-172.9	69.4	0	0	0	111.5	S375 A401 G402 L403 K408 S409	S375-L405 WeakPolarHBondContact O-CD2 3.22Å; S375-L405 WeakPolarHBondContact OG-CD2 3.37Å; A401-L405 PolarHBondContact O-N 2.87Å; G402-L405 PolarHBondContact O-N 2.57Å; L403-L405 VanDerWaalsContact C-N 3.26Å; L403-L405 PolarHBondContact O-N 3.04Å; L405-K408 PolarHBondContact O-N 3.15Å; L405-S409 WeakPolarHBondContact O-CB 3.49Å; L405-S409 PolarHBondContact O-N 3.06Å; L405-S409 PolarHBondContact O-OG 2.95Å
406	I	94.5	Very high	92.3	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.2	-49.9	175.8	-66.2	167.2	0	0	0	110.2	F378 L390 L392 I398 G402 L403 K408 S409 V410 W416	F378-I406 HydrophobicContact CB-CG1 4.31Å; F378-I406 HydrophobicContact CD1-CG2 3.88Å; F378-I406 HydrophobicContact CD2-CD1 4.33Å; F378-I406 HydrophobicContact CD2-CG1 3.97Å; F378-I406 HydrophobicContact CE1-CG2 4.01Å; F378-I406 HydrophobicContact CE2-CD1 4.38Å; F378-I406 HydrophobicContact CE2-CG1 4.43Å; F378-I406 HydrophobicContact CG-CG1 4.07Å; F378-I406 HydrophobicContact CG-CG2 4.16Å; F378-I406 HydrophobicContact CZ-CG2 4.39Å; L390-I406 HydrophobicContact CD2-CG2 3.9Å; L392-I406 HydrophobicContact CD1-CD1 4.12Å; L392-I406 HydrophobicContact CD1-CG2 4.33Å; I398-I406 HydrophobicContact CD1-CD1 4.33Å; I398-I406 HydrophobicContact CG2-CD1 3.97Å; G402-I406 WeakPolarHBondContact O-CG1 3.27Å; G402-I406 PolarHBondContact O-N 3.08Å; L403-I406 PolarHBondContact O-N 3.49Å; L403-I406 VanDerWaalsContact O-N 3.14Å; I406-K408 VanDerWaalsContact C-N 3.3Å; I406-K408 PolarHBondContact O-N 3.02Å; I406-S409 WeakPolarHBondContact O-CA 3.38Å; I406-S409 WeakPolarHBondContact O-CB 3.45Å; I406-S409 PolarHBondContact O-N 3.12Å; I406-V410 HydrophobicContact CG2-CG2 3.97Å; I406-V410 VanDerWaalsContact O-CG2 3.22Å; I406-V410 WeakPolarHBondContact O-CG2 3.27Å; I406-V410 PolarHBondContact O-N 3.28Å; I406-W416 HydrophobicContact CG2-CH2 4.11Å; I406-W416 HydrophobicContact CG2-CZ3 4.44Å
407	I	94.2	Very high	92.9	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-53.7	-47.2	177.6	-71.6	166.3	0	0	0	111.5	L403 S409 W416 V431 L432 N435	L403-I407 HydrophobicContact CD1-CD1 4.09Å; L403-I407 HydrophobicContact CD1-CG1 4.2Å; L403-I407 HydrophobicContact CD2-CD1 4.4Å; L403-I407 HydrophobicContact CG-CD1 3.79Å; L403-I407 HydrophobicContact CG-CG1 4.35Å; L403-I407 VanDerWaalsContact O-CG1 3.3Å; L403-I407 WeakPolarHBondContact O-CG1 3.41Å; L403-I407 PolarHBondContact O-N 3.26Å; I407-S409 PolarHBondContact O-N 2.84Å; I407-W416 HydrophobicContact CB-CH2 4.31Å; I407-W416 HydrophobicContact CG1-CH2 3.64Å; I407-W416 HydrophobicContact CG1-CZ2 4.15Å; I407-W416 HydrophobicContact CG1-CZ3 3.94Å; I407-V431 HydrophobicContact CB-CG1 4.32Å; I407-V431 HydrophobicContact CG2-CG1 3.93Å; I407-L432 HydrophobicContact CD1-CB 3.97Å; I407-L432 HydrophobicContact CD1-CD1 4.1Å; I407-L432 HydrophobicContact CG1-CD1 4.01Å; I407-L432 HydrophobicContact CG2-CB 4.44Å; I407-L432 HydrophobicContact CG2-CD1 4.1Å; I407-N435 HydrophobicContact CG2-CB 4.15Å
408	K	92.4	Very high	93.4	Very high	112 Å²	112	28.8 Å²	28.8	49%	0.487	15%	0.154	S	C	.	.	H	α-helix	trans	-64.8	-27.2	178.4	-72.9	169.8	-176.1	174.2	0	112.7	Q404 L405 I406 T411 V431	Q404-K408 WeakPolarHBondContact O-CD 3.39Å; Q404-K408 VanDerWaalsContact O-CG 3.26Å; Q404-K408 WeakPolarHBondContact O-CG 3.42Å; Q404-K408 PolarHBondContact O-N 3.21Å; Q404-K408 VanDerWaalsContact O-N 3.13Å; L405-K408 PolarHBondContact O-N 3.15Å; I406-K408 VanDerWaalsContact C-N 3.3Å; I406-K408 PolarHBondContact O-N 3.02Å; K408-T411 WeakPolarHBondContact O-CG2 3.19Å; K408-V431 HydrophobicContact CG-CG1 4.19Å
409	S	91.2	Very high	93.4	Very high	30 Å²	30	29.4 Å²	29.4	21%	0.21	16%	0.158	C	C	.	.	H	α-helix	trans	-84	-35.8	-178.1	-54.2	0	0	0	0	112.8	F378 N379 L405 I406 I407	F378-S409 WeakPolarHBondContact O-CB 3.22Å; N379-S409 WeakPolarHBondContact CA-OG 3.36Å; L405-S409 WeakPolarHBondContact O-CB 3.49Å; L405-S409 PolarHBondContact O-N 3.06Å; L405-S409 PolarHBondContact O-OG 2.95Å; I406-S409 WeakPolarHBondContact O-CA 3.38Å; I406-S409 WeakPolarHBondContact O-CB 3.45Å; I406-S409 PolarHBondContact O-N 3.12Å; I407-S409 PolarHBondContact O-N 2.84Å
410	V	91.2	Very high	93.3	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.006	14%	0.141	C	C	.	.			trans	-116.7	58.9	-176.6	-68.2	0	0	0	0	112.9	F378 F384 L390 I406 Q412 V413 W416	F378-V410 HydrophobicContact CD1-CG1 3.85Å; F378-V410 HydrophobicContact CD1-CG2 4.43Å; F378-V410 HydrophobicContact CE1-CG1 4.32Å; F384-V410 HydrophobicContact CB-CG1 3.84Å; F384-V410 HydrophobicContact CD2-CG1 4.43Å; L390-V410 HydrophobicContact CD2-CG2 4.14Å; I406-V410 HydrophobicContact CG2-CG2 3.97Å; I406-V410 VanDerWaalsContact O-CG2 3.22Å; I406-V410 WeakPolarHBondContact O-CG2 3.27Å; I406-V410 PolarHBondContact O-N 3.28Å; V410-Q412 PolarHBondContact O-N 3.37Å; V410-Q412 VanDerWaalsContact O-N 3.12Å; V410-V413 HydrophobicContact CB-CG2 3.82Å; V410-V413 HydrophobicContact CG2-CG2 3.91Å; V410-V413 WeakPolarHBondContact O-CG2 3.41Å; V410-V413 PolarHBondContact O-N 3.02Å; V410-W416 HydrophobicContact CG2-CH2 3.81Å; V410-W416 HydrophobicContact CG2-CZ2 3.92Å
411	T	91.3	Very high	93.1	Very high	58 Å²	58	24.4 Å²	24.4	36%	0.356	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-20.5	-176.2	61.3	0	0	0	0	115.2	K408 N435	K408-T411 WeakPolarHBondContact O-CG2 3.19Å; T411-N435 WeakPolarHBondContact CB-O 3.09Å; T411-N435 HydrophobicContact CG2-CB 4.16Å
412	Q	90.6	Very high	92.5	Very high	45 Å²	45	22.1 Å²	22.1	21%	0.21	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-3.9	-178.2	74.6	-68.3	-22.8	0	0	114.9	F384 K385 L387 V410 E414 I438	F384-Q412 PolarHBondContact O-NE2 3.42Å; K385-Q412 WeakPolarHBondContact O-CG 3.39Å; L387-Q412 WeakPolarHBondContact O-CG 3.23Å; V410-Q412 PolarHBondContact O-N 3.37Å; V410-Q412 VanDerWaalsContact O-N 3.12Å; Q412-E414 PolarHBondContact O-N 3.23Å; Q412-I438 HydrophobicContact CB-CD1 4.29Å; Q412-I438 WeakPolarHBondContact O-CD1 3.47Å
413	V	93.8	Very high	92.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.114	C	C	.	.			trans	-65.6	127.1	178.2	172.3	0	0	0	0	109.6	L387 L390 V410 H415 W416	L387-V413 HydrophobicContact CB-CG2 4.15Å; L387-V413 HydrophobicContact CD2-CG2 3.94Å; L387-V413 HydrophobicContact CG-CG2 4.05Å; L390-V413 HydrophobicContact CB-CG1 4Å; L390-V413 HydrophobicContact CB-CG2 4.45Å; V410-V413 HydrophobicContact CB-CG2 3.82Å; V410-V413 HydrophobicContact CG2-CG2 3.91Å; V410-V413 WeakPolarHBondContact O-CG2 3.41Å; V410-V413 PolarHBondContact O-N 3.02Å; V413-H415 WeakPolarHBondContact CG1-O 3.43Å; V413-W416 HydrophobicContact CB-CZ2 4Å; V413-W416 HydrophobicContact CG1-CD2 4.13Å; V413-W416 HydrophobicContact CG1-CG 4.17Å; V413-W416 HydrophobicContact CG1-CZ2 4.22Å; V413-W416 HydrophobicContact CG2-CZ2 4.44Å; V413-W416 PolarHBondContact O-NE1 3.37Å
414	E	94.8	Very high	91.8	Very high	26 Å²	26	22.6 Å²	22.6	12%	0.121	11%	0.114	C	C	.	.			trans	-92.8	-28.8	-179.6	-61.8	-173.3	172.1	0	0	112.2	I388 Q412 I438 R440 T441	I388-E414 HydrophobicContact CG2-CB 4.05Å; I388-E414 HydrophobicContact CG2-CG 4.1Å; I388-E414 PolarHBondContact O-N 2.64Å; Q412-E414 PolarHBondContact O-N 3.23Å; E414-I438 HydrophobicContact CG-CD1 3.93Å; E414-I438 HydrophobicContact CG-CG1 4.38Å; E414-R440 HydrophobicContact CB-CB 4.33Å; E414-R440 HydrophobicContact CB-CG 4.22Å; E414-R440 PolarHBondContact O-N 3.48Å; E414-R440 IonicContact OE1-CZ 2.63Å; E414-R440 IonicContact OE1-NE 3.31Å; E414-R440 IonicContact OE1-NH1 2.8Å; E414-R440 PolarHBondContact OE1-NH1 2.85Å; E414-R440 IonicContact OE1-NH2 3.07Å; E414-R440 PolarHBondContact OE1-NH2 3.19Å; E414-R440 VanDerWaalsContact OE2-CD 3.28Å; E414-R440 WeakPolarHBondContact OE2-CD 3.36Å; E414-R440 IonicContact OE2-CZ 2.69Å; E414-R440 IonicContact OE2-NE 2.65Å; E414-R440 PolarHBondContact OE2-NE 3.47Å; E414-R440 IonicContact OE2-NH1 3.56Å; E414-R440 PolarHBondContact OE2-NH1 3.25Å; E414-R440 IonicContact OE2-NH2 2.95Å; E414-T441 PolarHBondContact O-N 3.04Å
415	H	96.9	Very high	91.5	Very high	49 Å²	49	20.8 Å²	20.8	23%	0.227	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	111.6	-176.5	-52.2	-81.7	0	0	0	111	I388 Y389 L390 V413 T441	I388-H415 PolarHBondContact O-N 3.39Å; Y389-H415 HydrophobicContact CD2-CB 3.38Å; Y389-H415 AromaticContact CD2-CG 3.91Å; Y389-H415 HydrophobicContact CE2-CB 4.05Å; Y389-H415 HydrophobicContact CG-CB 4.01Å; L390-H415 PolarHBondContact N-O 3.08Å; V413-H415 WeakPolarHBondContact CG1-O 3.43Å; H415-T441 WeakPolarHBondContact CA-O 3.48Å; H415-T441 WeakPolarHBondContact ND1-CB 3.46Å; H415-T441 PolarHBondContact ND1-OG1 3.38Å
416	W	97.3	Very high	91.4	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	115.3	178.7	-75.8	89.4	0	0	0	110.4	L390 L392 L403 I406 I407 V410 V413 L418 L432 T441 L442 E443	L390-W416 HydrophobicContact CD2-CE3 4.5Å; L390-W416 HydrophobicContact CD2-CH2 3.92Å; L390-W416 HydrophobicContact CD2-CZ3 3.8Å; L392-W416 HydrophobicContact CD1-CZ3 4.4Å; L403-W416 HydrophobicContact CD1-CZ3 4.25Å; I406-W416 HydrophobicContact CG2-CH2 4.11Å; I406-W416 HydrophobicContact CG2-CZ3 4.44Å; I407-W416 HydrophobicContact CB-CH2 4.31Å; I407-W416 HydrophobicContact CG1-CH2 3.64Å; I407-W416 HydrophobicContact CG1-CZ2 4.15Å; I407-W416 HydrophobicContact CG1-CZ3 3.94Å; V410-W416 HydrophobicContact CG2-CH2 3.81Å; V410-W416 HydrophobicContact CG2-CZ2 3.92Å; V413-W416 HydrophobicContact CB-CZ2 4Å; V413-W416 HydrophobicContact CG1-CD2 4.13Å; V413-W416 HydrophobicContact CG1-CG 4.17Å; V413-W416 HydrophobicContact CG1-CZ2 4.22Å; V413-W416 HydrophobicContact CG2-CZ2 4.44Å; V413-W416 PolarHBondContact O-NE1 3.37Å; W416-L418 HydrophobicContact CE3-CD1 4.44Å; W416-L418 HydrophobicContact CE3-CD2 4.21Å; W416-L432 HydrophobicContact CD2-CD1 3.87Å; W416-L432 HydrophobicContact CG-CD1 4.01Å; W416-L432 HydrophobicContact CZ2-CD1 4.25Å; W416-T441 PolarHBondContact N-O 3.35Å; W416-L442 HydrophobicContact CB-CD1 4.08Å; W416-L442 WeakPolarHBondContact O-CA 3.45Å; W416-E443 PolarHBondContact O-N 3.31Å
417	I	97.7	Very high	91.4	Very high	7 Å²	7	23.4 Å²	23.4	4%	0.036	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	115.5	175.6	-44.5	-57.3	0	0	0	108.4	Y389 L390 D391 L392 S393 N419 T441 E443	Y389-I417 HydrophobicContact CE1-CG1 4.27Å; Y389-I417 HydrophobicContact CE2-CD1 4.36Å; Y389-I417 HydrophobicContact CE2-CG1 4.04Å; Y389-I417 WeakPolarHBondContact OH-CG1 3.49Å; L390-I417 PolarHBondContact O-N 3.03Å; L390-I417 VanDerWaalsContact O-N 3.09Å; D391-I417 HydrophobicContact CB-CB 3.89Å; D391-I417 HydrophobicContact CB-CG1 4.25Å; L392-I417 PolarHBondContact N-O 2.83Å; S393-I417 WeakPolarHBondContact OG-CG2 3.46Å; I417-N419 WeakPolarHBondContact CG2-ND2 3.34Å; I417-T441 HydrophobicContact CD1-CG2 4.2Å; I417-E443 HydrophobicContact CD1-CB 3.7Å; I417-E443 HydrophobicContact CG2-CB 4.17Å; I417-E443 HydrophobicContact CG2-CG 4.47Å
418	L	95.5	Very high	91.4	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	12%	0.123	C	C	.	.			trans	-133.5	51.3	-167.8	-63.9	176.8	0	0	0	110.2	L392 L403 W416 I421 I424 L442 E443 N447	L392-L418 HydrophobicContact CB-CD2 4.13Å; L392-L418 HydrophobicContact CD1-CD2 4.5Å; L403-L418 HydrophobicContact CD1-CD2 4Å; L403-L418 HydrophobicContact CD2-CD1 4.49Å; W416-L418 HydrophobicContact CE3-CD1 4.44Å; W416-L418 HydrophobicContact CE3-CD2 4.21Å; L418-I421 HydrophobicContact CB-CD1 4.09Å; L418-I421 HydrophobicContact CD2-CD1 4.06Å; L418-I424 HydrophobicContact CB-CD1 3.79Å; L418-I424 HydrophobicContact CD1-CD1 4.15Å; L418-I424 HydrophobicContact CG-CD1 4.41Å; L418-L442 HydrophobicContact CD1-CD1 4.38Å; L418-E443 PolarHBondContact N-O 3.1Å; L418-N447 PolarHBondContact O-ND2 2.89Å; L418-N447 PolarHBondContact O-OD1 3.31Å; L418-N447 VanDerWaalsContact O-OD1 3.09Å
419	N	91.6	Very high	91.4	Very high	16 Å²	16	18.2 Å²	18.2	9%	0.086	10%	0.1	C	C	.	.			trans	-86.5	153.9	-175.2	-57.8	-29.2	0	0	0	112.3	S393 G394 I417 I421 E443 V445	S393-N419 CarbonylContact C-O 3.43Å; S393-N419 WeakPolarHBondContact CA-O 3.46Å; S393-N419 WeakPolarHBondContact CB-O 3.16Å; S393-N419 WeakPolarHBondContact OG-CB 3.46Å; S393-N419 PolarHBondContact OG-N 2.83Å; S393-N419 VanDerWaalsContact OG-N 3.1Å; G394-N419 PolarHBondContact N-O 3.1Å; I417-N419 WeakPolarHBondContact CG2-ND2 3.34Å; N419-I421 VanDerWaalsContact C-N 3.27Å; N419-I421 VanDerWaalsContact O-CG1 3.31Å; N419-I421 WeakPolarHBondContact O-CG1 3.28Å; N419-I421 PolarHBondContact O-N 2.95Å; N419-E443 PolarHBondContact ND2-OE1 3.11Å; N419-E443 WeakPolarHBondContact OD1-CG 3.42Å; N419-E443 PolarHBondContact OD1-O 3.04Å; N419-V445 CarbonylContact C-O 3.28Å; N419-V445 WeakPolarHBondContact CA-O 3.22Å; N419-V445 HydrophobicContact CB-CB 4.09Å; N419-V445 WeakPolarHBondContact OD1-CB 3.45Å; N419-V445 PolarHBondContact OD1-N 3.32Å
420	D	84.5	Confident	91.5	Very high	16 Å²	16	21.2 Å²	21.2	9%	0.086	11%	0.114	C	C	.	.	S	Bend	trans	55.1	39.2	177.7	-57	-53.9	0	0	0	113.7	Y366 P422 V445 N446 N447	Y366-D420 HydrophobicContact CE1-CB 4.25Å; Y366-D420 WeakPolarHBondContact CE1-OD2 3.31Å; Y366-D420 PolarHBondContact OH-OD2 2.73Å; D420-P422 WeakPolarHBondContact O-CD 3.28Å; D420-V445 PolarHBondContact N-O 3.17Å; D420-N446 WeakPolarHBondContact OD1-CB 3.23Å; D420-N446 PolarHBondContact OD1-ND2 3.41Å; D420-N447 PolarHBondContact N-OD1 3.37Å; D420-N447 VanDerWaalsContact N-OD1 3.09Å
421	I	87.1	Confident	91.7	Very high	2 Å²	2	22 Å²	22	1%	0.01	12%	0.119	C	C	.	.			trans	-116.2	91.3	177.7	-48	-177.5	0	0	0	109	L392 L418 N419 W423 I424 N447	L392-I421 WeakPolarHBondContact O-CD1 3.31Å; L418-I421 HydrophobicContact CB-CD1 4.09Å; L418-I421 HydrophobicContact CD2-CD1 4.06Å; N419-I421 VanDerWaalsContact C-N 3.27Å; N419-I421 VanDerWaalsContact O-CG1 3.31Å; N419-I421 WeakPolarHBondContact O-CG1 3.28Å; N419-I421 PolarHBondContact O-N 2.95Å; I421-W423 VanDerWaalsContact C-N 3.26Å; I421-W423 HydrophobicContact CG2-CD2 3.63Å; I421-W423 HydrophobicContact CG2-CE3 4.01Å; I421-W423 HydrophobicContact CG2-CG 4.26Å; I421-W423 HydrophobicContact CG2-CH2 3.6Å; I421-W423 HydrophobicContact CG2-CZ2 3.23Å; I421-W423 HydrophobicContact CG2-CZ3 3.98Å; I421-W423 PolarHBondContact O-N 3.45Å; I421-I424 HydrophobicContact CB-CD1 3.65Å; I421-I424 HydrophobicContact CB-CG1 3.86Å; I421-I424 HydrophobicContact CD1-CD1 3.87Å; I421-I424 HydrophobicContact CG1-CD1 4.24Å; I421-I424 HydrophobicContact CG2-CD1 3.83Å; I421-I424 HydrophobicContact CG2-CG1 3.59Å; I421-I424 PolarHBondContact O-N 2.98Å; I421-N447 PolarHBondContact N-OD1 3.33Å; I421-N447 WeakPolarHBondContact O-CB 3.45Å; I421-N447 PolarHBondContact O-OD1 3.17Å
422	P	80	Confident	91.9	Very high	5 Å²	5	19.2 Å²	19.2	3%	0.032	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-14.8	-167.7	28.1	-35.9	0	0	0	114.7	D420 Y494	D420-P422 WeakPolarHBondContact O-CD 3.28Å; P422-Y494 HydrophobicContact CG-CD1 3.93Å; P422-Y494 HydrophobicContact CG-CE1 4.02Å
423	W	84.5	Confident	91.8	Very high	11 Å²	11	17.2 Å²	17.2	4%	0.042	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-4.2	179.9	50.9	-108.2	0	0	0	113.9	I396 I398 E399 S400 L403 I421 S425	I396-W423 PolarHBondContact O-NE1 2.92Å; I398-W423 HydrophobicContact CB-CZ2 4.45Å; E399-W423 VanDerWaalsContact C-CZ2 3.49Å; E399-W423 VanDerWaalsContact C-CZ3 3.44Å; E399-W423 VanDerWaalsContact CA-CE2 3.44Å; E399-W423 VanDerWaalsContact CA-CZ2 3.44Å; E399-W423 VanDerWaalsContact N-CZ2 3.32Å; E399-W423 WeakPolarHBondContact O-CH2 3.13Å; S400-W423 VanDerWaalsContact CA-CE3 3.5Å; S400-W423 VanDerWaalsContact N-CE3 3.28Å; L403-W423 HydrophobicContact CB-CH2 3.62Å; L403-W423 HydrophobicContact CB-CZ3 3.89Å; L403-W423 HydrophobicContact CD2-CH2 3.76Å; L403-W423 HydrophobicContact CD2-CZ3 3.64Å; L403-W423 HydrophobicContact CG-CH2 4.28Å; L403-W423 HydrophobicContact CG-CZ3 4.41Å; I421-W423 VanDerWaalsContact C-N 3.26Å; I421-W423 HydrophobicContact CG2-CD2 3.63Å; I421-W423 HydrophobicContact CG2-CE3 4.01Å; I421-W423 HydrophobicContact CG2-CG 4.26Å; I421-W423 HydrophobicContact CG2-CH2 3.6Å; I421-W423 HydrophobicContact CG2-CZ2 3.23Å; I421-W423 HydrophobicContact CG2-CZ3 3.98Å; I421-W423 PolarHBondContact O-N 3.45Å; W423-S425 PolarHBondContact O-N 3.09Å
424	I	89	Confident	91.7	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.005	12%	0.117	C	C	.	.			trans	-63.1	131.3	176.5	-71	-178.6	0	0	0	109.3	L403 L418 I421 D428 L429 I510	L403-I424 HydrophobicContact CD2-CD1 3.95Å; L403-I424 HydrophobicContact CD2-CG1 4.02Å; L418-I424 HydrophobicContact CB-CD1 3.79Å; L418-I424 HydrophobicContact CD1-CD1 4.15Å; L418-I424 HydrophobicContact CG-CD1 4.41Å; I421-I424 HydrophobicContact CB-CD1 3.65Å; I421-I424 HydrophobicContact CB-CG1 3.86Å; I421-I424 HydrophobicContact CD1-CD1 3.87Å; I421-I424 HydrophobicContact CG1-CD1 4.24Å; I421-I424 HydrophobicContact CG2-CD1 3.83Å; I421-I424 HydrophobicContact CG2-CG1 3.59Å; I421-I424 PolarHBondContact O-N 2.98Å; I424-D428 HydrophobicContact CG2-CB 4.36Å; I424-L429 HydrophobicContact CG2-CD2 4.24Å; I424-L429 HydrophobicContact CG2-CG 4.48Å; I424-I510 HydrophobicContact CB-CD1 4.44Å; I424-I510 HydrophobicContact CG2-CD1 3.75Å; I424-I510 HydrophobicContact CG2-CG1 4.06Å
425	S	89.8	Confident	91.5	Very high	3 Å²	3	22.1 Å²	22.1	2%	0.021	13%	0.126	C	C	.	.			trans	-129.5	173.9	-176.1	68.6	0	0	0	0	111.7	W423 T427 D428 L429	W423-S425 PolarHBondContact O-N 3.09Å; S425-T427 PolarHBondContact O-N 3.17Å; S425-T427 VanDerWaalsContact O-N 3.13Å; S425-T427 PolarHBondContact OG-N 2.75Å; S425-T427 PolarHBondContact OG-OG1 3.46Å; S425-D428 PolarHBondContact N-OD2 3.46Å; S425-D428 PolarHBondContact O-N 3.04Å; S425-D428 VanDerWaalsContact O-N 3.08Å; S425-D428 PolarHBondContact OG-OD2 3.15Å; S425-L429 PolarHBondContact O-N 3.11Å
426	D	92.1	Very high	91.1	Very high	27 Å²	27	19.8 Å²	19.8	14%	0.144	12%	0.115	C	C	.	.	H	α-helix	trans	-53.7	-30.6	171.1	-72.6	-8.2	0	0	0	113.3	L429 N430 I510 T511 G514	D426-L429 PolarHBondContact O-N 3.05Å; D426-N430 VanDerWaalsContact O-CB 3.31Å; D426-N430 WeakPolarHBondContact O-CB 3.39Å; D426-N430 PolarHBondContact O-N 2.97Å; D426-I510 WeakPolarHBondContact OD1-CA 3.4Å; D426-T511 PolarHBondContact OD1-N 3.29Å; D426-T511 PolarHBondContact OD2-OG1 2.95Å; D426-G514 VanDerWaalsContact CG-CA 3.49Å; D426-G514 WeakPolarHBondContact OD1-CA 3.1Å; D426-G514 PolarHBondContact OD1-N 3.24Å; D426-G514 PolarHBondContact OD2-N 3.28Å
427	T	93.1	Very high	90.4	Very high	80 Å²	80	23.7 Å²	23.7	49%	0.491	14%	0.142	S	C	.	.	H	α-helix	trans	-66.5	-40	179.2	68.2	0	0	0	0	111.6	S425 N430 V431	S425-T427 PolarHBondContact O-N 3.17Å; S425-T427 VanDerWaalsContact O-N 3.13Å; S425-T427 PolarHBondContact OG-N 2.75Å; S425-T427 PolarHBondContact OG-OG1 3.46Å; T427-N430 PolarHBondContact O-N 3.44Å; T427-V431 WeakPolarHBondContact O-CG2 3.3Å; T427-V431 PolarHBondContact O-N 2.83Å
428	D	94.4	Very high	89.8	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.011	16%	0.158	C	C	.	.	H	α-helix	trans	-70	-41.1	178.8	-52.3	-64.1	0	0	0	110.8	S400 L403 Q404 I424 S425 N430 V431 L432	S400-D428 WeakPolarHBondContact CB-OD1 3.16Å; S400-D428 PolarHBondContact OG-OD1 2.64Å; L403-D428 HydrophobicContact CD2-CB 4.44Å; Q404-D428 WeakPolarHBondContact CG-OD1 3.47Å; Q404-D428 PolarHBondContact NE2-OD1 2.93Å; I424-D428 HydrophobicContact CG2-CB 4.36Å; S425-D428 PolarHBondContact N-OD2 3.46Å; S425-D428 PolarHBondContact O-N 3.04Å; S425-D428 VanDerWaalsContact O-N 3.08Å; S425-D428 PolarHBondContact OG-OD2 3.15Å; D428-N430 VanDerWaalsContact C-N 3.33Å; D428-N430 PolarHBondContact O-N 2.64Å; D428-V431 PolarHBondContact O-N 3.23Å; D428-L432 WeakPolarHBondContact O-CB 3.48Å; D428-L432 PolarHBondContact O-N 3.08Å
429	L	94	Very high	89.6	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-64.9	-37.5	174.3	-61.1	-172.8	0	0	0	112.1	I424 S425 D426 V431 L432 G433 M444 I510 S517 V518	I424-L429 HydrophobicContact CG2-CD2 4.24Å; I424-L429 HydrophobicContact CG2-CG 4.48Å; S425-L429 PolarHBondContact O-N 3.11Å; D426-L429 PolarHBondContact O-N 3.05Å; L429-V431 VanDerWaalsContact C-N 3.34Å; L429-V431 PolarHBondContact O-N 3.11Å; L429-L432 HydrophobicContact CD2-CD2 4.46Å; L429-L432 WeakPolarHBondContact O-CB 3.48Å; L429-L432 PolarHBondContact O-N 2.84Å; L429-G433 PolarHBondContact O-N 3.29Å; L429-M444 HydrophobicContact CD1-CE 4.16Å; L429-M444 HydrophobicContact CD1-SD 3.98Å; L429-M444 HydrophobicContact CD2-CE 4.38Å; L429-M444 HydrophobicContact CD2-SD 3.39Å; L429-M444 WeakPolarHBondContact CD2-SD 3.45Å; L429-M444 HydrophobicContact CG-SD 4.31Å; L429-I510 HydrophobicContact CD1-CB 4.5Å; L429-I510 HydrophobicContact CD1-CD1 4.33Å; L429-I510 HydrophobicContact CD1-CG1 4.15Å; L429-I510 HydrophobicContact CD1-CG2 3.71Å; L429-S517 PolarHBondContact O-OG 3.5Å; L429-V518 HydrophobicContact CB-CG1 4.18Å; L429-V518 WeakPolarHBondContact O-CG1 3.46Å
430	N	93.2	Very high	89.7	Confident	94 Å²	94	30.8 Å²	30.8	50%	0.503	17%	0.172	S	C	.	.	H	α-helix	trans	-64.5	-40.9	175	-174	57.1	0	0	0	111.6	D426 T427 D428 S434 S517	D426-N430 VanDerWaalsContact O-CB 3.31Å; D426-N430 WeakPolarHBondContact O-CB 3.39Å; D426-N430 PolarHBondContact O-N 2.97Å; T427-N430 PolarHBondContact O-N 3.44Å; D428-N430 VanDerWaalsContact C-N 3.33Å; D428-N430 PolarHBondContact O-N 2.64Å; N430-S434 WeakPolarHBondContact O-CB 3.39Å; N430-S434 PolarHBondContact O-N 3.09Å; N430-S434 PolarHBondContact O-OG 2.93Å; N430-S517 WeakPolarHBondContact CA-OG 3.46Å; N430-S517 PolarHBondContact N-OG 3.17Å
431	V	94.8	Very high	90.2	Very high	16 Å²	16	30.7 Å²	30.7	10%	0.097	17%	0.172	C	C	.	.	H	α-helix	trans	-62.9	-43	172.8	175.3	0	0	0	0	110.9	Q404 I407 K408 T427 D428 L429 S434 N435	Q404-V431 HydrophobicContact CB-CG1 4.06Å; Q404-V431 HydrophobicContact CG-CB 4.09Å; Q404-V431 HydrophobicContact CG-CG1 4.11Å; Q404-V431 HydrophobicContact CG-CG2 3.94Å; I407-V431 HydrophobicContact CB-CG1 4.32Å; I407-V431 HydrophobicContact CG2-CG1 3.93Å; K408-V431 HydrophobicContact CG-CG1 4.19Å; T427-V431 WeakPolarHBondContact O-CG2 3.3Å; T427-V431 PolarHBondContact O-N 2.83Å; D428-V431 PolarHBondContact O-N 3.23Å; L429-V431 VanDerWaalsContact C-N 3.34Å; L429-V431 PolarHBondContact O-N 3.11Å; V431-S434 WeakPolarHBondContact CA-OG 3.37Å; V431-S434 PolarHBondContact O-N 3.04Å; V431-S434 PolarHBondContact O-OG 2.81Å; V431-N435 WeakPolarHBondContact CG1-ND2 3.47Å; V431-N435 WeakPolarHBondContact O-CB 3.2Å; V431-N435 PolarHBondContact O-N 3.35Å; V431-N435 PolarHBondContact O-ND2 3.27Å
432	L	94.4	Very high	90.6	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-58.8	-54.5	174.7	-174.4	62.8	0	0	0	112.3	I407 W416 D428 L429 S434 N435 C436 I439 L442 V518	I407-L432 HydrophobicContact CD1-CB 3.97Å; I407-L432 HydrophobicContact CD1-CD1 4.1Å; I407-L432 HydrophobicContact CG1-CD1 4.01Å; I407-L432 HydrophobicContact CG2-CB 4.44Å; I407-L432 HydrophobicContact CG2-CD1 4.1Å; W416-L432 HydrophobicContact CD2-CD1 3.87Å; W416-L432 HydrophobicContact CG-CD1 4.01Å; W416-L432 HydrophobicContact CZ2-CD1 4.25Å; D428-L432 WeakPolarHBondContact O-CB 3.48Å; D428-L432 PolarHBondContact O-N 3.08Å; L429-L432 HydrophobicContact CD2-CD2 4.46Å; L429-L432 WeakPolarHBondContact O-CB 3.48Å; L429-L432 PolarHBondContact O-N 2.84Å; L432-S434 VanDerWaalsContact C-N 3.31Å; L432-S434 PolarHBondContact O-N 2.87Å; L432-N435 PolarHBondContact O-N 2.71Å; L432-C436 HydrophobicContact CD1-CB 4.19Å; L432-C436 WeakPolarHBondContact O-CB 3.34Å; L432-C436 PolarHBondContact O-N 2.65Å; L432-I439 HydrophobicContact CD1-CD1 3.79Å; L432-I439 HydrophobicContact CD2-CD1 4.17Å; L432-I439 HydrophobicContact CG-CD1 3.61Å; L432-L442 HydrophobicContact CD2-CD1 3.75Å; L432-L442 HydrophobicContact CD2-CD2 4.26Å; L432-V518 HydrophobicContact CB-CG1 4.35Å; L432-V518 HydrophobicContact CD2-CG1 4.14Å; L432-V518 HydrophobicContact CG-CG1 4.34Å
433	G	90.5	Very high	91.4	Very high	2 Å²	2	32.8 Å²	32.8	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-62.2	-35.4	-179.6	0	0	0	0	0	113.4	L429 S517 K521	L429-G433 PolarHBondContact O-N 3.29Å; G433-S517 WeakPolarHBondContact CA-O 3.41Å; G433-K521 WeakPolarHBondContact O-CE 3.27Å; G433-K521 PolarHBondContact O-NZ 2.9Å
434	S	91	Very high	91.8	Very high	73 Å²	73	32.2 Å²	32.2	51%	0.51	18%	0.179	S	C	.	.	H	α-helix	trans	-72.5	-33.5	179.6	67.1	0	0	0	0	113.9	N430 V431 L432	N430-S434 WeakPolarHBondContact O-CB 3.39Å; N430-S434 PolarHBondContact O-N 3.09Å; N430-S434 PolarHBondContact O-OG 2.93Å; V431-S434 WeakPolarHBondContact CA-OG 3.37Å; V431-S434 PolarHBondContact O-N 3.04Å; V431-S434 PolarHBondContact O-OG 2.81Å; L432-S434 VanDerWaalsContact C-N 3.31Å; L432-S434 PolarHBondContact O-N 2.87Å
435	N	90.9	Very high	91.7	Very high	56 Å²	56	34.3 Å²	34.3	30%	0.299	19%	0.192	S	C	.	.	H	α-helix	trans	-103.1	-35.8	-171.9	-67.9	-58.7	0	0	0	113.8	I407 T411 V431 L432 S437	I407-N435 HydrophobicContact CG2-CB 4.15Å; T411-N435 WeakPolarHBondContact CB-O 3.09Å; T411-N435 HydrophobicContact CG2-CB 4.16Å; V431-N435 WeakPolarHBondContact CG1-ND2 3.47Å; V431-N435 WeakPolarHBondContact O-CB 3.2Å; V431-N435 PolarHBondContact O-N 3.35Å; V431-N435 PolarHBondContact O-ND2 3.27Å; L432-N435 PolarHBondContact O-N 2.71Å; N435-S437 PolarHBondContact O-N 3.33Å
436	C	87.9	Confident	91.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.193	C	C	.	.			trans	-101	85.5	-176.3	-64.9	0	0	0	0	109.7	L432 I438 I439	L432-C436 HydrophobicContact CD1-CB 4.19Å; L432-C436 WeakPolarHBondContact O-CB 3.34Å; L432-C436 PolarHBondContact O-N 2.65Å; C436-I438 VanDerWaalsContact C-N 3.28Å; C436-I438 PolarHBondContact O-N 3.37Å; C436-I439 HydrophobicContact CB-CD1 3.53Å; C436-I439 HydrophobicContact CB-CG1 3.47Å; C436-I439 VanDerWaalsContact CB-CG1 3.47Å; C436-I439 WeakPolarHBondContact O-CD1 3.46Å; C436-I439 VanDerWaalsContact O-CG1 3.3Å; C436-I439 WeakPolarHBondContact O-CG1 3.37Å
437	S	82	Confident	90.8	Very high	82 Å²	82	33.4 Å²	33.4	57%	0.573	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-10.9	-176.8	58.8	0	0	0	0	114.9	N435	N435-S437 PolarHBondContact O-N 3.33Å
438	I	86.7	Confident	89.8	Confident	73 Å²	73	30.2 Å²	30.2	37%	0.374	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.8	16.1	-174.8	61.2	161.3	0	0	0	113.6	Q412 E414 C436 R440	Q412-I438 HydrophobicContact CB-CD1 4.29Å; Q412-I438 WeakPolarHBondContact O-CD1 3.47Å; E414-I438 HydrophobicContact CG-CD1 3.93Å; E414-I438 HydrophobicContact CG-CG1 4.38Å; C436-I438 VanDerWaalsContact C-N 3.28Å; C436-I438 PolarHBondContact O-N 3.37Å; I438-R440 PolarHBondContact O-N 3.09Å
439	I	90.7	Very high	88.1	Confident	1 Å²	1	31 Å²	31	1%	0.005	17%	0.171	C	C	.	.			trans	-59.8	124.3	-179.8	-58.1	165.3	0	0	0	109.4	L432 C436 T441 L442 K521 L523	L432-I439 HydrophobicContact CD1-CD1 3.79Å; L432-I439 HydrophobicContact CD2-CD1 4.17Å; L432-I439 HydrophobicContact CG-CD1 3.61Å; C436-I439 HydrophobicContact CB-CD1 3.53Å; C436-I439 HydrophobicContact CB-CG1 3.47Å; C436-I439 VanDerWaalsContact CB-CG1 3.47Å; C436-I439 WeakPolarHBondContact O-CD1 3.46Å; C436-I439 VanDerWaalsContact O-CG1 3.3Å; C436-I439 WeakPolarHBondContact O-CG1 3.37Å; I439-T441 WeakPolarHBondContact CG2-O 3.35Å; I439-L442 HydrophobicContact CG2-CB 4.42Å; I439-K521 VanDerWaalsContact O-O 3.13Å; I439-L523 HydrophobicContact CB-CD2 4.14Å; I439-L523 HydrophobicContact CG2-CD2 3.6Å; I439-L523 WeakPolarHBondContact O-CD2 3.4Å
440	R	93.3	Very high	86.2	Confident	100 Å²	100	31.4 Å²	31.4	38%	0.377	17%	0.173	S	C	.	.			trans	-105.6	-27.4	174.2	-62.9	-170.3	-174.3	149.2	9.6	112.4	E414 I438 N524 R525	E414-R440 HydrophobicContact CB-CB 4.33Å; E414-R440 HydrophobicContact CB-CG 4.22Å; E414-R440 PolarHBondContact O-N 3.48Å; E414-R440 IonicContact OE1-CZ 2.63Å; E414-R440 IonicContact OE1-NE 3.31Å; E414-R440 IonicContact OE1-NH1 2.8Å; E414-R440 PolarHBondContact OE1-NH1 2.85Å; E414-R440 IonicContact OE1-NH2 3.07Å; E414-R440 PolarHBondContact OE1-NH2 3.19Å; E414-R440 VanDerWaalsContact OE2-CD 3.28Å; E414-R440 WeakPolarHBondContact OE2-CD 3.36Å; E414-R440 IonicContact OE2-CZ 2.69Å; E414-R440 IonicContact OE2-NE 2.65Å; E414-R440 PolarHBondContact OE2-NE 3.47Å; E414-R440 IonicContact OE2-NH1 3.56Å; E414-R440 PolarHBondContact OE2-NH1 3.25Å; E414-R440 IonicContact OE2-NH2 2.95Å; I438-R440 PolarHBondContact O-N 3.09Å; R440-N524 HydrophobicContact CB-CB 4.25Å; R440-N524 CarbonylContact O-C 3.43Å; R440-N524 WeakPolarHBondContact O-CA 3.36Å; R440-N524 WeakPolarHBondContact O-CB 3.45Å; R440-N524 PolarHBondContact O-N 3.45Å; R440-R525 PolarHBondContact O-N 3.46Å
441	T	95.6	Very high	84.1	Confident	13 Å²	13	32 Å²	32	8%	0.08	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	127.9	177.2	-56.9	0	0	0	0	110.4	E414 H415 W416 I417 I439 R525	E414-T441 PolarHBondContact O-N 3.04Å; H415-T441 WeakPolarHBondContact CA-O 3.48Å; H415-T441 WeakPolarHBondContact ND1-CB 3.46Å; H415-T441 PolarHBondContact ND1-OG1 3.38Å; W416-T441 PolarHBondContact N-O 3.35Å; I417-T441 HydrophobicContact CD1-CG2 4.2Å; I439-T441 WeakPolarHBondContact CG2-O 3.35Å; T441-R525 WeakPolarHBondContact CA-O 3.46Å; T441-R525 HydrophobicContact CG2-CB 4.09Å
442	L	95.7	Very high	81.4	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	122	168.8	178.1	59.3	0	0	0	108.5	W416 L418 L432 I439 M444 V518 L523 R525 L526 L527	W416-L442 HydrophobicContact CB-CD1 4.08Å; W416-L442 WeakPolarHBondContact O-CA 3.45Å; L418-L442 HydrophobicContact CD1-CD1 4.38Å; L432-L442 HydrophobicContact CD2-CD1 3.75Å; L432-L442 HydrophobicContact CD2-CD2 4.26Å; I439-L442 HydrophobicContact CG2-CB 4.42Å; L442-M444 HydrophobicContact CD1-CG 3.98Å; L442-M444 HydrophobicContact CD1-SD 4.21Å; L442-M444 HydrophobicContact CD2-CE 3.79Å; L442-M444 HydrophobicContact CD2-SD 4.09Å; L442-M444 HydrophobicContact CG-CE 4.12Å; L442-M444 HydrophobicContact CG-CG 4.13Å; L442-M444 HydrophobicContact CG-SD 4.21Å; L442-V518 HydrophobicContact CD2-CB 3.93Å; L442-V518 HydrophobicContact CD2-CG1 4.04Å; L442-V518 HydrophobicContact CD2-CG2 3.71Å; L442-L523 HydrophobicContact CB-CD2 4.38Å; L442-R525 PolarHBondContact N-O 3.09Å; L442-L526 HydrophobicContact CB-CD1 4.12Å; L442-L526 HydrophobicContact CD2-CD1 4.19Å; L442-L526 HydrophobicContact CG-CD1 4.3Å; L442-L527 PolarHBondContact O-N 3.2Å
443	E	95.8	Very high	79.1	Confident	51 Å²	51	35.4 Å²	35.4	24%	0.238	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	124.5	176.1	-168.2	176	141.4	0	0	110	W416 I417 L418 N419 V445 L527	W416-E443 PolarHBondContact O-N 3.31Å; I417-E443 HydrophobicContact CD1-CB 3.7Å; I417-E443 HydrophobicContact CG2-CB 4.17Å; I417-E443 HydrophobicContact CG2-CG 4.47Å; L418-E443 PolarHBondContact N-O 3.1Å; N419-E443 PolarHBondContact ND2-OE1 3.11Å; N419-E443 WeakPolarHBondContact OD1-CG 3.42Å; N419-E443 PolarHBondContact OD1-O 3.04Å; E443-V445 HydrophobicContact CG-CG2 3.86Å; E443-L527 CarbonylContact C-O 3.15Å; E443-L527 WeakPolarHBondContact CA-O 3.43Å; E443-L527 HydrophobicContact CB-CB 4.34Å; E443-L527 HydrophobicContact CG-CB 3.87Å
444	M	93.1	Very high	76.7	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	72.6	-176.7	-64.6	-177.2	-59.9	0	0	109.5	L429 L442 I510 L515 L527 V528 S529	L429-M444 HydrophobicContact CD1-CE 4.16Å; L429-M444 HydrophobicContact CD1-SD 3.98Å; L429-M444 HydrophobicContact CD2-CE 4.38Å; L429-M444 HydrophobicContact CD2-SD 3.39Å; L429-M444 WeakPolarHBondContact CD2-SD 3.45Å; L429-M444 HydrophobicContact CG-SD 4.31Å; L442-M444 HydrophobicContact CD1-CG 3.98Å; L442-M444 HydrophobicContact CD1-SD 4.21Å; L442-M444 HydrophobicContact CD2-CE 3.79Å; L442-M444 HydrophobicContact CD2-SD 4.09Å; L442-M444 HydrophobicContact CG-CE 4.12Å; L442-M444 HydrophobicContact CG-CG 4.13Å; L442-M444 HydrophobicContact CG-SD 4.21Å; M444-I510 HydrophobicContact SD-CD1 3.99Å; M444-L515 HydrophobicContact CE-CD2 3.67Å; M444-L527 PolarHBondContact N-O 2.97Å; M444-V528 HydrophobicContact CE-CG2 3.74Å; M444-S529 PolarHBondContact O-N 3.4Å
445	V	87.6	Confident	74.1	Confident	45 Å²	45	38.2 Å²	38.2	27%	0.273	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	130.1	179.5	171.6	0	0	0	0	108.8	N419 D420 E443 N447 S529	N419-V445 CarbonylContact C-O 3.28Å; N419-V445 WeakPolarHBondContact CA-O 3.22Å; N419-V445 HydrophobicContact CB-CB 4.09Å; N419-V445 WeakPolarHBondContact OD1-CB 3.45Å; N419-V445 PolarHBondContact OD1-N 3.32Å; D420-V445 PolarHBondContact N-O 3.17Å; E443-V445 HydrophobicContact CG-CG2 3.86Å; V445-N447 PolarHBondContact O-N 3.17Å; V445-N447 PolarHBondContact O-OD1 3.04Å; V445-S529 VanDerWaalsContact CA-OG 3.29Å; V445-S529 WeakPolarHBondContact CA-OG 3.49Å; V445-S529 WeakPolarHBondContact CB-OG 3.47Å; V445-S529 WeakPolarHBondContact CG1-OG 3.29Å
446	N	79.2	Confident	71.6	Confident	7 Å²	7	41.3 Å²	41.3	4%	0.037	23%	0.226	C	C	.	.	S	Bend	trans	60	39.1	171.5	-166.2	42.4	0	0	0	115.1	D420 Q448 L458 S529 N530	D420-N446 WeakPolarHBondContact OD1-CB 3.23Å; D420-N446 PolarHBondContact OD1-ND2 3.41Å; N446-Q448 VanDerWaalsContact C-N 3.31Å; N446-L458 WeakPolarHBondContact ND2-CD2 3.37Å; N446-S529 PolarHBondContact N-O 3.43Å; N446-N530 PolarHBondContact OD1-ND2 3.39Å
447	N	82.7	Confident	69.2	Low	3 Å²	3	44.1 Å²	44.1	2%	0.016	24%	0.237	C	C	.	.			trans	-93.6	23.8	174	-63	-21.2	0	0	0	113.1	L418 D420 I421 V445 I510 M531	L418-N447 PolarHBondContact O-ND2 2.89Å; L418-N447 PolarHBondContact O-OD1 3.31Å; L418-N447 VanDerWaalsContact O-OD1 3.09Å; D420-N447 PolarHBondContact N-OD1 3.37Å; D420-N447 VanDerWaalsContact N-OD1 3.09Å; I421-N447 PolarHBondContact N-OD1 3.33Å; I421-N447 WeakPolarHBondContact O-CB 3.45Å; I421-N447 PolarHBondContact O-OD1 3.17Å; V445-N447 PolarHBondContact O-N 3.17Å; V445-N447 PolarHBondContact O-OD1 3.04Å; N447-I510 HydrophobicContact CB-CD1 4.06Å; N447-M531 HydrophobicContact CB-CE 3.57Å
448	Q	71.5	Confident	67	Low	13 Å²	13	40.7 Å²	40.7	6%	0.061	21%	0.212	C	C	.	.	S	Bend	trans	-73.6	144.7	173.6	-106.7	-173.3	65.4	0	0	110.6	N446 V450 T452 N530 M531 S532	N446-Q448 VanDerWaalsContact C-N 3.31Å; Q448-V450 PolarHBondContact O-N 3.49Å; Q448-T452 PolarHBondContact OE1-OG1 3.15Å; Q448-N530 VanDerWaalsContact CD-O 3.27Å; Q448-N530 WeakPolarHBondContact CG-O 3.34Å; Q448-N530 PolarHBondContact NE2-O 3.33Å; Q448-N530 PolarHBondContact NE2-OD1 2.81Å; Q448-M531 HydrophobicContact CG-SD 4.22Å; Q448-S532 PolarHBondContact NE2-OG 3.3Å; Q448-S532 PolarHBondContact OE1-OG 3.1Å
449	N	60	Low	64.7	Low	20 Å²	20	38.9 Å²	38.9	11%	0.107	21%	0.206	C	C	.	.			trans	-68.7	130.4	173.5	-163.7	-11.7	0	0	0	109.4	F451 T452	N449-F451 PolarHBondContact O-N 2.92Å; N449-F451 VanDerWaalsContact OD1-CD2 3.24Å; N449-F451 WeakPolarHBondContact OD1-CD2 3.36Å; N449-T452 PolarHBondContact O-N 2.86Å; N449-T452 PolarHBondContact O-OG1 2.88Å
450	V	53.2	Low	62.3	Low	9 Å²	9	41.4 Å²	41.4	6%	0.055	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.9	-169.1	-173	0	0	0	0	113.1	Q448 T452 S453 L455 L458 I491 A495	Q448-V450 PolarHBondContact O-N 3.49Å; V450-T452 VanDerWaalsContact C-N 3.26Å; V450-T452 PolarHBondContact O-N 2.78Å; V450-S453 CarbonylContact O-C 3.49Å; V450-L455 HydrophobicContact CG1-CD2 4.39Å; V450-L458 HydrophobicContact CB-CD1 4.09Å; V450-L458 HydrophobicContact CG1-CD1 3.54Å; V450-L458 HydrophobicContact CG2-CD1 3.58Å; V450-I491 HydrophobicContact CG2-CG2 3.93Å; V450-A495 HydrophobicContact CB-CB 3.75Å; V450-A495 HydrophobicContact CG1-CB 3.71Å; V450-A495 HydrophobicContact CG2-CB 3.94Å
451	F	49.8	Very low	59.5	Low	107 Å²	107	39.1 Å²	39.1	47%	0.469	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-34.8	174	-61.9	-78	0	0	0	113.5	N449 A498 L499	N449-F451 PolarHBondContact O-N 2.92Å; N449-F451 VanDerWaalsContact OD1-CD2 3.24Å; N449-F451 WeakPolarHBondContact OD1-CD2 3.36Å; F451-A498 HydrophobicContact CE2-CB 3.79Å; F451-A498 HydrophobicContact CZ-CB 3.75Å; F451-L499 HydrophobicContact CD1-CD1 3.99Å; F451-L499 HydrophobicContact CE1-CB 4.22Å; F451-L499 HydrophobicContact CE1-CD1 3.47Å; F451-L499 VanDerWaalsContact CE1-CD1 3.47Å; F451-L499 HydrophobicContact CE1-CG 3.71Å; F451-L499 HydrophobicContact CZ-CD1 4.31Å; F451-L499 HydrophobicContact CZ-CG 4.48Å
452	T	38.7	Very low	56.8	Low	77 Å²	77	38.9 Å²	38.9	47%	0.472	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-35.8	-176.1	59.3	0	0	0	0	112.1	Q448 N449 V450	Q448-T452 PolarHBondContact OE1-OG1 3.15Å; N449-T452 PolarHBondContact O-N 2.86Å; N449-T452 PolarHBondContact O-OG1 2.88Å; V450-T452 VanDerWaalsContact C-N 3.26Å; V450-T452 PolarHBondContact O-N 2.78Å
453	S	44.4	Very low	53.7	Low	12 Å²	12	43.8 Å²	43.8	8%	0.084	24%	0.238	C	C	.	.	S	Bend	trans	-99.2	88	175.7	61.8	0	0	0	0	108.4	V450 L455	V450-S453 CarbonylContact O-C 3.49Å; S453-L455 PolarHBondContact O-N 3.08Å
454	G	41.8	Very low	50.8	Low	51 Å²	51	48 Å²	48	53%	0.526	26%	0.256	S	S	.	.			trans	-38.7	138.8	-179.2	0	0	0	0	0	112.6	H456 Y457	G454-H456 PolarHBondContact O-N 3.25Å; G454-Y457 PolarHBondContact O-N 3.42Å
455	L	35.3	Very low	48.1	Very low	83 Å²	83	52 Å²	52	44%	0.435	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-37.6	-25.8	-172.7	-77.4	147.4	0	0	0	116	V450 S453 Y457 H492	V450-L455 HydrophobicContact CG1-CD2 4.39Å; S453-L455 PolarHBondContact O-N 3.08Å; L455-Y457 VanDerWaalsContact C-N 3.28Å; L455-Y457 PolarHBondContact O-N 3.19Å; L455-H492 WeakPolarHBondContact CD2-CE1 3.47Å; L455-H492 WeakPolarHBondContact CD2-ND1 3.33Å
456	H	37.9	Very low	45.5	Very low	120 Å²	120	52.9 Å²	52.9	56%	0.556	28%	0.276	S	S	*	.	H	α-helix	trans	-60.9	-22.8	175.1	-163	81.2	0	0	0	115.4	G454 S459 K460	G454-H456 PolarHBondContact O-N 3.25Å; H456-S459 PolarHBondContact O-OG 3.16Å; H456-K460 VanDerWaalsContact NE2-CE 3.32Å; H456-K460 WeakPolarHBondContact NE2-CE 3.47Å; H456-K460 PolarHBondContact NE2-NZ 3.42Å
457	Y	38.2	Very low	43.3	Very low	59 Å²	59	61.8 Å²	61.8	23%	0.231	31%	0.314	C	S	.	.	H	α-helix	trans	-83.1	-40.4	-178.9	-147.2	-91.1	0	0	0	113	G454 L455 K460 T461 D582	G454-Y457 PolarHBondContact O-N 3.42Å; L455-Y457 VanDerWaalsContact C-N 3.28Å; L455-Y457 PolarHBondContact O-N 3.19Å; Y457-K460 PolarHBondContact O-N 3.19Å; Y457-K460 VanDerWaalsContact O-N 3.17Å; Y457-T461 HydrophobicContact CD1-CG2 4.39Å; Y457-T461 HydrophobicContact CE1-CG2 4.23Å; Y457-T461 PolarHBondContact O-N 3.31Å; Y457-T461 PolarHBondContact O-OG1 3.21Å; Y457-D582 PolarHBondContact OH-OD2 3.25Å
458	L	36	Very low	40.9	Very low	10 Å²	10	65.6 Å²	65.6	5%	0.052	34%	0.341	C	S	.	.	H	α-helix	trans	-69	-35.2	-179.6	-73.6	163.5	0	0	0	113.2	N446 V450 K460 T461 C462 I491	N446-L458 WeakPolarHBondContact ND2-CD2 3.37Å; V450-L458 HydrophobicContact CB-CD1 4.09Å; V450-L458 HydrophobicContact CG1-CD1 3.54Å; V450-L458 HydrophobicContact CG2-CD1 3.58Å; L458-K460 PolarHBondContact O-N 3.24Å; L458-T461 PolarHBondContact O-OG1 3.24Å; L458-C462 WeakPolarHBondContact O-CB 3.47Å; L458-C462 PolarHBondContact O-N 2.88Å; L458-C462 PolarHBondContact O-SG 3.06Å; L458-I491 HydrophobicContact CD1-CG2 3.57Å; L458-I491 HydrophobicContact CD2-CD1 4.43Å; L458-I491 HydrophobicContact CD2-CG2 4.23Å; L458-I491 HydrophobicContact CG-CG2 4.44Å
459	S	37.6	Very low	38.7	Very low	36 Å²	36	69.1 Å²	69.1	25%	0.252	36%	0.364	S	S	.	.	H	α-helix	trans	-61.2	-35.1	173.1	66.6	0	0	0	0	111.2	H456 L463	H456-S459 PolarHBondContact O-OG 3.16Å; S459-L463 WeakPolarHBondContact O-CB 3.22Å; S459-L463 WeakPolarHBondContact O-CD1 3.05Å; S459-L463 WeakPolarHBondContact O-CG 3.21Å; S459-L463 PolarHBondContact O-N 3.06Å
460	K	40.1	Very low	37	Very low	54 Å²	54	73.5 Å²	73.5	24%	0.235	39%	0.393	C	S	.	.	H	α-helix	trans	-75.8	-40.7	-178.3	-80.1	-179.9	170.6	171.8	0	114.2	H456 Y457 L458	H456-K460 VanDerWaalsContact NE2-CE 3.32Å; H456-K460 WeakPolarHBondContact NE2-CE 3.47Å; H456-K460 PolarHBondContact NE2-NZ 3.42Å; Y457-K460 PolarHBondContact O-N 3.19Å; Y457-K460 VanDerWaalsContact O-N 3.17Å; L458-K460 PolarHBondContact O-N 3.24Å
461	T	35.8	Very low	36.1	Very low	51 Å²	51	78.9 Å²	78.9	31%	0.313	43%	0.426	S	S	.	.	H	α-helix	trans	-73.1	-41	178.6	41.6	0	0	0	0	111.8	Y457 L458 L463 F464	Y457-T461 HydrophobicContact CD1-CG2 4.39Å; Y457-T461 HydrophobicContact CE1-CG2 4.23Å; Y457-T461 PolarHBondContact O-N 3.31Å; Y457-T461 PolarHBondContact O-OG1 3.21Å; L458-T461 PolarHBondContact O-OG1 3.24Å; T461-L463 PolarHBondContact O-N 3.45Å; T461-F464 PolarHBondContact O-N 3.2Å
462	C	38.1	Very low	35	Very low	8 Å²	8	81.8 Å²	81.8	5%	0.054	45%	0.446	C	S	.	.	H	α-helix	trans	-76.1	-20.7	-178.8	-65.1	0	0	0	0	113.8	L458 F464 H465 I488	L458-C462 WeakPolarHBondContact O-CB 3.47Å; L458-C462 PolarHBondContact O-N 2.88Å; L458-C462 PolarHBondContact O-SG 3.06Å; C462-F464 PolarHBondContact O-N 3.2Å; C462-F464 VanDerWaalsContact O-N 3.11Å; C462-H465 PolarHBondContact O-N 3.13Å; C462-I488 HydrophobicContact CB-CD1 3.39Å; C462-I488 HydrophobicContact CB-CG1 3.1Å
463	L	31.8	Very low	34.6	Very low	103 Å²	103	80 Å²	80	54%	0.539	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-24.5	172.2	-92.8	164.9	0	0	0	113.1	S459 T461 H465	S459-L463 WeakPolarHBondContact O-CB 3.22Å; S459-L463 WeakPolarHBondContact O-CD1 3.05Å; S459-L463 WeakPolarHBondContact O-CG 3.21Å; S459-L463 PolarHBondContact O-N 3.06Å; T461-L463 PolarHBondContact O-N 3.45Å; L463-H465 PolarHBondContact O-N 3.48Å
464	F	33.9	Very low	33.7	Very low	139 Å²	139	87.5 Å²	87.5	61%	0.61	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-24.5	174.8	-80.6	-80.9	0	0	0	113.4	T461 C462 E852	T461-F464 PolarHBondContact O-N 3.2Å; C462-F464 PolarHBondContact O-N 3.2Å; C462-F464 VanDerWaalsContact O-N 3.11Å; F464-E852 HydrophobicContact CE1-CG 4.31Å; F464-E852 HydrophobicContact CZ-CG 3.81Å
465	H	36.4	Very low	33.3	Very low	84 Å²	84	91.6 Å²	91.6	39%	0.389	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-19.7	-175	-73.1	-90.7	0	0	0	113.8	Y341 C462 L463	Y341-H465 HydrophobicContact CE1-CB 4.48Å; Y341-H465 AromaticContact CZ-ND1 3.63Å; Y341-H465 PolarHBondContact OH-CE1 2.57Å; Y341-H465 VanDerWaalsContact OH-CE1 3.31Å; Y341-H465 PolarHBondContact OH-ND1 3.23Å; C462-H465 PolarHBondContact O-N 3.13Å; L463-H465 PolarHBondContact O-N 3.48Å
466	E	33.8	Very low	32.9	Very low	65 Å²	65	95.2 Å²	95.2	30%	0.304	51%	0.506	S	S	.	.			trans	-103.1	7.2	-168.3	-82.6	-178.4	-162.1	0	0	116.7	S468 T486	E466-S468 PolarHBondContact O-N 3.23Å; E466-S468 PolarHBondContact O-OG 2.77Å; E466-T486 VanDerWaalsContact CD-CG2 3.48Å; E466-T486 WeakPolarHBondContact OE1-CB 3.09Å; E466-T486 VanDerWaalsContact OE1-CG2 3.26Å; E466-T486 WeakPolarHBondContact OE1-CG2 3.47Å; E466-T486 WeakPolarHBondContact OE2-CG2 3.48Å
467	K	32.4	Very low	32.6	Very low	194 Å²	194	94.1 Å²	94.1	84%	0.843	50%	0.503	S	S	*	.			trans	-63.6	15.9	167.9	-75.8	-171.3	-179.4	175.2	0	114.3	T469	K467-T469 PolarHBondContact O-N 2.96Å; K467-T469 VanDerWaalsContact O-N 3.11Å
468	S	32.6	Very low	32.4	Very low	82 Å²	82	100 Å²	100	57%	0.573	53%	0.53	S	S	*	.	S	Bend	trans	-66.8	100.6	157.6	46.5	0	0	0	0	109	E466	E466-S468 PolarHBondContact O-N 3.23Å; E466-S468 PolarHBondContact O-OG 2.77Å
469	T	25	Very low	32.3	Very low	88 Å²	88	104.6 Å²	104.6	54%	0.54	55%	0.554	S	S	.	*			trans	-22.2	129.7	170.1	54.2	0	0	0	0	113.6	K467 V471	K467-T469 PolarHBondContact O-N 2.96Å; K467-T469 VanDerWaalsContact O-N 3.11Å; T469-V471 PolarHBondContact O-N 3.33Å
470	P	24.9	Very low	32.1	Very low	111 Å²	111	112.2 Å²	112.2	72%	0.721	58%	0.583	S	S	*	*			trans	-49	140.8	165.2	-19	29.7	0	0	0	108.8	D472	P470-D472 PolarHBondContact O-N 3.12Å
471	V	33.1	Very low	31.9	Very low	123 Å²	123	118.6 Å²	118.6	75%	0.745	61%	0.613	S	S	*	*			trans	-65.9	84.8	173	-179.2	0	0	0	0	107.1	T469 G473	T469-V471 PolarHBondContact O-N 3.33Å; V471-G473 PolarHBondContact O-N 2.97Å
472	D	26.6	Very low	31.7	Very low	167 Å²	167	120.4 Å²	120.4	89%	0.893	62%	0.621	S	S	*	*			trans	-70	91.5	160.7	-88.7	-20.8	0	0	0	106.5	P470	P470-D472 PolarHBondContact O-N 3.12Å
473	G	30.5	Very low	31.3	Very low	40 Å²	40	129.1 Å²	129.1	41%	0.412	65%	0.653	S	S	.	*	S	Bend	trans	179.4	108.1	175.5	0	0	0	0	0	106.2	V471 I475	V471-G473 PolarHBondContact O-N 2.97Å; G473-I475 PolarHBondContact O-N 3.43Å
474	D	26.6	Very low	31.6	Very low	170 Å²	170	128.5 Å²	128.5	91%	0.909	66%	0.655	S	S	*	*			trans	-60.3	51.5	179	-74.3	-48.1	0	0	0	113.5	Q476	D474-Q476 VanDerWaalsContact C-N 3.28Å; D474-Q476 PolarHBondContact O-N 3.38Å; D474-Q476 VanDerWaalsContact O-N 3.1Å
475	I	33.7	Very low	32.1	Very low	136 Å²	136	126.2 Å²	126.2	70%	0.697	65%	0.648	S	S	*	*			trans	-78.8	93.2	160.4	-56	178	0	0	0	104.4	G473 I477	G473-I475 PolarHBondContact O-N 3.43Å; I475-I477 HydrophobicContact CG2-CG1 4.18Å; I475-I477 PolarHBondContact O-N 3.37Å
476	Q	26.9	Very low	32.6	Very low	160 Å²	160	125.2 Å²	125.2	75%	0.748	65%	0.648	S	S	*	*			trans	-56.5	85.6	164.8	-71.3	-178.8	11.2	0	0	108.6	D474 K478	D474-Q476 VanDerWaalsContact C-N 3.28Å; D474-Q476 PolarHBondContact O-N 3.38Å; D474-Q476 VanDerWaalsContact O-N 3.1Å; Q476-K478 VanDerWaalsContact C-N 3.27Å; Q476-K478 PolarHBondContact O-N 2.9Å
477	I	30.2	Very low	33.4	Very low	97 Å²	97	123 Å²	123	50%	0.497	64%	0.64	S	S	.	*			trans	-67.4	95.8	164.4	-57.4	176.4	0	0	0	104.9	I475 D479 N482	I475-I477 HydrophobicContact CG2-CG1 4.18Å; I475-I477 PolarHBondContact O-N 3.37Å; I477-D479 HydrophobicContact CG2-CB 4.44Å; I477-D479 WeakPolarHBondContact CG2-O 3.5Å; I477-D479 PolarHBondContact O-N 3.2Å; I477-D479 VanDerWaalsContact O-N 3.17Å; I477-N482 HydrophobicContact CG2-CB 4.24Å
478	K	34.2	Very low	34.2	Very low	183 Å²	183	115 Å²	115	80%	0.796	61%	0.606	S	S	*	*			trans	-62.2	-15.4	178.7	-77.5	-174.9	175	-179.2	0	112.7	Q476 K480	Q476-K478 VanDerWaalsContact C-N 3.27Å; Q476-K478 PolarHBondContact O-N 2.9Å; K478-K480 PolarHBondContact O-N 2.73Å
479	D	34.7	Very low	35.1	Very low	105 Å²	105	112.3 Å²	112.3	56%	0.561	59%	0.591	S	S	*	*			trans	-92.8	99.8	172.1	-72.6	-36.3	0	0	0	111.7	I477 Q481 N482	I477-D479 HydrophobicContact CG2-CB 4.44Å; I477-D479 WeakPolarHBondContact CG2-O 3.5Å; I477-D479 PolarHBondContact O-N 3.2Å; I477-D479 VanDerWaalsContact O-N 3.17Å; D479-Q481 PolarHBondContact O-N 3.16Å; D479-N482 HydrophobicContact CB-CB 4.32Å; D479-N482 PolarHBondContact O-N 2.75Å
480	K	33.7	Very low	36.4	Very low	196 Å²	196	108.2 Å²	108.2	85%	0.852	57%	0.566	S	S	*	*	G	3₁₀ helix	trans	-52.6	-22.4	168	-73.2	-177.1	178.2	178.4	0	112.8	K478 N482	K478-K480 PolarHBondContact O-N 2.73Å; K480-N482 VanDerWaalsContact C-N 3.31Å; K480-N482 PolarHBondContact O-N 3.13Å
481	Q	34	Very low	37.8	Very low	188 Å²	188	103.4 Å²	103.4	88%	0.879	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-73.7	-15	179.2	-63.9	-167.6	8	0	0	114.4	D479	D479-Q481 PolarHBondContact O-N 3.16Å
482	N	33.4	Very low	38.7	Very low	89 Å²	89	100.1 Å²	100.1	48%	0.476	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-107.7	11.9	-171.1	-123.2	0.1	0	0	0	114.5	I477 D479 K480	I477-N482 HydrophobicContact CG2-CB 4.24Å; D479-N482 HydrophobicContact CB-CB 4.32Å; D479-N482 PolarHBondContact O-N 2.75Å; K480-N482 VanDerWaalsContact C-N 3.31Å; K480-N482 PolarHBondContact O-N 3.13Å
483	R	30	Very low	40	Very low	191 Å²	191	98.5 Å²	98.5	72%	0.721	50%	0.495	S	S	*	.	S	Bend	trans	-65.5	133.1	171.4	-73.4	-172.7	177.9	-170.5	-1.5	109.1	I485	R483-I485 PolarHBondContact O-N 2.83Å
484	P	36.6	Very low	41.2	Very low	91 Å²	91	99.6 Å²	99.6	59%	0.591	49%	0.487	S	S	*	.			trans	-58.4	113.1	174.8	21.6	-29.3	0	0	0	108.3	T486	P484-T486 PolarHBondContact O-N 2.76Å
485	I	45.4	Very low	42.6	Very low	91 Å²	91	91.7 Å²	91.7	47%	0.467	45%	0.446	S	S	.	.			trans	-72.2	117.6	179.8	-43.1	174.2	0	0	0	106.4	R483 L490	R483-I485 PolarHBondContact O-N 2.83Å; I485-L490 HydrophobicContact CB-CD1 4.33Å; I485-L490 HydrophobicContact CB-CD2 4.02Å; I485-L490 HydrophobicContact CB-CG 4Å; I485-L490 HydrophobicContact CD1-CD2 4.06Å; I485-L490 HydrophobicContact CG2-CD1 4.34Å; I485-L490 HydrophobicContact CG2-CD2 3.49Å; I485-L490 VanDerWaalsContact CG2-CD2 3.49Å; I485-L490 HydrophobicContact CG2-CG 3.49Å; I485-L490 VanDerWaalsContact CG2-CG 3.49Å
486	T	47	Very low	43.4	Very low	62 Å²	62	89.2 Å²	89.2	38%	0.38	43%	0.434	S	S	.	.			trans	-62.6	144.1	176.1	44.2	0	0	0	0	109.7	E466 P484 I488 G489 L490	E466-T486 VanDerWaalsContact CD-CG2 3.48Å; E466-T486 WeakPolarHBondContact OE1-CB 3.09Å; E466-T486 VanDerWaalsContact OE1-CG2 3.26Å; E466-T486 WeakPolarHBondContact OE1-CG2 3.47Å; E466-T486 WeakPolarHBondContact OE2-CG2 3.48Å; P484-T486 PolarHBondContact O-N 2.76Å; T486-I488 PolarHBondContact O-N 3.34Å; T486-G489 WeakPolarHBondContact O-CA 3.27Å; T486-G489 PolarHBondContact O-N 3.36Å; T486-G489 PolarHBondContact OG1-N 3.47Å; T486-L490 PolarHBondContact O-N 2.85Å
487	C	49.5	Very low	44.7	Very low	19 Å²	19	84.4 Å²	84.4	13%	0.128	42%	0.418	C	S	.	.	H	α-helix	trans	-57.8	-35.8	177.9	-65.5	0	0	0	0	110.4	Y366 L490 I491	Y366-C487 HydrophobicContact CD1-CB 4.19Å; Y366-C487 WeakPolarHBondContact CD1-SG 3.33Å; C487-L490 PolarHBondContact O-N 3.18Å; C487-I491 VanDerWaalsContact O-CG1 3.3Å; C487-I491 WeakPolarHBondContact O-CG1 3.32Å; C487-I491 PolarHBondContact O-N 3.45Å
488	I	50.7	Low	45.8	Very low	26 Å²	26	80.6 Å²	80.6	13%	0.133	40%	0.401	C	S	.	.	H	α-helix	trans	-54.6	-57	169.5	-65.4	177.6	0	0	0	110.3	C462 T486 L490 I491 H492	C462-I488 HydrophobicContact CB-CD1 3.39Å; C462-I488 HydrophobicContact CB-CG1 3.1Å; T486-I488 PolarHBondContact O-N 3.34Å; I488-L490 PolarHBondContact O-N 3.32Å; I488-I491 PolarHBondContact O-N 2.87Å; I488-H492 WeakPolarHBondContact CG2-CD2 3.29Å; I488-H492 WeakPolarHBondContact O-CB 3.16Å; I488-H492 PolarHBondContact O-CD2 3.2Å; I488-H492 PolarHBondContact O-N 2.82Å
489	G	50.7	Low	46.6	Very low	26 Å²	26	76.9 Å²	76.9	27%	0.268	39%	0.389	S	S	.	.	H	α-helix	trans	-57.4	-33.6	-179.9	0	0	0	0	0	113.3	T486 K493	T486-G489 WeakPolarHBondContact O-CA 3.27Å; T486-G489 PolarHBondContact O-N 3.36Å; T486-G489 PolarHBondContact OG1-N 3.47Å; G489-K493 VanDerWaalsContact O-CB 3.27Å; G489-K493 WeakPolarHBondContact O-CB 3.27Å; G489-K493 PolarHBondContact O-N 3.18Å
490	L	51.8	Low	47.3	Very low	2 Å²	2	78.2 Å²	78.2	1%	0.01	40%	0.396	C	S	.	.	H	α-helix	trans	-74.1	-44.2	176.7	-72	175.8	0	0	0	113.5	T368 I396 Y397 I485 T486 C487 I488 H492 K493 Y494	T368-L490 HydrophobicContact CG2-CD1 3.24Å; I396-L490 HydrophobicContact CD1-CB 3.69Å; Y397-L490 HydrophobicContact CE2-CD1 4.35Å; Y397-L490 HydrophobicContact CE2-CD2 3.76Å; Y397-L490 WeakPolarHBondContact OH-CD2 3.43Å; I485-L490 HydrophobicContact CB-CD1 4.33Å; I485-L490 HydrophobicContact CB-CD2 4.02Å; I485-L490 HydrophobicContact CB-CG 4Å; I485-L490 HydrophobicContact CD1-CD2 4.06Å; I485-L490 HydrophobicContact CG2-CD1 4.34Å; I485-L490 HydrophobicContact CG2-CD2 3.49Å; I485-L490 VanDerWaalsContact CG2-CD2 3.49Å; I485-L490 HydrophobicContact CG2-CG 3.49Å; I485-L490 VanDerWaalsContact CG2-CG 3.49Å; T486-L490 PolarHBondContact O-N 2.85Å; C487-L490 PolarHBondContact O-N 3.18Å; I488-L490 PolarHBondContact O-N 3.32Å; L490-H492 VanDerWaalsContact C-N 3.3Å; L490-H492 PolarHBondContact O-N 3.32Å; L490-K493 PolarHBondContact O-N 2.95Å; L490-Y494 WeakPolarHBondContact O-CB 3.21Å; L490-Y494 PolarHBondContact O-N 3.06Å
491	I	53.6	Low	48	Very low	9 Å²	9	73.9 Å²	73.9	5%	0.046	38%	0.382	C	S	.	.	H	α-helix	trans	-65	-39.1	175.7	-62.3	166.3	0	0	0	109.7	V450 L458 C487 I488 Y494 A495	V450-I491 HydrophobicContact CG2-CG2 3.93Å; L458-I491 HydrophobicContact CD1-CG2 3.57Å; L458-I491 HydrophobicContact CD2-CD1 4.43Å; L458-I491 HydrophobicContact CD2-CG2 4.23Å; L458-I491 HydrophobicContact CG-CG2 4.44Å; C487-I491 VanDerWaalsContact O-CG1 3.3Å; C487-I491 WeakPolarHBondContact O-CG1 3.32Å; C487-I491 PolarHBondContact O-N 3.45Å; I488-I491 PolarHBondContact O-N 2.87Å; I491-Y494 PolarHBondContact O-N 2.79Å; I491-A495 VanDerWaalsContact O-CB 3.31Å; I491-A495 WeakPolarHBondContact O-CB 3.18Å; I491-A495 PolarHBondContact O-N 3.21Å
492	H	53.6	Low	48.3	Very low	54 Å²	54	70 Å²	70	25%	0.25	38%	0.376	C	S	.	.	H	α-helix	trans	-59.6	-50.8	171.2	-82.2	-74.4	0	0	0	111.6	L455 I488 L490 Y494 A495 D496	L455-H492 WeakPolarHBondContact CD2-CE1 3.47Å; L455-H492 WeakPolarHBondContact CD2-ND1 3.33Å; I488-H492 WeakPolarHBondContact CG2-CD2 3.29Å; I488-H492 WeakPolarHBondContact O-CB 3.16Å; I488-H492 PolarHBondContact O-CD2 3.2Å; I488-H492 PolarHBondContact O-N 2.82Å; L490-H492 VanDerWaalsContact C-N 3.3Å; L490-H492 PolarHBondContact O-N 3.32Å; H492-Y494 VanDerWaalsContact C-N 3.29Å; H492-Y494 PolarHBondContact O-N 2.95Å; H492-A495 WeakPolarHBondContact O-CB 3.35Å; H492-A495 PolarHBondContact O-N 2.79Å; H492-D496 WeakPolarHBondContact O-CB 3.27Å; H492-D496 VanDerWaalsContact O-CG 3.23Å; H492-D496 PolarHBondContact O-N 3.09Å
493	K	53.9	Low	48.6	Very low	133 Å²	133	73.1 Å²	73.1	58%	0.578	39%	0.393	S	S	*	.	H	α-helix	trans	-62	-37.7	178.7	-171.5	-179.5	179.1	-174.3	0	112.2	G489 L490 S497	G489-K493 VanDerWaalsContact O-CB 3.27Å; G489-K493 WeakPolarHBondContact O-CB 3.27Å; G489-K493 PolarHBondContact O-N 3.18Å; L490-K493 PolarHBondContact O-N 2.95Å; K493-S497 WeakPolarHBondContact O-CB 3.49Å; K493-S497 PolarHBondContact O-N 3.44Å; K493-S497 PolarHBondContact O-OG 3.09Å
494	Y	54.5	Low	49.2	Very low	63 Å²	63	67.1 Å²	67.1	25%	0.247	38%	0.38	C	S	.	.	H	α-helix	trans	-64.7	-47.7	174.5	-174.6	-92.8	0	0	0	110.8	P422 L490 I491 H492 D496 S497 A498	P422-Y494 HydrophobicContact CG-CD1 3.93Å; P422-Y494 HydrophobicContact CG-CE1 4.02Å; L490-Y494 WeakPolarHBondContact O-CB 3.21Å; L490-Y494 PolarHBondContact O-N 3.06Å; I491-Y494 PolarHBondContact O-N 2.79Å; H492-Y494 VanDerWaalsContact C-N 3.29Å; H492-Y494 PolarHBondContact O-N 2.95Å; Y494-D496 VanDerWaalsContact C-N 3.35Å; Y494-D496 PolarHBondContact O-N 2.94Å; Y494-S497 PolarHBondContact O-N 2.83Å; Y494-S497 PolarHBondContact O-OG 2.83Å; Y494-A498 WeakPolarHBondContact O-CB 3.37Å; Y494-A498 PolarHBondContact O-N 3.43Å
495	A	56.1	Low	49.5	Very low	4 Å²	4	68.3 Å²	68.3	3%	0.033	38%	0.382	C	S	.	.	H	α-helix	trans	-59	-43.7	175.8	0	0	0	0	0	112.1	V450 I491 H492 A498 L499	V450-A495 HydrophobicContact CB-CB 3.75Å; V450-A495 HydrophobicContact CG1-CB 3.71Å; V450-A495 HydrophobicContact CG2-CB 3.94Å; I491-A495 VanDerWaalsContact O-CB 3.31Å; I491-A495 WeakPolarHBondContact O-CB 3.18Å; I491-A495 PolarHBondContact O-N 3.21Å; H492-A495 WeakPolarHBondContact O-CB 3.35Å; H492-A495 PolarHBondContact O-N 2.79Å; A495-A498 PolarHBondContact O-N 2.73Å; A495-L499 WeakPolarHBondContact O-CB 3.46Å; A495-L499 PolarHBondContact O-N 2.79Å
496	D	51.6	Low	49.5	Very low	85 Å²	85	70.5 Å²	70.5	46%	0.455	40%	0.399	S	S	.	.	H	α-helix	trans	-64	-41	175.8	-67.5	-22.3	0	0	0	111.4	H492 Y494 L499 N500	H492-D496 WeakPolarHBondContact O-CB 3.27Å; H492-D496 VanDerWaalsContact O-CG 3.23Å; H492-D496 PolarHBondContact O-N 3.09Å; Y494-D496 VanDerWaalsContact C-N 3.35Å; Y494-D496 PolarHBondContact O-N 2.94Å; D496-L499 WeakPolarHBondContact O-CB 3.34Å; D496-L499 PolarHBondContact O-N 3.2Å; D496-N500 PolarHBondContact O-N 2.85Å; D496-N500 VanDerWaalsContact O-N 3.12Å; D496-N500 PolarHBondContact O-ND2 3Å
497	S	54.5	Low	49.7	Very low	58 Å²	58	70.1 Å²	70.1	41%	0.406	41%	0.407	S	S	.	.	H	α-helix	trans	-66	-38.3	176.6	78.6	0	0	0	0	112.2	K493 Y494 N500 N501	K493-S497 WeakPolarHBondContact O-CB 3.49Å; K493-S497 PolarHBondContact O-N 3.44Å; K493-S497 PolarHBondContact O-OG 3.09Å; Y494-S497 PolarHBondContact O-N 2.83Å; Y494-S497 PolarHBondContact O-OG 2.83Å; S497-N500 PolarHBondContact O-N 2.98Å; S497-N501 PolarHBondContact O-N 3.14Å
498	A	53.1	Low	50.2	Low	17 Å²	17	72.7 Å²	72.7	14%	0.14	42%	0.417	C	S	.	.	H	α-helix	trans	-68.8	-36.6	174.8	0	0	0	0	0	110.9	F451 Y494 A495 N500 N501	F451-A498 HydrophobicContact CE2-CB 3.79Å; F451-A498 HydrophobicContact CZ-CB 3.75Å; Y494-A498 WeakPolarHBondContact O-CB 3.37Å; Y494-A498 PolarHBondContact O-N 3.43Å; A495-A498 PolarHBondContact O-N 2.73Å; A498-N500 VanDerWaalsContact C-N 3.32Å; A498-N500 PolarHBondContact O-N 3.32Å; A498-N501 CarbonylContact O-C 3.36Å; A498-N501 PolarHBondContact O-N 3.1Å
499	L	50.1	Low	51.5	Low	105 Å²	105	72.9 Å²	72.9	55%	0.55	42%	0.419	S	S	.	.	H	α-helix	trans	-61.2	-40.1	176.8	-125.6	109.8	0	0	0	111.9	F451 A495 D496 N501	F451-L499 HydrophobicContact CD1-CD1 3.99Å; F451-L499 HydrophobicContact CE1-CB 4.22Å; F451-L499 HydrophobicContact CE1-CD1 3.47Å; F451-L499 VanDerWaalsContact CE1-CD1 3.47Å; F451-L499 HydrophobicContact CE1-CG 3.71Å; F451-L499 HydrophobicContact CZ-CD1 4.31Å; F451-L499 HydrophobicContact CZ-CG 4.48Å; A495-L499 WeakPolarHBondContact O-CB 3.46Å; A495-L499 PolarHBondContact O-N 2.79Å; D496-L499 WeakPolarHBondContact O-CB 3.34Å; D496-L499 PolarHBondContact O-N 3.2Å; L499-N501 VanDerWaalsContact C-N 3.27Å; L499-N501 PolarHBondContact O-N 2.87Å
500	N	49.3	Very low	53.3	Low	133 Å²	133	71.8 Å²	71.8	71%	0.711	41%	0.406	S	S	*	.	H	α-helix	trans	-72.6	-21.1	178.9	-69.6	-29.2	0	0	0	112.7	D496 S497 A498 S502	D496-N500 PolarHBondContact O-N 2.85Å; D496-N500 VanDerWaalsContact O-N 3.12Å; D496-N500 PolarHBondContact O-ND2 3Å; S497-N500 PolarHBondContact O-N 2.98Å; A498-N500 VanDerWaalsContact C-N 3.32Å; A498-N500 PolarHBondContact O-N 3.32Å; N500-S502 VanDerWaalsContact C-N 3.32Å; N500-S502 PolarHBondContact O-N 3.33Å
501	N	48	Very low	55.1	Low	105 Å²	105	73.4 Å²	73.4	56%	0.561	42%	0.417	S	S	*	.			trans	-88.7	70.1	170.5	-77.1	-24.7	0	0	0	110	S497 A498 L499 N503 S504	S497-N501 PolarHBondContact O-N 3.14Å; A498-N501 CarbonylContact O-C 3.36Å; A498-N501 PolarHBondContact O-N 3.1Å; L499-N501 VanDerWaalsContact C-N 3.27Å; L499-N501 PolarHBondContact O-N 2.87Å; N501-N503 PolarHBondContact O-N 2.92Å; N501-S504 PolarHBondContact O-N 2.78Å; N501-S504 VanDerWaalsContact O-N 3.16Å; N501-S504 PolarHBondContact O-OG 2.81Å
502	S	40.7	Very low	57	Low	107 Å²	107	73.9 Å²	73.9	75%	0.748	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-2.7	-177.2	53.3	0	0	0	0	116.1	N500	N500-S502 VanDerWaalsContact C-N 3.32Å; N500-S502 PolarHBondContact O-N 3.33Å
503	N	40.7	Very low	58.7	Low	154 Å²	154	80.2 Å²	80.2	82%	0.824	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.1	-0.7	179.4	-76.8	-23.8	0	0	0	115.2	N501 N505	N501-N503 PolarHBondContact O-N 2.92Å; N503-N505 PolarHBondContact O-N 3.46Å
504	S	42.7	Very low	60.5	Low	66 Å²	66	73.9 Å²	73.9	46%	0.462	41%	0.414	S	S	.	.	S	Bend	trans	-96.4	88.4	-179.6	59.8	0	0	0	0	112.5	N501	N501-S504 PolarHBondContact O-N 2.78Å; N501-S504 VanDerWaalsContact O-N 3.16Å; N501-S504 PolarHBondContact O-OG 2.81Å
505	N	42.6	Very low	62.3	Low	116 Å²	116	70.9 Å²	70.9	62%	0.62	40%	0.402	S	S	*	.			trans	44.8	110.6	143.4	-70.4	-26.8	0	0	0	118.5	N503 G507	N503-N505 PolarHBondContact O-N 3.46Å; N505-G507 PolarHBondContact O-N 2.69Å
506	V	45.9	Very low	63.9	Low	136 Å²	136	74 Å²	74	82%	0.824	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	16.8	149	-172.1	0	0	0	0	112.3	L509	V506-L509 HydrophobicContact CG1-CD1 4.17Å; V506-L509 VanDerWaalsContact O-CD1 3.25Å; V506-L509 WeakPolarHBondContact O-CD1 3.4Å
507	G	49.6	Very low	65.6	Low	54 Å²	54	71 Å²	71	56%	0.557	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-9.5	-171.9	0	0	0	0	0	115.5	N505 L509	N505-G507 PolarHBondContact O-N 2.69Å; G507-L509 VanDerWaalsContact C-N 3.31Å; G507-L509 PolarHBondContact O-N 3.07Å
508	H	60.3	Low	67.3	Low	73 Å²	73	68.2 Å²	68.2	34%	0.338	38%	0.382	S	S	.	.			trans	-93.7	52.3	-179.9	-58	-70.3	0	0	0	111.9
509	L	77.3	Confident	68.8	Low	31 Å²	31	67.7 Å²	67.7	16%	0.162	38%	0.377	C	S	.	.			trans	-114.7	139.7	174.7	-76.6	121.2	0	0	0	110.3	V506 G507	V506-L509 HydrophobicContact CG1-CD1 4.17Å; V506-L509 VanDerWaalsContact O-CD1 3.25Å; V506-L509 WeakPolarHBondContact O-CD1 3.4Å; G507-L509 VanDerWaalsContact C-N 3.31Å; G507-L509 PolarHBondContact O-N 3.07Å
510	I	88.8	Confident	69.9	Low	2 Å²	2	63.1 Å²	63.1	1%	0.01	36%	0.356	C	S	.	.			trans	-71.3	123.5	162.5	-61.5	174.3	0	0	0	107.2	I424 D426 L429 M444 N447 L515 M531 S533	I424-I510 HydrophobicContact CB-CD1 4.44Å; I424-I510 HydrophobicContact CG2-CD1 3.75Å; I424-I510 HydrophobicContact CG2-CG1 4.06Å; D426-I510 WeakPolarHBondContact OD1-CA 3.4Å; L429-I510 HydrophobicContact CD1-CB 4.5Å; L429-I510 HydrophobicContact CD1-CD1 4.33Å; L429-I510 HydrophobicContact CD1-CG1 4.15Å; L429-I510 HydrophobicContact CD1-CG2 3.71Å; M444-I510 HydrophobicContact SD-CD1 3.99Å; N447-I510 HydrophobicContact CB-CD1 4.06Å; I510-L515 HydrophobicContact CG2-CD2 4.42Å; I510-L515 HydrophobicContact CG2-CG 4.39Å; I510-M531 HydrophobicContact CB-SD 4.29Å; I510-M531 HydrophobicContact CD1-CE 3.89Å; I510-S533 WeakPolarHBondContact O-CB 3.35Å; I510-S533 PolarHBondContact O-OG 2.91Å
511	T	90.9	Very high	71.1	Confident	37 Å²	37	59.7 Å²	59.7	23%	0.227	33%	0.334	C	S	.	.			trans	-120.3	177.2	173.5	80.8	0	0	0	0	110	D426 R513 G514 L515	D426-T511 PolarHBondContact OD1-N 3.29Å; D426-T511 PolarHBondContact OD2-OG1 2.95Å; T511-R513 PolarHBondContact O-N 3.13Å; T511-R513 VanDerWaalsContact O-N 3.13Å; T511-R513 PolarHBondContact OG1-N 3.31Å; T511-G514 PolarHBondContact O-N 3.03Å; T511-L515 PolarHBondContact O-N 2.8Å; T511-L515 VanDerWaalsContact O-N 3.16Å
512	D	91.8	Very high	72.6	Confident	18 Å²	18	57.3 Å²	57.3	10%	0.096	32%	0.322	C	S	.	.	H	α-helix	trans	-54.2	-27.9	172.2	-75.2	-74.8	0	0	0	113	L515 Q516 I534 D535 G536 S537 G538	D512-L515 PolarHBondContact O-N 2.94Å; D512-Q516 WeakPolarHBondContact O-CB 3.45Å; D512-Q516 PolarHBondContact O-N 3.31Å; D512-I534 VanDerWaalsContact OD2-CA 3.27Å; D512-I534 WeakPolarHBondContact OD2-CA 3.11Å; D512-D535 PolarHBondContact OD2-N 3.1Å; D512-G536 PolarHBondContact OD1-N 3.23Å; D512-G536 VanDerWaalsContact OD1-N 3.09Å; D512-S537 WeakPolarHBondContact CB-OG 3.35Å; D512-S537 VanDerWaalsContact CG-OG 3.27Å; D512-S537 PolarHBondContact OD1-N 3.05Å; D512-G538 WeakPolarHBondContact O-CA 3.48Å; D512-G538 PolarHBondContact OD1-N 2.98Å
513	R	90.9	Very high	74.9	Confident	187 Å²	187	52.3 Å²	52.3	71%	0.706	29%	0.286	S	S	*	.	H	α-helix	trans	-67.9	-40.4	175	-68.9	-170	-69.3	178.8	-4.4	112.8	T511 Q516 S517	T511-R513 PolarHBondContact O-N 3.13Å; T511-R513 VanDerWaalsContact O-N 3.13Å; T511-R513 PolarHBondContact OG1-N 3.31Å; R513-Q516 WeakPolarHBondContact O-CB 3.5Å; R513-Q516 PolarHBondContact O-N 2.79Å; R513-S517 PolarHBondContact O-N 3.1Å
514	G	90.5	Very high	77.4	Confident	1 Å²	1	47 Å²	47	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-64.9	-45	174.4	0	0	0	0	0	111.4	D426 T511 Q516 S517	D426-G514 VanDerWaalsContact CG-CA 3.49Å; D426-G514 WeakPolarHBondContact OD1-CA 3.1Å; D426-G514 PolarHBondContact OD1-N 3.24Å; D426-G514 PolarHBondContact OD2-N 3.28Å; T511-G514 PolarHBondContact O-N 3.03Å; G514-Q516 VanDerWaalsContact C-N 3.29Å; G514-Q516 PolarHBondContact O-N 3.19Å; G514-S517 WeakPolarHBondContact O-CB 3.42Å; G514-S517 PolarHBondContact O-N 3.25Å; G514-S517 VanDerWaalsContact O-N 3.13Å; G514-S517 PolarHBondContact O-OG 2.9Å
515	L	92	Very high	79.9	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.5	-41	174.9	-68.3	-178.2	0	0	0	111.9	M444 I510 T511 D512 S517 V518 C519 V528 I534 F580	M444-L515 HydrophobicContact CE-CD2 3.67Å; I510-L515 HydrophobicContact CG2-CD2 4.42Å; I510-L515 HydrophobicContact CG2-CG 4.39Å; T511-L515 PolarHBondContact O-N 2.8Å; T511-L515 VanDerWaalsContact O-N 3.16Å; D512-L515 PolarHBondContact O-N 2.94Å; L515-S517 PolarHBondContact O-N 3.15Å; L515-S517 VanDerWaalsContact O-N 3.13Å; L515-V518 WeakPolarHBondContact O-CG2 3.48Å; L515-V518 PolarHBondContact O-N 3.28Å; L515-V518 VanDerWaalsContact O-N 3.13Å; L515-C519 WeakPolarHBondContact O-CB 3.39Å; L515-C519 PolarHBondContact O-N 3.38Å; L515-C519 PolarHBondContact O-SG 2.71Å; L515-V528 HydrophobicContact CD2-CG2 4.17Å; L515-I534 HydrophobicContact CD1-CB 4.28Å; L515-I534 HydrophobicContact CD1-CD1 3.98Å; L515-I534 HydrophobicContact CD1-CG2 3.89Å; L515-F580 HydrophobicContact CD1-CE1 4.04Å
516	Q	90.6	Very high	82.4	Confident	68 Å²	68	44.2 Å²	44.2	32%	0.318	23%	0.229	S	C	.	.	H	α-helix	trans	-57	-30.3	177.8	-171.2	179.9	43.1	0	0	113.3	D512 R513 G514 G538 N540 N541	D512-Q516 WeakPolarHBondContact O-CB 3.45Å; D512-Q516 PolarHBondContact O-N 3.31Å; R513-Q516 WeakPolarHBondContact O-CB 3.5Å; R513-Q516 PolarHBondContact O-N 2.79Å; G514-Q516 VanDerWaalsContact C-N 3.29Å; G514-Q516 PolarHBondContact O-N 3.19Å; Q516-G538 WeakPolarHBondContact CA-O 3.19Å; Q516-G538 WeakPolarHBondContact CB-O 3.43Å; Q516-G538 PolarHBondContact N-O 3.49Å; Q516-N540 PolarHBondContact NE2-ND2 3.27Å; Q516-N540 PolarHBondContact NE2-OD1 3.37Å; Q516-N541 HydrophobicContact CG-CB 4.31Å; Q516-N541 WeakPolarHBondContact CG-ND2 3.48Å; Q516-N541 PolarHBondContact NE2-ND2 3.04Å
517	S	88.3	Confident	84.8	Confident	22 Å²	22	39 Å²	39	15%	0.154	20%	0.196	C	C	.	.	H	α-helix	trans	-73.7	-29.1	-179.5	74.8	0	0	0	0	114.1	L429 N430 G433 R513 G514 L515	L429-S517 PolarHBondContact O-OG 3.5Å; N430-S517 WeakPolarHBondContact CA-OG 3.46Å; N430-S517 PolarHBondContact N-OG 3.17Å; G433-S517 WeakPolarHBondContact CA-O 3.41Å; R513-S517 PolarHBondContact O-N 3.1Å; G514-S517 WeakPolarHBondContact O-CB 3.42Å; G514-S517 PolarHBondContact O-N 3.25Å; G514-S517 VanDerWaalsContact O-N 3.13Å; G514-S517 PolarHBondContact O-OG 2.9Å; L515-S517 PolarHBondContact O-N 3.15Å; L515-S517 VanDerWaalsContact O-N 3.13Å
518	V	89	Confident	86.8	Confident	1 Å²	1	36.4 Å²	36.4	1%	0.006	17%	0.169	C	C	.	.	H	α-helix	trans	-96.8	-21.8	179.3	-65.8	0	0	0	0	112.4	L429 L432 L442 L515 K521	L429-V518 HydrophobicContact CB-CG1 4.18Å; L429-V518 WeakPolarHBondContact O-CG1 3.46Å; L432-V518 HydrophobicContact CB-CG1 4.35Å; L432-V518 HydrophobicContact CD2-CG1 4.14Å; L432-V518 HydrophobicContact CG-CG1 4.34Å; L442-V518 HydrophobicContact CD2-CB 3.93Å; L442-V518 HydrophobicContact CD2-CG1 4.04Å; L442-V518 HydrophobicContact CD2-CG2 3.71Å; L515-V518 WeakPolarHBondContact O-CG2 3.48Å; L515-V518 PolarHBondContact O-N 3.28Å; L515-V518 VanDerWaalsContact O-N 3.13Å; V518-K521 WeakPolarHBondContact O-CG 3.43Å
519	C	83.7	Confident	88.2	Confident	6 Å²	6	33.7 Å²	33.7	4%	0.041	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.2	137.7	174.4	-68	0	0	0	0	111.1	L515 L539 I542	L515-C519 WeakPolarHBondContact O-CB 3.39Å; L515-C519 PolarHBondContact O-N 3.38Å; L515-C519 PolarHBondContact O-SG 2.71Å; C519-L539 WeakPolarHBondContact SG-CD2 3.46Å; C519-I542 HydrophobicContact CB-CB 4.47Å
520	G	73.5	Confident	88.5	Confident	9 Å²	9	33 Å²	33	9%	0.093	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	96.1	-2.7	-177.3	0	0	0	0	0	115.3	N522 N541 N570	G520-N522 PolarHBondContact O-N 3.37Å; G520-N522 VanDerWaalsContact O-N 3.08Å; G520-N541 VanDerWaalsContact CA-O 3.3Å; G520-N541 WeakPolarHBondContact CA-O 3.32Å; G520-N541 PolarHBondContact N-O 3.26Å; G520-N570 CarbonylContact O-C 3.45Å
521	K	74.5	Confident	88.3	Confident	61 Å²	61	33 Å²	33	27%	0.265	16%	0.155	S	C	.	.	S	Bend	trans	-82.2	26.7	-178.9	-56	-69.2	162.7	164.8	0	115.1	G433 I439 V518	G433-K521 WeakPolarHBondContact O-CE 3.27Å; G433-K521 PolarHBondContact O-NZ 2.9Å; I439-K521 VanDerWaalsContact O-O 3.13Å; V518-K521 WeakPolarHBondContact O-CG 3.43Å
522	N	79.7	Confident	87.9	Confident	55 Å²	55	32.9 Å²	32.9	29%	0.294	16%	0.155	S	C	.	.			trans	61.7	40.3	-174.3	-159.3	21.8	0	0	0	113.9	G520 N524 G571 S572 N574	G520-N522 PolarHBondContact O-N 3.37Å; G520-N522 VanDerWaalsContact O-N 3.08Å; N522-N524 PolarHBondContact O-OD1 3.1Å; N522-G571 PolarHBondContact OD1-O 3.24Å; N522-S572 PolarHBondContact N-OG 3.19Å; N522-N574 PolarHBondContact ND2-ND2 3.05Å; N522-N574 PolarHBondContact OD1-ND2 3.44Å
523	L	89.8	Confident	87.6	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.005	16%	0.161	C	C	.	.			trans	-61.4	137.6	179.6	-70.8	168.2	0	0	0	111.3	I439 L442 L526 S572 N574 L575	I439-L523 HydrophobicContact CB-CD2 4.14Å; I439-L523 HydrophobicContact CG2-CD2 3.6Å; I439-L523 WeakPolarHBondContact O-CD2 3.4Å; L442-L523 HydrophobicContact CB-CD2 4.38Å; L523-L526 HydrophobicContact CD1-CB 4.48Å; L523-S572 PolarHBondContact N-OG 2.84Å; L523-N574 CarbonylContact O-C 3.18Å; L523-L575 HydrophobicContact CB-CD1 3.89Å; L523-L575 WeakPolarHBondContact O-CA 3.25Å; L523-L575 WeakPolarHBondContact O-CD1 2.98Å; L523-L575 PolarHBondContact O-N 3.02Å
524	N	93.5	Very high	87.6	Confident	42 Å²	42	24.6 Å²	24.6	23%	0.225	13%	0.128	C	C	.	.	S	Bend	trans	-96.8	-32.8	169.4	-68.4	16.8	0	0	0	111.6	R440 N522 L576 E577	R440-N524 HydrophobicContact CB-CB 4.25Å; R440-N524 CarbonylContact O-C 3.43Å; R440-N524 WeakPolarHBondContact O-CA 3.36Å; R440-N524 WeakPolarHBondContact O-CB 3.45Å; R440-N524 PolarHBondContact O-N 3.45Å; N522-N524 PolarHBondContact O-OD1 3.1Å; N524-L576 PolarHBondContact O-N 2.82Å; N524-E577 PolarHBondContact O-N 2.79Å
525	R	95.2	Very high	87.7	Confident	125 Å²	125	27 Å²	27	47%	0.472	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	132	178.8	-54.4	-168.2	-176.9	174.8	0.2	110.9	R440 T441 L442 L527 E577	R440-R525 PolarHBondContact O-N 3.46Å; T441-R525 WeakPolarHBondContact CA-O 3.46Å; T441-R525 HydrophobicContact CG2-CB 4.09Å; L442-R525 PolarHBondContact N-O 3.09Å; R525-L527 HydrophobicContact CB-CD1 3.89Å; R525-E577 WeakPolarHBondContact CA-O 3.17Å; R525-E577 HydrophobicContact CB-CB 4.39Å; R525-E577 HydrophobicContact CG-CB 4.04Å; R525-E577 IonicContact NE-OE2 3.43Å
526	L	95.1	Very high	87.7	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	117.5	172.1	176.8	62.2	0	0	0	108.7	L442 L523 V528 L539 L575 E577 I578 S579 F580	L442-L526 HydrophobicContact CB-CD1 4.12Å; L442-L526 HydrophobicContact CD2-CD1 4.19Å; L442-L526 HydrophobicContact CG-CD1 4.3Å; L523-L526 HydrophobicContact CD1-CB 4.48Å; L526-V528 HydrophobicContact CD1-CG2 4Å; L526-V528 HydrophobicContact CG-CG2 4.3Å; L526-L539 HydrophobicContact CD2-CD2 3.96Å; L526-L575 HydrophobicContact CB-CD1 4.5Å; L526-E577 PolarHBondContact N-O 3.23Å; L526-E577 VanDerWaalsContact N-O 3.12Å; L526-I578 CarbonylContact O-C 3.55Å; L526-I578 WeakPolarHBondContact O-CA 3.07Å; L526-S579 PolarHBondContact O-N 3.07Å; L526-F580 HydrophobicContact CD2-CE2 4.5Å; L526-F580 HydrophobicContact CD2-CZ 3.97Å
527	L	95.1	Very high	87.7	Confident	26 Å²	26	26 Å²	26	14%	0.136	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	115.9	-179.7	-67.5	90.4	0	0	0	109.3	L442 E443 M444 R525	L442-L527 PolarHBondContact O-N 3.2Å; E443-L527 CarbonylContact C-O 3.15Å; E443-L527 WeakPolarHBondContact CA-O 3.43Å; E443-L527 HydrophobicContact CB-CB 4.34Å; E443-L527 HydrophobicContact CG-CB 3.87Å; M444-L527 PolarHBondContact N-O 2.97Å; R525-L527 HydrophobicContact CB-CD1 3.89Å
528	V	93	Very high	87.8	Confident	0 Å²	0	25.1 Å²	25.1	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	136.9	177.1	-178.3	0	0	0	0	107.4	M444 L515 L526 M531 I534 S579 F580 L581	M444-V528 HydrophobicContact CE-CG2 3.74Å; L515-V528 HydrophobicContact CD2-CG2 4.17Å; L526-V528 HydrophobicContact CD1-CG2 4Å; L526-V528 HydrophobicContact CG-CG2 4.3Å; V528-M531 HydrophobicContact CG1-CB 4.29Å; V528-M531 HydrophobicContact CG1-CG 3.47Å; V528-M531 VanDerWaalsContact CG1-CG 3.47Å; V528-I534 HydrophobicContact CG1-CD1 3.9Å; V528-S579 PolarHBondContact N-O 2.91Å; V528-S579 VanDerWaalsContact O-O 3.12Å; V528-F580 HydrophobicContact CB-CD1 3.72Å; V528-F580 HydrophobicContact CB-CE1 3.72Å; V528-F580 HydrophobicContact CG1-CD1 4.22Å; V528-F580 HydrophobicContact CG1-CE1 4.26Å; V528-F580 HydrophobicContact CG2-CD1 4.36Å; V528-F580 HydrophobicContact CG2-CE1 3.85Å; V528-F580 VanDerWaalsContact O-CA 3.23Å; V528-F580 WeakPolarHBondContact O-CA 3.39Å; V528-L581 PolarHBondContact O-N 2.71Å
529	S	89.8	Confident	87.8	Confident	15 Å²	15	25 Å²	25	11%	0.105	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	159.4	175.4	75.7	0	0	0	0	113.7	M444 V445 N446 L581	M444-S529 PolarHBondContact O-N 3.4Å; V445-S529 VanDerWaalsContact CA-OG 3.29Å; V445-S529 WeakPolarHBondContact CA-OG 3.49Å; V445-S529 WeakPolarHBondContact CB-OG 3.47Å; V445-S529 WeakPolarHBondContact CG1-OG 3.29Å; N446-S529 PolarHBondContact N-O 3.43Å; S529-L581 CarbonylContact C-O 3.6Å; S529-L581 WeakPolarHBondContact CA-O 3.18Å; S529-L581 WeakPolarHBondContact CB-O 3.5Å
530	N	82.7	Confident	87.9	Confident	16 Å²	16	27.6 Å²	27.6	9%	0.086	15%	0.148	C	C	.	.	S	Bend	trans	51.9	64	-177.7	-169.5	25	0	0	0	109	N446 Q448 L581 D582	N446-N530 PolarHBondContact OD1-ND2 3.39Å; Q448-N530 VanDerWaalsContact CD-O 3.27Å; Q448-N530 WeakPolarHBondContact CG-O 3.34Å; Q448-N530 PolarHBondContact NE2-O 3.33Å; Q448-N530 PolarHBondContact NE2-OD1 2.81Å; N530-L581 PolarHBondContact N-O 2.52Å; N530-D582 WeakPolarHBondContact CA-O 3.14Å
531	M	85.6	Confident	88.3	Confident	2 Å²	2	30.1 Å²	30.1	1%	0.01	16%	0.159	C	C	.	.			trans	-129.7	108.2	178.7	-68.8	-66.8	163.7	0	0	111.6	N447 Q448 I510 V528 I534 D582 C583	N447-M531 HydrophobicContact CB-CE 3.57Å; Q448-M531 HydrophobicContact CG-SD 4.22Å; I510-M531 HydrophobicContact CB-SD 4.29Å; I510-M531 HydrophobicContact CD1-CE 3.89Å; V528-M531 HydrophobicContact CG1-CB 4.29Å; V528-M531 HydrophobicContact CG1-CG 3.47Å; V528-M531 VanDerWaalsContact CG1-CG 3.47Å; M531-I534 HydrophobicContact CB-CD1 3.52Å; M531-I534 HydrophobicContact CB-CG1 3.61Å; M531-I534 HydrophobicContact CG-CD1 4.1Å; M531-D582 PolarHBondContact N-O 3.33Å; M531-C583 WeakPolarHBondContact O-CA 3.39Å
532	S	82.6	Confident	88.7	Confident	35 Å²	35	27.3 Å²	27.3	25%	0.245	15%	0.147	C	C	.	.	S	Bend	trans	-90.8	-5.2	-178.4	57.7	0	0	0	0	113.8	Q448 K585	Q448-S532 PolarHBondContact NE2-OG 3.3Å; Q448-S532 PolarHBondContact OE1-OG 3.1Å; S532-K585 WeakPolarHBondContact O-CD 3.47Å; S532-K585 WeakPolarHBondContact O-CE 3.44Å; S532-K585 PolarHBondContact O-NZ 2.92Å; S532-K585 VanDerWaalsContact O-NZ 3.09Å
533	S	84.8	Confident	88.5	Confident	31 Å²	31	26.1 Å²	26.1	22%	0.217	14%	0.142	C	C	.	.	S	Bend	trans	-96.6	-14.4	-177.3	44.6	0	0	0	0	114	I510	I510-S533 WeakPolarHBondContact O-CB 3.35Å; I510-S533 PolarHBondContact O-OG 2.91Å
534	I	90.5	Very high	87	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.159	C	C	.	.			trans	-105.4	136.8	-172.9	64	177.1	0	0	0	112.1	D512 L515 V528 M531 F580 C583 K585 M586	D512-I534 VanDerWaalsContact OD2-CA 3.27Å; D512-I534 WeakPolarHBondContact OD2-CA 3.11Å; L515-I534 HydrophobicContact CD1-CB 4.28Å; L515-I534 HydrophobicContact CD1-CD1 3.98Å; L515-I534 HydrophobicContact CD1-CG2 3.89Å; V528-I534 HydrophobicContact CG1-CD1 3.9Å; M531-I534 HydrophobicContact CB-CD1 3.52Å; M531-I534 HydrophobicContact CB-CG1 3.61Å; M531-I534 HydrophobicContact CG-CD1 4.1Å; I534-F580 HydrophobicContact CD1-CD1 3.72Å; I534-F580 HydrophobicContact CD1-CE1 3.84Å; I534-C583 HydrophobicContact CD1-CB 4.44Å; I534-C583 HydrophobicContact CG1-CB 4.39Å; I534-K585 CarbonylContact O-C 3.44Å; I534-K585 WeakPolarHBondContact O-CB 3.12Å; I534-M586 HydrophobicContact CB-CE 4.48Å; I534-M586 HydrophobicContact CD1-CE 3.66Å; I534-M586 HydrophobicContact CG1-CE 3.81Å
535	D	92	Very high	84.9	Confident	53 Å²	53	32.5 Å²	32.5	28%	0.283	18%	0.179	S	C	.	.			trans	-116.8	-8.7	179.8	72.4	7.7	0	0	0	114.6	D512 S537 K585 N587	D512-D535 PolarHBondContact OD2-N 3.1Å; D535-S537 WeakPolarHBondContact OD1-CB 3.31Å; D535-S537 PolarHBondContact OD1-N 2.63Å; D535-S537 PolarHBondContact OD1-OG 2.9Å; D535-K585 WeakPolarHBondContact CA-O 3.29Å; D535-K585 HydrophobicContact CB-CB 4.38Å; D535-N587 VanDerWaalsContact O-CG 3.29Å; D535-N587 PolarHBondContact O-N 3.27Å; D535-N587 PolarHBondContact O-ND2 2.9Å; D535-N587 PolarHBondContact O-OD1 2.94Å
536	G	91.7	Very high	82.5	Confident	0 Å²	0	31 Å²	31	0%	0	18%	0.181	C	C	.	.	S	Bend	trans	105.6	-10.7	178.6	0	0	0	0	0	113.9	D512 G538 L539 M586	D512-G536 PolarHBondContact OD1-N 3.23Å; D512-G536 VanDerWaalsContact OD1-N 3.09Å; G536-G538 PolarHBondContact O-N 3.09Å; G536-L539 PolarHBondContact O-N 3.45Å; G536-M586 WeakPolarHBondContact CA-SD 3.46Å
537	S	91.6	Very high	79.7	Confident	46 Å²	46	36.3 Å²	36.3	32%	0.322	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-61.6	-23.7	176.8	59.5	0	0	0	0	113.5	D512 D535 L539 N540	D512-S537 WeakPolarHBondContact CB-OG 3.35Å; D512-S537 VanDerWaalsContact CG-OG 3.27Å; D512-S537 PolarHBondContact OD1-N 3.05Å; D535-S537 WeakPolarHBondContact OD1-CB 3.31Å; D535-S537 PolarHBondContact OD1-N 2.63Å; D535-S537 PolarHBondContact OD1-OG 2.9Å; S537-L539 PolarHBondContact O-N 3.39Å; S537-N540 PolarHBondContact O-N 3.18Å
538	G	89.5	Confident	77.1	Confident	3 Å²	3	40.4 Å²	40.4	3%	0.031	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-69	-12.9	178.1	0	0	0	0	0	114.5	D512 Q516 G536 N540	D512-G538 WeakPolarHBondContact O-CA 3.48Å; D512-G538 PolarHBondContact OD1-N 2.98Å; Q516-G538 WeakPolarHBondContact CA-O 3.19Å; Q516-G538 WeakPolarHBondContact CB-O 3.43Å; Q516-G538 PolarHBondContact N-O 3.49Å; G536-G538 PolarHBondContact O-N 3.09Å; G538-N540 VanDerWaalsContact C-N 3.32Å
539	L	90.6	Very high	74.5	Confident	0 Å²	0	46 Å²	46	0%	0	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-90	4.4	-176.7	-64.4	162	0	0	0	113.3	C519 L526 G536 S537 N541 I542 F580 L590 H593	C519-L539 WeakPolarHBondContact SG-CD2 3.46Å; L526-L539 HydrophobicContact CD2-CD2 3.96Å; G536-L539 PolarHBondContact O-N 3.45Å; S537-L539 PolarHBondContact O-N 3.39Å; L539-N541 PolarHBondContact O-N 2.57Å; L539-N541 VanDerWaalsContact O-N 3.08Å; L539-I542 HydrophobicContact CD2-CD1 4.04Å; L539-I542 VanDerWaalsContact O-CB 3.23Å; L539-I542 WeakPolarHBondContact O-CB 3.34Å; L539-I542 WeakPolarHBondContact O-CG2 3.23Å; L539-I542 PolarHBondContact O-N 3.42Å; L539-F580 HydrophobicContact CD1-CE2 3.72Å; L539-F580 HydrophobicContact CD1-CZ 3.72Å; L539-F580 HydrophobicContact CD2-CE2 4.48Å; L539-F580 HydrophobicContact CD2-CZ 4.05Å; L539-F580 HydrophobicContact CG-CZ 4.37Å; L539-L590 HydrophobicContact CD1-CB 4.34Å; L539-L590 HydrophobicContact CD1-CD1 3.12Å; L539-L590 HydrophobicContact CD1-CG 4.28Å; L539-H593 HydrophobicContact CB-CB 4.22Å
540	N	85.9	Confident	71.8	Confident	60 Å²	60	53 Å²	53	32%	0.321	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-57.7	-23.6	179.5	62.9	4.9	0	0	0	114.7	Q516 S537 G538	Q516-N540 PolarHBondContact NE2-ND2 3.27Å; Q516-N540 PolarHBondContact NE2-OD1 3.37Å; S537-N540 PolarHBondContact O-N 3.18Å; G538-N540 VanDerWaalsContact C-N 3.32Å
541	N	81.8	Confident	69.5	Low	62 Å²	62	62.9 Å²	62.9	33%	0.332	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-95.8	5.5	176.7	-73.3	-15.5	0	0	0	113.9	Q516 G520 L539 V543	Q516-N541 HydrophobicContact CG-CB 4.31Å; Q516-N541 WeakPolarHBondContact CG-ND2 3.48Å; Q516-N541 PolarHBondContact NE2-ND2 3.04Å; G520-N541 VanDerWaalsContact CA-O 3.3Å; G520-N541 WeakPolarHBondContact CA-O 3.32Å; G520-N541 PolarHBondContact N-O 3.26Å; L539-N541 PolarHBondContact O-N 2.57Å; L539-N541 VanDerWaalsContact O-N 3.08Å; N541-V543 PolarHBondContact O-N 3.48Å
542	I	82.8	Confident	67.3	Low	1 Å²	1	71.2 Å²	71.2	1%	0.005	37%	0.372	C	S	.	.	S	Bend	trans	-61.1	-33.4	-178.5	-156.5	167.7	0	0	0	111.9	C519 L539 S572 L575 I578 H593 L594 L597	C519-I542 HydrophobicContact CB-CB 4.47Å; L539-I542 HydrophobicContact CD2-CD1 4.04Å; L539-I542 VanDerWaalsContact O-CB 3.23Å; L539-I542 WeakPolarHBondContact O-CB 3.34Å; L539-I542 WeakPolarHBondContact O-CG2 3.23Å; L539-I542 PolarHBondContact O-N 3.42Å; I542-S572 WeakPolarHBondContact O-CB 3.11Å; I542-S572 PolarHBondContact O-N 2.83Å; I542-L575 HydrophobicContact CD1-CD2 3.74Å; I542-I578 HydrophobicContact CD1-CD1 4.23Å; I542-H593 HydrophobicContact CG2-CB 4.3Å; I542-L594 HydrophobicContact CD1-CD2 4.06Å; I542-L597 HydrophobicContact CD1-CD1 4.4Å
543	V	74	Confident	65	Low	30 Å²	30	73.9 Å²	73.9	18%	0.182	39%	0.391	C	S	.	.	S	Bend	trans	-113.3	123.5	166.6	-175.4	0	0	0	0	107.9	N541 N545 L573 P596 L597	N541-V543 PolarHBondContact O-N 3.48Å; V543-N545 PolarHBondContact O-N 3.32Å; V543-L573 HydrophobicContact CG1-CD2 4.4Å; V543-P596 HydrophobicContact CG1-CB 4.37Å; V543-P596 HydrophobicContact CG2-CB 4.11Å; V543-P596 HydrophobicContact CG2-CG 4.24Å; V543-L597 HydrophobicContact CG2-CD2 3.58Å; V543-L597 HydrophobicContact CG2-CG 4.25Å
544	P	59.7	Low	63.1	Low	57 Å²	57	82.9 Å²	82.9	37%	0.37	43%	0.426	S	S	.	.			trans	-58.3	131.6	178.1	-23.9	32.9	0	0	0	110.2	D546 N570	P544-D546 PolarHBondContact O-N 2.98Å; P544-N570 VanDerWaalsContact CG-C 3.47Å; P544-N570 WeakPolarHBondContact CG-O 3.24Å
545	N	49	Very low	60.8	Low	120 Å²	120	85.6 Å²	85.6	64%	0.642	45%	0.445	S	S	*	.	S	Bend	trans	-66.2	81.4	175.1	-86.6	-33.3	0	0	0	110.7	V543	V543-N545 PolarHBondContact O-N 3.32Å
546	D	44.9	Very low	58.6	Low	95 Å²	95	91.5 Å²	91.5	51%	0.508	47%	0.468	S	S	.	.	S	Bend	trans	-116.3	6.4	170.7	-129.3	8.4	0	0	0	113.9	P544 R550	P544-D546 PolarHBondContact O-N 2.98Å; D546-R550 PolarHBondContact O-NH1 3.48Å
547	N	37.2	Very low	56.3	Low	111 Å²	111	95.3 Å²	95.3	59%	0.594	50%	0.5	S	S	*	.	S	Bend	trans	-140	-2	-177.5	-77.8	-41.6	0	0	0	118	R550	N547-R550 PolarHBondContact OD1-NH1 3.35Å
548	V	38.8	Very low	53.6	Low	111 Å²	111	100 Å²	100	67%	0.673	52%	0.517	S	S	*	.	S	Bend	trans	-79.6	-40.3	-177.8	-174.4	0	0	0	0	112.3	R550	V548-R550 PolarHBondContact O-N 3.28Å; V548-R550 VanDerWaalsContact O-N 3.16Å
549	S	38.1	Very low	51	Low	118 Å²	118	108.7 Å²	108.7	83%	0.825	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-1.4	178.6	-57.5	0	0	0	0	114.8
550	R	33.1	Very low	48.4	Very low	161 Å²	161	116.2 Å²	116.2	61%	0.608	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-13.8	-177.6	-77.3	-177.1	175.8	160.4	0.1	114.6	D546 N547 V548	D546-R550 PolarHBondContact O-NH1 3.48Å; N547-R550 PolarHBondContact OD1-NH1 3.35Å; V548-R550 PolarHBondContact O-N 3.28Å; V548-R550 VanDerWaalsContact O-N 3.16Å
551	R	35.6	Very low	46.1	Very low	224 Å²	224	117.8 Å²	117.8	85%	0.845	60%	0.604	S	S	*	*	S	Bend	trans	-86.8	-9.7	-174.8	-76.5	-173.1	174.7	178.4	-0.6	115.7
552	H	38.4	Very low	43.8	Very low	177 Å²	177	122.8 Å²	122.8	82%	0.819	62%	0.622	S	S	*	*	S	Bend	trans	-120	2.6	-173.7	-67	-53.9	0	0	0	117.1
553	S	34.5	Very low	41.5	Very low	91 Å²	91	129.5 Å²	129.5	64%	0.636	66%	0.657	S	S	*	*			trans	-96.5	105.3	176.3	-167.4	0	0	0	0	112.1	S555	S553-S555 PolarHBondContact O-N 3.17Å; S553-S555 VanDerWaalsContact O-N 3.11Å
554	K	46.2	Very low	39.5	Very low	220 Å²	220	135.8 Å²	135.8	96%	0.957	69%	0.69	S	S	*	*			trans	-73.1	14.1	179.4	-75.7	-177.1	175.9	176.5	0	114.7
555	S	41.2	Very low	38.2	Very low	57 Å²	57	137.7 Å²	137.7	40%	0.399	71%	0.705	S	S	.	*			trans	-91.6	114.1	-178.4	172.1	0	0	0	0	112.2	S553 A557	S553-S555 PolarHBondContact O-N 3.17Å; S553-S555 VanDerWaalsContact O-N 3.11Å; S555-A557 PolarHBondContact O-N 3.4Å
556	K	45.6	Very low	37.3	Very low	177 Å²	177	135.4 Å²	135.4	77%	0.77	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-66.3	-22	178.9	-152.3	175.7	-175.7	-179.3	0	112.7	H558	K556-H558 PolarHBondContact O-N 3.47Å
557	A	44.3	Very low	36.7	Very low	80 Å²	80	137.6 Å²	137.6	66%	0.661	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-79.4	-13	-172.2	0	0	0	0	0	114.9	S555	S555-A557 PolarHBondContact O-N 3.4Å
558	H	35.5	Very low	36.5	Very low	145 Å²	145	139 Å²	139	67%	0.671	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-99	4.8	179.8	-83.3	-8.6	0	0	0	115.2	K556	K556-H558 PolarHBondContact O-N 3.47Å
559	R	34.7	Very low	36.7	Very low	186 Å²	186	137.6 Å²	137.6	70%	0.702	72%	0.719	S	S	*	*	S	Bend	trans	-76.8	-19.3	178.6	-100.2	-174.8	-89.6	-161.5	-6.2	114.7
560	L	36.1	Very low	36.9	Very low	157 Å²	157	137 Å²	137	82%	0.822	71%	0.706	S	S	*	*	S	Bend	trans	-102.7	-19.7	-169.8	-74	164	0	0	0	115.2
561	S	36.5	Very low	37.8	Very low	94 Å²	94	129.4 Å²	129.4	66%	0.657	68%	0.678	S	S	*	*	S	Bend	trans	-94.2	1.9	-173.8	64.6	0	0	0	0	115.8
562	K	33.6	Very low	39.2	Very low	167 Å²	167	118.8 Å²	118.8	73%	0.726	64%	0.638	S	S	*	*	S	Bend	trans	-130.5	21.8	-176.5	-94.3	-178.4	177.7	179.2	0	115.9	N564	K562-N564 VanDerWaalsContact C-N 3.32Å
563	L	34.4	Very low	40.9	Very low	141 Å²	141	113.2 Å²	113.2	74%	0.738	61%	0.614	S	S	*	*	S	Bend	trans	-82.1	-4.6	170.9	-91	156.2	0	0	0	114.1
564	N	32.6	Very low	43.3	Very low	162 Å²	162	112 Å²	112	87%	0.866	60%	0.601	S	S	*	*			trans	-108.4	6.8	-173.6	-77.3	-4.9	0	0	0	116	K562 G566	K562-N564 VanDerWaalsContact C-N 3.32Å; N564-G566 PolarHBondContact O-N 3.27Å
565	S	32.9	Very low	45.5	Very low	97 Å²	97	101.5 Å²	101.5	68%	0.678	56%	0.555	S	S	*	*	S	Bend	trans	-87.6	105.3	166	58.9	0	0	0	0	108.9	L567	S565-L567 PolarHBondContact O-N 3.28Å; S565-L567 VanDerWaalsContact O-N 3.16Å
566	G	29.6	Very low	48.1	Very low	72 Å²	72	102 Å²	102	74%	0.742	55%	0.553	S	S	*	*			trans	-39.1	116.9	176.9	0	0	0	0	0	112.6	N564 L568	N564-G566 PolarHBondContact O-N 3.27Å; G566-L568 PolarHBondContact O-N 3.22Å
567	L	31.8	Very low	50.5	Low	141 Å²	141	94.5 Å²	94.5	74%	0.738	52%	0.521	S	S	*	.			trans	-54.4	87.5	177.8	-169.3	82.5	0	0	0	111.1	S565 V569	S565-L567 PolarHBondContact O-N 3.28Å; S565-L567 VanDerWaalsContact O-N 3.16Å; L567-V569 VanDerWaalsContact C-N 3.28Å; L567-V569 HydrophobicContact CD2-CG2 3.46Å; L567-V569 VanDerWaalsContact CD2-CG2 3.46Å; L567-V569 HydrophobicContact CG-CG2 3.52Å; L567-V569 PolarHBondContact O-N 3.05Å
568	L	33	Very low	53	Low	140 Å²	140	90.7 Å²	90.7	73%	0.733	49%	0.489	S	S	*	.			trans	-75.6	88.2	162.9	-72.2	173.7	0	0	0	107.4	G566 N570	G566-L568 PolarHBondContact O-N 3.22Å; L568-N570 PolarHBondContact O-N 3.23Å
569	V	43.6	Very low	55.9	Low	82 Å²	82	84 Å²	84	50%	0.497	46%	0.458	S	S	.	.			trans	-66.9	63.5	170.3	-170.1	0	0	0	0	108.9	L567 G571 L573	L567-V569 VanDerWaalsContact C-N 3.28Å; L567-V569 HydrophobicContact CD2-CG2 3.46Å; L567-V569 VanDerWaalsContact CD2-CG2 3.46Å; L567-V569 HydrophobicContact CG-CG2 3.52Å; L567-V569 PolarHBondContact O-N 3.05Å; V569-G571 PolarHBondContact O-N 3.19Å; V569-G571 VanDerWaalsContact O-N 3.14Å; V569-L573 HydrophobicContact CG1-CD1 3.92Å
570	N	41.5	Very low	58.7	Low	106 Å²	106	75.1 Å²	75.1	57%	0.567	43%	0.425	S	S	*	.			trans	-88.6	53.1	179.9	-76.4	-3.8	0	0	0	110.1	G520 P544 L568	G520-N570 CarbonylContact O-C 3.45Å; P544-N570 VanDerWaalsContact CG-C 3.47Å; P544-N570 WeakPolarHBondContact CG-O 3.24Å; L568-N570 PolarHBondContact O-N 3.23Å
571	G	53.1	Low	61.4	Low	2 Å²	2	70.2 Å²	70.2	2%	0.021	40%	0.399	C	S	.	.	S	Bend	trans	-126.4	148.9	-178.6	0	0	0	0	0	113.3	N522 V569 L573	N522-G571 PolarHBondContact OD1-O 3.24Å; V569-G571 PolarHBondContact O-N 3.19Å; V569-G571 VanDerWaalsContact O-N 3.14Å; G571-L573 PolarHBondContact O-N 2.98Å
572	S	63.8	Low	63.9	Low	0 Å²	0	67.5 Å²	67.5	0%	0	38%	0.377	C	S	.	.			trans	-71.8	43.6	177	-55.1	0	0	0	0	113.8	N522 L523 I542 N574 L575 L597	N522-S572 PolarHBondContact N-OG 3.19Å; L523-S572 PolarHBondContact N-OG 2.84Å; I542-S572 WeakPolarHBondContact O-CB 3.11Å; I542-S572 PolarHBondContact O-N 2.83Å; S572-N574 PolarHBondContact O-N 2.8Å; S572-N574 VanDerWaalsContact O-N 3.13Å; S572-L575 WeakPolarHBondContact O-CB 3.33Å; S572-L575 PolarHBondContact O-N 3.46Å; S572-L575 VanDerWaalsContact O-N 3.14Å; S572-L597 WeakPolarHBondContact O-CD2 3.23Å
573	L	75.5	Confident	66.7	Low	60 Å²	60	59.5 Å²	59.5	31%	0.314	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-17.6	173.6	-64.7	176	0	0	0	112.3	V543 V569 G571 P598 H599	V543-L573 HydrophobicContact CG1-CD2 4.4Å; V569-L573 HydrophobicContact CG1-CD1 3.92Å; G571-L573 PolarHBondContact O-N 2.98Å; L573-P598 WeakPolarHBondContact O-CD 3.34Å; L573-H599 PolarHBondContact O-CD2 3.45Å; L573-H599 VanDerWaalsContact O-CD2 3.28Å
574	N	84.5	Confident	69.2	Low	66 Å²	66	54.8 Å²	54.8	35%	0.353	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91	10.1	178.1	-63.8	-48.2	0	0	0	114	N522 L523 S572 L576	N522-N574 PolarHBondContact ND2-ND2 3.05Å; N522-N574 PolarHBondContact OD1-ND2 3.44Å; L523-N574 CarbonylContact O-C 3.18Å; S572-N574 PolarHBondContact O-N 2.8Å; S572-N574 VanDerWaalsContact O-N 3.13Å; N574-L576 WeakPolarHBondContact O-CG 3.26Å; N574-L576 PolarHBondContact O-N 3.43Å; N574-L576 VanDerWaalsContact O-N 3.15Å
575	L	91.7	Very high	72.1	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.304	C	S	.	.			trans	-63.3	117.9	178.6	-163	73.9	0	0	0	110.5	L523 L526 I542 S572 I578 L597 H599 L600	L523-L575 HydrophobicContact CB-CD1 3.89Å; L523-L575 WeakPolarHBondContact O-CA 3.25Å; L523-L575 WeakPolarHBondContact O-CD1 2.98Å; L523-L575 PolarHBondContact O-N 3.02Å; L526-L575 HydrophobicContact CB-CD1 4.5Å; I542-L575 HydrophobicContact CD1-CD2 3.74Å; S572-L575 WeakPolarHBondContact O-CB 3.33Å; S572-L575 PolarHBondContact O-N 3.46Å; S572-L575 VanDerWaalsContact O-N 3.14Å; L575-I578 HydrophobicContact CD2-CB 4.07Å; L575-I578 HydrophobicContact CD2-CD1 4.02Å; L575-I578 HydrophobicContact CD2-CG1 4.35Å; L575-L597 HydrophobicContact CB-CD1 4.21Å; L575-L597 HydrophobicContact CB-CD2 4.5Å; L575-L597 HydrophobicContact CD2-CD1 3.67Å; L575-H599 CarbonylContact O-C 3.6Å; L575-L600 HydrophobicContact CD2-CD1 4.13Å; L575-L600 HydrophobicContact CG-CD1 4.11Å; L575-L600 WeakPolarHBondContact O-CA 3.29Å; L575-L600 PolarHBondContact O-N 3.04Å
576	L	95.5	Very high	75	Confident	67 Å²	67	48.2 Å²	48.2	35%	0.351	27%	0.272	S	S	.	.			trans	-102	-32.9	-179.4	-60.6	-179.4	0	0	0	112.1	N524 N574 H599 T601 V602	N524-L576 PolarHBondContact O-N 2.82Å; N574-L576 WeakPolarHBondContact O-CG 3.26Å; N574-L576 PolarHBondContact O-N 3.43Å; N574-L576 VanDerWaalsContact O-N 3.15Å; L576-H599 HydrophobicContact CD2-CB 3.88Å; L576-H599 VanDerWaalsContact CD2-O 3.31Å; L576-H599 WeakPolarHBondContact CD2-O 3.41Å; L576-T601 PolarHBondContact O-N 3Å; L576-T601 PolarHBondContact O-OG1 2.88Å; L576-V602 PolarHBondContact O-N 3.23Å; L576-V602 VanDerWaalsContact O-N 3.1Å
577	E	96.6	Very high	78	Confident	20 Å²	20	46.6 Å²	46.6	9%	0.093	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	132.3	-177.6	178.6	170	-169.6	0	0	111	N524 R525 L526 V602 K604	N524-E577 PolarHBondContact O-N 2.79Å; R525-E577 WeakPolarHBondContact CA-O 3.17Å; R525-E577 HydrophobicContact CB-CB 4.39Å; R525-E577 HydrophobicContact CG-CB 4.04Å; R525-E577 IonicContact NE-OE2 3.43Å; L526-E577 PolarHBondContact N-O 3.23Å; L526-E577 VanDerWaalsContact N-O 3.12Å; E577-V602 WeakPolarHBondContact CA-O 3.39Å; E577-V602 HydrophobicContact CB-CB 4.02Å; E577-V602 HydrophobicContact CB-CG1 4.5Å; E577-V602 HydrophobicContact CG-CB 3.84Å; E577-V602 HydrophobicContact CG-CG1 3.77Å; E577-K604 WeakPolarHBondContact OE1-CE 3.48Å; E577-K604 IonicContact OE1-NZ 3.75Å; E577-K604 PolarHBondContact OE1-NZ 3.38Å
578	I	95.6	Very high	81.1	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	132.4	170	-161	170.4	0	0	0	109.6	L526 I542 L575 F580 L590 L594 L600 V602 V603 K604	L526-I578 CarbonylContact O-C 3.55Å; L526-I578 WeakPolarHBondContact O-CA 3.07Å; I542-I578 HydrophobicContact CD1-CD1 4.23Å; L575-I578 HydrophobicContact CD2-CB 4.07Å; L575-I578 HydrophobicContact CD2-CD1 4.02Å; L575-I578 HydrophobicContact CD2-CG1 4.35Å; I578-F580 HydrophobicContact CD1-CD2 4.39Å; I578-F580 HydrophobicContact CD1-CE2 3.68Å; I578-F580 HydrophobicContact CG1-CD2 4.07Å; I578-F580 HydrophobicContact CG1-CE2 3.64Å; I578-L590 HydrophobicContact CD1-CD1 4.06Å; I578-L594 HydrophobicContact CD1-CD1 4.13Å; I578-L594 HydrophobicContact CD1-CD2 3.47Å; I578-L594 VanDerWaalsContact CD1-CD2 3.47Å; I578-L594 HydrophobicContact CD1-CG 4.42Å; I578-L594 HydrophobicContact CG2-CD1 3.89Å; I578-L600 HydrophobicContact CB-CD1 4.31Å; I578-L600 HydrophobicContact CG2-CD1 4.1Å; I578-L600 HydrophobicContact CG2-CD2 4.16Å; I578-V602 PolarHBondContact N-O 2.93Å; I578-V603 HydrophobicContact CG2-CB 4.46Å; I578-V603 HydrophobicContact CG2-CG1 4.37Å; I578-V603 HydrophobicContact CG2-CG2 4Å; I578-V603 WeakPolarHBondContact O-CA 3.41Å; I578-K604 PolarHBondContact O-N 3.03Å
579	S	96.3	Very high	84	Confident	3 Å²	3	37.6 Å²	37.6	2%	0.021	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	120.4	-176.3	-178.7	0	0	0	0	110.3	L526 V528 L581 K604	L526-S579 PolarHBondContact O-N 3.07Å; V528-S579 PolarHBondContact N-O 2.91Å; V528-S579 VanDerWaalsContact O-O 3.12Å; S579-L581 WeakPolarHBondContact OG-CG 3.32Å; S579-K604 CarbonylContact C-O 3.49Å; S579-K604 VanDerWaalsContact CA-O 3.29Å; S579-K604 WeakPolarHBondContact CA-O 3.45Å
580	F	95.5	Very high	86.4	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	94.1	168.7	-70	-81.5	0	0	0	107.9	L515 L526 V528 I534 L539 I578 C583 M586 L590 K604 L605 C608	L515-F580 HydrophobicContact CD1-CE1 4.04Å; L526-F580 HydrophobicContact CD2-CE2 4.5Å; L526-F580 HydrophobicContact CD2-CZ 3.97Å; V528-F580 HydrophobicContact CB-CD1 3.72Å; V528-F580 HydrophobicContact CB-CE1 3.72Å; V528-F580 HydrophobicContact CG1-CD1 4.22Å; V528-F580 HydrophobicContact CG1-CE1 4.26Å; V528-F580 HydrophobicContact CG2-CD1 4.36Å; V528-F580 HydrophobicContact CG2-CE1 3.85Å; V528-F580 VanDerWaalsContact O-CA 3.23Å; V528-F580 WeakPolarHBondContact O-CA 3.39Å; I534-F580 HydrophobicContact CD1-CD1 3.72Å; I534-F580 HydrophobicContact CD1-CE1 3.84Å; L539-F580 HydrophobicContact CD1-CE2 3.72Å; L539-F580 HydrophobicContact CD1-CZ 3.72Å; L539-F580 HydrophobicContact CD2-CE2 4.48Å; L539-F580 HydrophobicContact CD2-CZ 4.05Å; L539-F580 HydrophobicContact CG-CZ 4.37Å; I578-F580 HydrophobicContact CD1-CD2 4.39Å; I578-F580 HydrophobicContact CD1-CE2 3.68Å; I578-F580 HydrophobicContact CG1-CD2 4.07Å; I578-F580 HydrophobicContact CG1-CE2 3.64Å; F580-C583 HydrophobicContact CB-CB 4.39Å; F580-M586 HydrophobicContact CB-CE 3.97Å; F580-M586 HydrophobicContact CD1-CE 3.34Å; F580-M586 HydrophobicContact CD2-CE 4.19Å; F580-M586 HydrophobicContact CE1-CE 3.8Å; F580-M586 HydrophobicContact CG-CE 3.57Å; F580-M586 HydrophobicContact CZ-CE 4.39Å; F580-L590 HydrophobicContact CD2-CD1 4.08Å; F580-L590 HydrophobicContact CD2-CD2 4.13Å; F580-L590 HydrophobicContact CE2-CD1 3.84Å; F580-K604 PolarHBondContact N-O 3.23Å; F580-L605 HydrophobicContact CB-CD2 4Å; F580-L605 HydrophobicContact CD2-CD2 4.28Å; F580-L605 WeakPolarHBondContact O-CA 3.5Å; F580-C608 PolarHBondContact O-SG 2.86Å
581	L	92.8	Very high	89	Confident	54 Å²	54	28.7 Å²	28.7	28%	0.283	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	137.9	-177.5	-58.7	173	0	0	0	110	V528 S529 N530 S579 C583 K604 S606	V528-L581 PolarHBondContact O-N 2.71Å; S529-L581 CarbonylContact C-O 3.6Å; S529-L581 WeakPolarHBondContact CA-O 3.18Å; S529-L581 WeakPolarHBondContact CB-O 3.5Å; N530-L581 PolarHBondContact N-O 2.52Å; S579-L581 WeakPolarHBondContact OG-CG 3.32Å; L581-C583 VanDerWaalsContact C-N 3.27Å; L581-C583 PolarHBondContact O-N 2.65Å; L581-C583 PolarHBondContact O-SG 3.25Å; L581-K604 HydrophobicContact CD2-CB 3.89Å; L581-S606 CarbonylContact C-O 3.4Å; L581-S606 VanDerWaalsContact CA-O 3.31Å; L581-S606 WeakPolarHBondContact CA-O 3.49Å
582	D	89	Confident	91	Very high	37 Å²	37	33.8 Å²	33.8	20%	0.198	17%	0.172	C	C	.	.	S	Bend	trans	53.2	46.2	179.4	-63.8	-27.3	0	0	0	112.8	Y457 N530 M531 P584 S606 R635	Y457-D582 PolarHBondContact OH-OD2 3.25Å; N530-D582 WeakPolarHBondContact CA-O 3.14Å; M531-D582 PolarHBondContact N-O 3.33Å; D582-P584 WeakPolarHBondContact O-CD 3.38Å; D582-S606 PolarHBondContact N-O 3.42Å; D582-R635 IonicContact OD1-CZ 2.84Å; D582-R635 IonicContact OD1-NE 3.87Å; D582-R635 IonicContact OD1-NH2 3.79Å; D582-R635 PolarHBondContact OD1-NH2 2.72Å; D582-R635 IonicContact OD2-NH2 2.73Å; D582-R635 PolarHBondContact OD2-NH2 2.94Å
583	C	91.2	Very high	92.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.181	C	C	.	.			trans	-114.8	80.4	176.4	-60.5	0	0	0	0	108.8	M531 I534 F580 L581 K585 M586 G607	M531-C583 WeakPolarHBondContact O-CA 3.39Å; I534-C583 HydrophobicContact CD1-CB 4.44Å; I534-C583 HydrophobicContact CG1-CB 4.39Å; F580-C583 HydrophobicContact CB-CB 4.39Å; L581-C583 VanDerWaalsContact C-N 3.27Å; L581-C583 PolarHBondContact O-N 2.65Å; L581-C583 PolarHBondContact O-SG 3.25Å; C583-K585 VanDerWaalsContact C-N 3.3Å; C583-K585 PolarHBondContact O-N 3.07Å; C583-M586 HydrophobicContact CB-CB 3.99Å; C583-M586 HydrophobicContact CB-CE 4.28Å; C583-M586 WeakPolarHBondContact O-CB 3.43Å; C583-M586 PolarHBondContact O-N 2.67Å; C583-G607 CarbonylContact C-O 3.54Å; C583-G607 PolarHBondContact N-O 2.92Å
584	P	88.1	Confident	93.1	Very high	42 Å²	42	33 Å²	33	27%	0.273	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-26.2	-165.1	24.5	-35	0	0	0	114.3	D582 M586 E609 S610	D582-P584 WeakPolarHBondContact O-CD 3.38Å; P584-M586 VanDerWaalsContact C-N 3.32Å; P584-E609 HydrophobicContact CB-CG 4.45Å; P584-S610 WeakPolarHBondContact O-CB 3.1Å; P584-S610 PolarHBondContact O-N 3.07Å; P584-S610 PolarHBondContact O-OG 3.32Å
585	K	91.7	Very high	93.5	Very high	120 Å²	120	32.1 Å²	32.1	52%	0.522	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-12.2	175.1	-70.1	-170.2	-171.7	158.6	0	113.7	S532 I534 D535 C583 N587	S532-K585 WeakPolarHBondContact O-CD 3.47Å; S532-K585 WeakPolarHBondContact O-CE 3.44Å; S532-K585 PolarHBondContact O-NZ 2.92Å; S532-K585 VanDerWaalsContact O-NZ 3.09Å; I534-K585 CarbonylContact O-C 3.44Å; I534-K585 WeakPolarHBondContact O-CB 3.12Å; D535-K585 WeakPolarHBondContact CA-O 3.29Å; D535-K585 HydrophobicContact CB-CB 4.38Å; C583-K585 VanDerWaalsContact C-N 3.3Å; C583-K585 PolarHBondContact O-N 3.07Å; K585-N587 PolarHBondContact O-N 3.27Å
586	M	93.9	Very high	93.3	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.182	C	C	.	.			trans	-60	119.1	179.2	-170.2	64.8	63.2	0	0	110	I534 G536 F580 C583 P584 L590 C608 S610	I534-M586 HydrophobicContact CB-CE 4.48Å; I534-M586 HydrophobicContact CD1-CE 3.66Å; I534-M586 HydrophobicContact CG1-CE 3.81Å; G536-M586 WeakPolarHBondContact CA-SD 3.46Å; F580-M586 HydrophobicContact CB-CE 3.97Å; F580-M586 HydrophobicContact CD1-CE 3.34Å; F580-M586 HydrophobicContact CD2-CE 4.19Å; F580-M586 HydrophobicContact CE1-CE 3.8Å; F580-M586 HydrophobicContact CG-CE 3.57Å; F580-M586 HydrophobicContact CZ-CE 4.39Å; C583-M586 HydrophobicContact CB-CB 3.99Å; C583-M586 HydrophobicContact CB-CE 4.28Å; C583-M586 WeakPolarHBondContact O-CB 3.43Å; C583-M586 PolarHBondContact O-N 2.67Å; P584-M586 VanDerWaalsContact C-N 3.32Å; M586-L590 HydrophobicContact CG-CB 4.31Å; M586-L590 HydrophobicContact CG-CD2 3.56Å; M586-L590 HydrophobicContact SD-CB 3.65Å; M586-L590 HydrophobicContact SD-CD2 3.64Å; M586-L590 HydrophobicContact SD-CG 4.11Å; M586-C608 HydrophobicContact CB-CB 4.07Å; M586-C608 VanDerWaalsContact CB-SG 3.56Å; M586-C608 HydrophobicContact CG-CB 4.47Å; M586-S610 WeakPolarHBondContact O-CB 3.15Å
587	N	93.8	Very high	93.1	Very high	38 Å²	38	32.2 Å²	32.2	20%	0.203	17%	0.166	C	C	.	.			trans	-119.4	-174.6	-171.9	68.3	40.6	0	0	0	111.8	D535 K585 I589 L590	D535-N587 VanDerWaalsContact O-CG 3.29Å; D535-N587 PolarHBondContact O-N 3.27Å; D535-N587 PolarHBondContact O-ND2 2.9Å; D535-N587 PolarHBondContact O-OD1 2.94Å; K585-N587 PolarHBondContact O-N 3.27Å; N587-I589 PolarHBondContact O-N 2.95Å; N587-I589 VanDerWaalsContact O-N 3.1Å; N587-I589 WeakPolarHBondContact OD1-CB 3.44Å; N587-I589 WeakPolarHBondContact OD1-CD1 3.47Å; N587-I589 WeakPolarHBondContact OD1-CG1 3.27Å; N587-I589 PolarHBondContact OD1-N 2.83Å; N587-L590 PolarHBondContact O-N 2.92Å
588	D	96.8	Very high	92.7	Very high	30 Å²	30	33.1 Å²	33.1	16%	0.16	17%	0.174	C	C	.	.	H	α-helix	trans	-62.6	-18.1	-174.5	-61	-16	0	0	0	114.1	L590 L591 Q592 L611 T612 G615 L618	D588-L590 VanDerWaalsContact C-N 3.29Å; D588-L590 PolarHBondContact O-N 2.79Å; D588-L591 PolarHBondContact O-N 3.22Å; D588-L591 VanDerWaalsContact O-N 3.1Å; D588-Q592 PolarHBondContact O-N 3.03Å; D588-L611 WeakPolarHBondContact OD1-CA 3.39Å; D588-T612 PolarHBondContact OD1-N 3.16Å; D588-T612 PolarHBondContact OD2-OG1 3.14Å; D588-G615 VanDerWaalsContact OD1-CA 3.28Å; D588-G615 WeakPolarHBondContact OD1-CA 3.48Å; D588-G615 PolarHBondContact OD1-N 2.84Å; D588-G615 PolarHBondContact OD2-N 3.12Å; D588-L618 HydrophobicContact CB-CD1 4.34Å
589	I	94.3	Very high	92.5	Very high	63 Å²	63	37.4 Å²	37.4	32%	0.323	19%	0.193	S	C	.	.	H	α-helix	trans	-61.8	-37.7	179.2	-62.5	169.7	0	0	0	111	N587 L591 Q592 H593	N587-I589 PolarHBondContact O-N 2.95Å; N587-I589 VanDerWaalsContact O-N 3.1Å; N587-I589 WeakPolarHBondContact OD1-CB 3.44Å; N587-I589 WeakPolarHBondContact OD1-CD1 3.47Å; N587-I589 WeakPolarHBondContact OD1-CG1 3.27Å; N587-I589 PolarHBondContact OD1-N 2.83Å; I589-L591 VanDerWaalsContact C-N 3.26Å; I589-L591 PolarHBondContact O-N 2.89Å; I589-Q592 WeakPolarHBondContact O-CB 3.15Å; I589-Q592 PolarHBondContact O-N 3.38Å; I589-H593 WeakPolarHBondContact CG2-NE2 3.28Å; I589-H593 PolarHBondContact O-CD2 3.06Å; I589-H593 VanDerWaalsContact O-CD2 3.24Å; I589-H593 PolarHBondContact O-N 3.23Å; I589-H593 VanDerWaalsContact O-N 3.16Å
590	L	94	Very high	92.5	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-49	-52.2	171.9	153.6	70.2	0	0	0	110.4	L539 I578 F580 M586 N587 D588 Q592 H593 L594 L605	L539-L590 HydrophobicContact CD1-CB 4.34Å; L539-L590 HydrophobicContact CD1-CD1 3.12Å; L539-L590 HydrophobicContact CD1-CG 4.28Å; I578-L590 HydrophobicContact CD1-CD1 4.06Å; F580-L590 HydrophobicContact CD2-CD1 4.08Å; F580-L590 HydrophobicContact CD2-CD2 4.13Å; F580-L590 HydrophobicContact CE2-CD1 3.84Å; M586-L590 HydrophobicContact CG-CB 4.31Å; M586-L590 HydrophobicContact CG-CD2 3.56Å; M586-L590 HydrophobicContact SD-CB 3.65Å; M586-L590 HydrophobicContact SD-CD2 3.64Å; M586-L590 HydrophobicContact SD-CG 4.11Å; N587-L590 PolarHBondContact O-N 2.92Å; D588-L590 VanDerWaalsContact C-N 3.29Å; D588-L590 PolarHBondContact O-N 2.79Å; L590-Q592 VanDerWaalsContact C-N 3.31Å; L590-Q592 PolarHBondContact O-N 2.95Å; L590-H593 WeakPolarHBondContact O-CB 3.47Å; L590-H593 PolarHBondContact O-N 2.97Å; L590-H593 VanDerWaalsContact O-N 3.08Å; L590-L594 HydrophobicContact CD1-CD1 4.18Å; L590-L594 HydrophobicContact CD1-CD2 4.23Å; L590-L594 HydrophobicContact CD1-CG 4.23Å; L590-L594 WeakPolarHBondContact O-CG 3.28Å; L590-L594 PolarHBondContact O-N 3.28Å; L590-L605 HydrophobicContact CD2-CD1 4.15Å; L590-L605 HydrophobicContact CD2-CD2 3.42Å; L590-L605 VanDerWaalsContact CD2-CD2 3.42Å; L590-L605 HydrophobicContact CD2-CG 4.45Å
591	L	95.9	Very high	92.6	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-69.7	-31.6	-173.6	-65.3	174.4	0	0	0	111.5	D588 I589 H593 L594 I595 L605 L611 G615 L618 L619	D588-L591 PolarHBondContact O-N 3.22Å; D588-L591 VanDerWaalsContact O-N 3.1Å; I589-L591 VanDerWaalsContact C-N 3.26Å; I589-L591 PolarHBondContact O-N 2.89Å; L591-H593 VanDerWaalsContact C-N 3.28Å; L591-H593 PolarHBondContact O-N 3.2Å; L591-L594 HydrophobicContact CD2-CD1 3.97Å; L591-L594 PolarHBondContact O-N 3.32Å; L591-I595 PolarHBondContact O-N 3.14Å; L591-L605 HydrophobicContact CD1-CD1 4.42Å; L591-L605 HydrophobicContact CD2-CD1 3.77Å; L591-L605 HydrophobicContact CG-CD1 4.43Å; L591-L611 HydrophobicContact CD1-CD2 3.72Å; L591-L611 HydrophobicContact CG-CD2 4.35Å; L591-G615 WeakPolarHBondContact CD1-O 3.38Å; L591-L618 HydrophobicContact CB-CB 4.15Å; L591-L619 HydrophobicContact CD1-CB 4.17Å; L591-L619 HydrophobicContact CD2-CB 4.06Å; L591-L619 HydrophobicContact CD2-CD1 3.86Å; L591-L619 HydrophobicContact CD2-CG 4.35Å
592	Q	93.8	Very high	92.9	Very high	109 Å²	109	37 Å²	37	51%	0.509	19%	0.193	S	C	.	.	H	α-helix	trans	-58.6	-40.9	170.3	-170.3	178.9	4.1	0	0	112	D588 I589 L590 L594 L618	D588-Q592 PolarHBondContact O-N 3.03Å; I589-Q592 WeakPolarHBondContact O-CB 3.15Å; I589-Q592 PolarHBondContact O-N 3.38Å; L590-Q592 VanDerWaalsContact C-N 3.31Å; L590-Q592 PolarHBondContact O-N 2.95Å; Q592-L594 VanDerWaalsContact C-N 3.29Å; Q592-L594 PolarHBondContact O-N 2.77Å; Q592-L618 HydrophobicContact CB-CD1 4.15Å
593	H	91.5	Very high	93.3	Very high	43 Å²	43	35.3 Å²	35.3	20%	0.199	18%	0.184	C	C	.	.	H	α-helix	trans	-71.4	-22.5	179	-66.3	-45.2	0	0	0	113.5	L539 I542 I589 L590 L591 P596	L539-H593 HydrophobicContact CB-CB 4.22Å; I542-H593 HydrophobicContact CG2-CB 4.3Å; I589-H593 WeakPolarHBondContact CG2-NE2 3.28Å; I589-H593 PolarHBondContact O-CD2 3.06Å; I589-H593 VanDerWaalsContact O-CD2 3.24Å; I589-H593 PolarHBondContact O-N 3.23Å; I589-H593 VanDerWaalsContact O-N 3.16Å; L590-H593 WeakPolarHBondContact O-CB 3.47Å; L590-H593 PolarHBondContact O-N 2.97Å; L590-H593 VanDerWaalsContact O-N 3.08Å; L591-H593 VanDerWaalsContact C-N 3.28Å; L591-H593 PolarHBondContact O-N 3.2Å; H593-P596 WeakPolarHBondContact O-CD 3.41Å
594	L	92.8	Very high	93.6	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-80	-24.5	179.3	-54.9	-172.5	0	0	0	113.5	I542 I578 L590 L591 Q592 P596 L597 L600 Y624	I542-L594 HydrophobicContact CD1-CD2 4.06Å; I578-L594 HydrophobicContact CD1-CD1 4.13Å; I578-L594 HydrophobicContact CD1-CD2 3.47Å; I578-L594 VanDerWaalsContact CD1-CD2 3.47Å; I578-L594 HydrophobicContact CD1-CG 4.42Å; I578-L594 HydrophobicContact CG2-CD1 3.89Å; L590-L594 HydrophobicContact CD1-CD1 4.18Å; L590-L594 HydrophobicContact CD1-CD2 4.23Å; L590-L594 HydrophobicContact CD1-CG 4.23Å; L590-L594 WeakPolarHBondContact O-CG 3.28Å; L590-L594 PolarHBondContact O-N 3.28Å; L591-L594 HydrophobicContact CD2-CD1 3.97Å; L591-L594 PolarHBondContact O-N 3.32Å; Q592-L594 VanDerWaalsContact C-N 3.29Å; Q592-L594 PolarHBondContact O-N 2.77Å; L594-P596 VanDerWaalsContact C-N 3.27Å; L594-P596 WeakPolarHBondContact O-CD 3.44Å; L594-L597 HydrophobicContact CB-CD1 4.16Å; L594-L597 HydrophobicContact CD2-CD1 3.76Å; L594-L597 VanDerWaalsContact O-CB 3.25Å; L594-L597 WeakPolarHBondContact O-CB 3.21Å; L594-L597 VanDerWaalsContact O-CG 3.29Å; L594-L597 WeakPolarHBondContact O-CG 3.39Å; L594-L597 PolarHBondContact O-N 3.46Å; L594-L600 HydrophobicContact CD1-CD2 4.12Å; L594-Y624 HydrophobicContact CB-CE1 3.87Å; L594-Y624 VanDerWaalsContact O-CE1 3.28Å; L594-Y624 WeakPolarHBondContact O-CE1 3.4Å
595	I	92.1	Very high	94.1	Very high	49 Å²	49	35.2 Å²	35.2	25%	0.251	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-41.9	-44.9	-174.5	-69.3	172	0	0	0	114.3	L591 L597 L618 G622 A623	L591-I595 PolarHBondContact O-N 3.14Å; I595-L597 VanDerWaalsContact C-N 3.26Å; I595-L597 PolarHBondContact O-N 3.01Å; I595-L618 HydrophobicContact CD1-CB 4.33Å; I595-L618 HydrophobicContact CD1-CD2 3.89Å; I595-G622 WeakPolarHBondContact O-CA 3.07Å; I595-A623 PolarHBondContact O-N 3.11Å
596	P	88.8	Confident	94.2	Very high	68 Å²	68	29.6 Å²	29.6	44%	0.442	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-6	-175.9	-8.2	25	0	0	0	114.8	V543 H593 L594 P598	V543-P596 HydrophobicContact CG1-CB 4.37Å; V543-P596 HydrophobicContact CG2-CB 4.11Å; V543-P596 HydrophobicContact CG2-CG 4.24Å; H593-P596 WeakPolarHBondContact O-CD 3.41Å; L594-P596 VanDerWaalsContact C-N 3.27Å; L594-P596 WeakPolarHBondContact O-CD 3.44Å; P596-P598 WeakPolarHBondContact O-CD 3.35Å
597	L	90.1	Very high	94.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.156	C	C	.	.			trans	-75.3	125.7	-177.4	-59.9	175.2	0	0	0	110.8	I542 V543 S572 L575 L594 I595 Y624	I542-L597 HydrophobicContact CD1-CD1 4.4Å; V543-L597 HydrophobicContact CG2-CD2 3.58Å; V543-L597 HydrophobicContact CG2-CG 4.25Å; S572-L597 WeakPolarHBondContact O-CD2 3.23Å; L575-L597 HydrophobicContact CB-CD1 4.21Å; L575-L597 HydrophobicContact CB-CD2 4.5Å; L575-L597 HydrophobicContact CD2-CD1 3.67Å; L594-L597 HydrophobicContact CB-CD1 4.16Å; L594-L597 HydrophobicContact CD2-CD1 3.76Å; L594-L597 VanDerWaalsContact O-CB 3.25Å; L594-L597 WeakPolarHBondContact O-CB 3.21Å; L594-L597 VanDerWaalsContact O-CG 3.29Å; L594-L597 WeakPolarHBondContact O-CG 3.39Å; L594-L597 PolarHBondContact O-N 3.46Å; I595-L597 VanDerWaalsContact C-N 3.26Å; I595-L597 PolarHBondContact O-N 3.01Å; L597-Y624 HydrophobicContact CB-CD1 4.27Å; L597-Y624 WeakPolarHBondContact O-CB 3.28Å; L597-Y624 WeakPolarHBondContact O-CD1 3.46Å; L597-Y624 PolarHBondContact O-N 3.44Å
598	P	89.2	Confident	94.1	Very high	40 Å²	40	27.9 Å²	27.9	26%	0.26	15%	0.146	S	C	.	.	S	Bend	trans	-89.4	-20	-175.2	30.7	-34.2	0	0	0	114.7	L573 P596	L573-P598 WeakPolarHBondContact O-CD 3.34Å; P596-P598 WeakPolarHBondContact O-CD 3.35Å
599	H	92.1	Very high	93.9	Very high	90 Å²	90	31 Å²	31	42%	0.417	16%	0.16	S	C	.	.			trans	-115.3	7.7	-163.2	-61.7	-41.5	0	0	0	114.9	L573 L575 L576 T601	L573-H599 PolarHBondContact O-CD2 3.45Å; L573-H599 VanDerWaalsContact O-CD2 3.28Å; L575-H599 CarbonylContact O-C 3.6Å; L576-H599 HydrophobicContact CD2-CB 3.88Å; L576-H599 VanDerWaalsContact CD2-O 3.31Å; L576-H599 WeakPolarHBondContact CD2-O 3.41Å; H599-T601 PolarHBondContact O-N 2.75Å
600	L	95.6	Very high	93.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.156	C	C	.	.			trans	-64	130.4	-178.1	-158.6	65.5	0	0	0	110.7	L575 I578 L594 V603 Y624	L575-L600 HydrophobicContact CD2-CD1 4.13Å; L575-L600 HydrophobicContact CG-CD1 4.11Å; L575-L600 WeakPolarHBondContact O-CA 3.29Å; L575-L600 PolarHBondContact O-N 3.04Å; I578-L600 HydrophobicContact CB-CD1 4.31Å; I578-L600 HydrophobicContact CG2-CD1 4.1Å; I578-L600 HydrophobicContact CG2-CD2 4.16Å; L594-L600 HydrophobicContact CD1-CD2 4.12Å; L600-V603 HydrophobicContact CD2-CG2 3.33Å; L600-V603 HydrophobicContact CG-CG2 3.85Å; L600-Y624 HydrophobicContact CB-CD1 3.96Å; L600-Y624 HydrophobicContact CB-CD2 3.94Å; L600-Y624 HydrophobicContact CB-CG 3.55Å; L600-Y624 HydrophobicContact CD2-CD1 4.1Å; L600-Y624 HydrophobicContact CD2-CD2 4.01Å; L600-Y624 HydrophobicContact CD2-CE1 3.99Å; L600-Y624 HydrophobicContact CD2-CE2 3.9Å; L600-Y624 HydrophobicContact CD2-CG 4.12Å; L600-Y624 HydrophobicContact CG-CD2 4.48Å; L600-Y624 HydrophobicContact CG-CG 4.46Å
601	T	97.4	Very high	94	Very high	35 Å²	35	29.7 Å²	29.7	22%	0.215	16%	0.156	C	C	.	.			trans	-123.3	-23.9	-179	56.8	0	0	0	0	113	L576 H599 K629 E630	L576-T601 PolarHBondContact O-N 3Å; L576-T601 PolarHBondContact O-OG1 2.88Å; H599-T601 PolarHBondContact O-N 2.75Å; T601-K629 PolarHBondContact O-N 2.8Å; T601-E630 PolarHBondContact O-N 3.34Å
602	V	98.2	Very high	94.1	Very high	14 Å²	14	31.8 Å²	31.8	9%	0.085	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	124.1	-177.1	179.4	0	0	0	0	108.8	L576 E577 I578 K604 E630	L576-V602 PolarHBondContact O-N 3.23Å; L576-V602 VanDerWaalsContact O-N 3.1Å; E577-V602 WeakPolarHBondContact CA-O 3.39Å; E577-V602 HydrophobicContact CB-CB 4.02Å; E577-V602 HydrophobicContact CB-CG1 4.5Å; E577-V602 HydrophobicContact CG-CB 3.84Å; E577-V602 HydrophobicContact CG-CG1 3.77Å; I578-V602 PolarHBondContact N-O 2.93Å; V602-K604 HydrophobicContact CG1-CD 4.3Å; V602-K604 HydrophobicContact CG1-CG 3.89Å; V602-E630 WeakPolarHBondContact CA-O 3.45Å; V602-E630 HydrophobicContact CB-CB 4.48Å; V602-E630 HydrophobicContact CG1-CB 4.21Å; V602-E630 HydrophobicContact CG2-CB 4.15Å; V602-E630 HydrophobicContact CG2-CG 4.17Å
603	V	98.2	Very high	94.3	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	118.2	174.8	173	0	0	0	0	108.6	I578 L600 L605 L619 L628 E630 L631 Y632	I578-V603 HydrophobicContact CG2-CB 4.46Å; I578-V603 HydrophobicContact CG2-CG1 4.37Å; I578-V603 HydrophobicContact CG2-CG2 4Å; I578-V603 WeakPolarHBondContact O-CA 3.41Å; L600-V603 HydrophobicContact CD2-CG2 3.33Å; L600-V603 HydrophobicContact CG-CG2 3.85Å; V603-L605 HydrophobicContact CG1-CD1 3.6Å; V603-L605 HydrophobicContact CG1-CD2 4.49Å; V603-L605 HydrophobicContact CG1-CG 3.72Å; V603-L619 HydrophobicContact CG1-CD1 4.04Å; V603-L628 HydrophobicContact CB-CD1 4.26Å; V603-L628 HydrophobicContact CG2-CD1 3.67Å; V603-E630 PolarHBondContact N-O 3.16Å; V603-L631 HydrophobicContact CB-CD1 3.91Å; V603-L631 HydrophobicContact CG1-CD1 3.86Å; V603-L631 WeakPolarHBondContact O-CA 3.27Å; V603-Y632 PolarHBondContact O-N 3.24Å
604	K	97.8	Very high	94.6	Very high	41 Å²	41	30.5 Å²	30.5	18%	0.178	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	111.9	179.4	-45.6	-175.4	166.6	146.9	0	111	E577 I578 S579 F580 L581 V602 Y632	E577-K604 WeakPolarHBondContact OE1-CE 3.48Å; E577-K604 IonicContact OE1-NZ 3.75Å; E577-K604 PolarHBondContact OE1-NZ 3.38Å; I578-K604 PolarHBondContact O-N 3.03Å; S579-K604 CarbonylContact C-O 3.49Å; S579-K604 VanDerWaalsContact CA-O 3.29Å; S579-K604 WeakPolarHBondContact CA-O 3.45Å; F580-K604 PolarHBondContact N-O 3.23Å; L581-K604 HydrophobicContact CD2-CB 3.89Å; V602-K604 HydrophobicContact CG1-CD 4.3Å; V602-K604 HydrophobicContact CG1-CG 3.89Å; K604-Y632 HydrophobicContact CB-CD2 4.19Å; K604-Y632 HydrophobicContact CB-CG 4.3Å; K604-Y632 HydrophobicContact CD-CD2 4.19Å; K604-Y632 HydrophobicContact CD-CE2 4.19Å; K604-Y632 HydrophobicContact CG-CD2 3.55Å; K604-Y632 HydrophobicContact CG-CE2 3.95Å; K604-Y632 HydrophobicContact CG-CG 4.07Å
605	L	97.4	Very high	94.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.164	C	C	.	.			trans	-132	26.5	-174.9	-56.4	174.2	0	0	0	111.6	F580 L590 L591 V603 G607 C608 L611 Y632 L633 C636	F580-L605 HydrophobicContact CB-CD2 4Å; F580-L605 HydrophobicContact CD2-CD2 4.28Å; F580-L605 WeakPolarHBondContact O-CA 3.5Å; L590-L605 HydrophobicContact CD2-CD1 4.15Å; L590-L605 HydrophobicContact CD2-CD2 3.42Å; L590-L605 VanDerWaalsContact CD2-CD2 3.42Å; L590-L605 HydrophobicContact CD2-CG 4.45Å; L591-L605 HydrophobicContact CD1-CD1 4.42Å; L591-L605 HydrophobicContact CD2-CD1 3.77Å; L591-L605 HydrophobicContact CG-CD1 4.43Å; V603-L605 HydrophobicContact CG1-CD1 3.6Å; V603-L605 HydrophobicContact CG1-CD2 4.49Å; V603-L605 HydrophobicContact CG1-CG 3.72Å; L605-G607 PolarHBondContact O-N 3.14Å; L605-C608 HydrophobicContact CB-CB 4.33Å; L605-C608 VanDerWaalsContact O-CB 3.28Å; L605-C608 WeakPolarHBondContact O-CB 3.4Å; L605-C608 PolarHBondContact O-N 3.38Å; L605-C608 PolarHBondContact O-SG 3.02Å; L605-L611 HydrophobicContact CB-CD1 3.76Å; L605-L611 HydrophobicContact CD1-CD1 3.8Å; L605-L611 HydrophobicContact CG-CD1 4.34Å; L605-Y632 CarbonylContact C-O 3.55Å; L605-Y632 WeakPolarHBondContact CA-O 3.31Å; L605-Y632 PolarHBondContact N-O 3.34Å; L605-L633 HydrophobicContact CB-CD2 4.15Å; L605-L633 HydrophobicContact CD1-CD2 4.47Å; L605-C636 PolarHBondContact O-SG 2.76Å; L605-C636 VanDerWaalsContact O-SG 3.35Å
606	S	95.4	Very high	95.1	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.014	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	132.9	177.8	-58.5	0	0	0	0	110.6	L581 D582 C608 Y632 A634	L581-S606 CarbonylContact C-O 3.4Å; L581-S606 VanDerWaalsContact CA-O 3.31Å; L581-S606 WeakPolarHBondContact CA-O 3.49Å; D582-S606 PolarHBondContact N-O 3.42Å; S606-C608 VanDerWaalsContact C-N 3.35Å; S606-Y632 PolarHBondContact N-O 3.28Å; S606-Y632 WeakPolarHBondContact OG-CB 3.25Å; S606-A634 CarbonylContact C-O 3.52Å; S606-A634 WeakPolarHBondContact CA-O 3.46Å; S606-A634 PolarHBondContact OG-N 3.17Å
607	G	91.4	Very high	95.5	Very high	2 Å²	2	29.4 Å²	29.4	2%	0.021	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.6	13	-176	0	0	0	0	0	114.6	C583 L605 E609 A634	C583-G607 CarbonylContact C-O 3.54Å; C583-G607 PolarHBondContact N-O 2.92Å; L605-G607 PolarHBondContact O-N 3.14Å; G607-E609 PolarHBondContact O-N 3.33Å; G607-A634 PolarHBondContact N-O 3.25Å
608	C	93.9	Very high	95.8	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.158	C	C	.	.			trans	-87.6	74.6	168.9	-66.3	0	0	0	0	110.7	F580 M586 L605 S606 S610 L611	F580-C608 PolarHBondContact O-SG 2.86Å; M586-C608 HydrophobicContact CB-CB 4.07Å; M586-C608 VanDerWaalsContact CB-SG 3.56Å; M586-C608 HydrophobicContact CG-CB 4.47Å; L605-C608 HydrophobicContact CB-CB 4.33Å; L605-C608 VanDerWaalsContact O-CB 3.28Å; L605-C608 WeakPolarHBondContact O-CB 3.4Å; L605-C608 PolarHBondContact O-N 3.38Å; L605-C608 PolarHBondContact O-SG 3.02Å; S606-C608 VanDerWaalsContact C-N 3.35Å; C608-S610 PolarHBondContact O-N 3.12Å; C608-S610 VanDerWaalsContact O-N 3.08Å; C608-L611 HydrophobicContact CB-CD1 3.49Å; C608-L611 VanDerWaalsContact CB-CD1 3.49Å; C608-L611 HydrophobicContact CB-CG 3.82Å; C608-L611 WeakPolarHBondContact O-CB 3.33Å; C608-L611 PolarHBondContact O-N 3.1Å; C608-L611 VanDerWaalsContact O-N 3.14Å
609	E	92.3	Very high	96.2	Very high	94 Å²	94	28.9 Å²	28.9	44%	0.439	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-21.1	-174	-62.5	171	-158.2	0	0	114.4	P584 G607 K638	P584-E609 HydrophobicContact CB-CG 4.45Å; G607-E609 PolarHBondContact O-N 3.33Å; E609-K638 WeakPolarHBondContact O-CE 3.37Å
610	S	94.5	Very high	96.4	Very high	36 Å²	36	24.6 Å²	24.6	25%	0.252	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-8.3	-179.4	-64.2	0	0	0	0	114.4	P584 M586 C608	P584-S610 WeakPolarHBondContact O-CB 3.1Å; P584-S610 PolarHBondContact O-N 3.07Å; P584-S610 PolarHBondContact O-OG 3.32Å; M586-S610 WeakPolarHBondContact O-CB 3.15Å; C608-S610 PolarHBondContact O-N 3.12Å; C608-S610 VanDerWaalsContact O-N 3.08Å
611	L	96.2	Very high	96.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.145	C	C	.	.			trans	-68.1	136.1	177.2	-73.9	174.4	0	0	0	112.2	D588 L591 L605 C608 L633 K638	D588-L611 WeakPolarHBondContact OD1-CA 3.39Å; L591-L611 HydrophobicContact CD1-CD2 3.72Å; L591-L611 HydrophobicContact CG-CD2 4.35Å; L605-L611 HydrophobicContact CB-CD1 3.76Å; L605-L611 HydrophobicContact CD1-CD1 3.8Å; L605-L611 HydrophobicContact CG-CD1 4.34Å; C608-L611 HydrophobicContact CB-CD1 3.49Å; C608-L611 VanDerWaalsContact CB-CD1 3.49Å; C608-L611 HydrophobicContact CB-CG 3.82Å; C608-L611 WeakPolarHBondContact O-CB 3.33Å; C608-L611 PolarHBondContact O-N 3.1Å; C608-L611 VanDerWaalsContact O-N 3.14Å; L611-L633 HydrophobicContact CD1-CD2 4.41Å; L611-K638 WeakPolarHBondContact O-CB 3.49Å
612	T	97.3	Very high	96.2	Very high	44 Å²	44	26.6 Å²	26.6	27%	0.27	14%	0.136	S	C	.	.	B	Isolated β-bridge	trans	-118.7	174.1	179.2	82.4	0	0	0	0	112.3	D588 Q614 G615 I616 K638	D588-T612 PolarHBondContact OD1-N 3.16Å; D588-T612 PolarHBondContact OD2-OG1 3.14Å; T612-Q614 PolarHBondContact O-N 2.9Å; T612-Q614 VanDerWaalsContact O-N 3.15Å; T612-Q614 WeakPolarHBondContact OG1-CB 3.43Å; T612-Q614 PolarHBondContact OG1-N 3.1Å; T612-Q614 VanDerWaalsContact OG1-N 3.15Å; T612-G615 WeakPolarHBondContact O-CA 3.4Å; T612-G615 PolarHBondContact O-N 3.18Å; T612-I616 PolarHBondContact O-N 3.3Å; T612-K638 HydrophobicContact CG2-CB 4.47Å; T612-K638 HydrophobicContact CG2-CD 4.11Å
613	D	98.1	Very high	95.8	Very high	31 Å²	31	29.1 Å²	29.1	17%	0.166	16%	0.158	C	C	.	.	H	α-helix	trans	-55.4	-29.6	172.4	-60.7	-22	0	0	0	112.4	I616 K617 T640 K642 A643	D613-I616 PolarHBondContact O-N 3.46Å; D613-K617 PolarHBondContact O-N 3Å; D613-T640 PolarHBondContact OD1-N 3.17Å; D613-T640 PolarHBondContact OD2-OG1 2.96Å; D613-K642 HydrophobicContact CB-CB 4.44Å; D613-A643 HydrophobicContact CB-CB 4.41Å; D613-A643 VanDerWaalsContact OD1-CB 3.28Å; D613-A643 WeakPolarHBondContact OD1-CB 3.49Å
614	Q	97.7	Very high	95.5	Very high	95 Å²	95	29.1 Å²	29.1	44%	0.444	16%	0.158	S	C	.	.	H	α-helix	trans	-69.5	-36.8	175.9	-178.6	55.9	37.6	0	0	111.7	T612 K617 L618	T612-Q614 PolarHBondContact O-N 2.9Å; T612-Q614 VanDerWaalsContact O-N 3.15Å; T612-Q614 WeakPolarHBondContact OG1-CB 3.43Å; T612-Q614 PolarHBondContact OG1-N 3.1Å; T612-Q614 VanDerWaalsContact OG1-N 3.15Å; Q614-K617 WeakPolarHBondContact O-CB 3.22Å; Q614-K617 PolarHBondContact O-N 2.9Å; Q614-L618 WeakPolarHBondContact O-CG 3.3Å; Q614-L618 PolarHBondContact O-N 3.23Å
615	G	97	Very high	95.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-59.8	-45.9	170.3	0	0	0	0	0	111.9	D588 L591 T612 K617 L618 L619	D588-G615 VanDerWaalsContact OD1-CA 3.28Å; D588-G615 WeakPolarHBondContact OD1-CA 3.48Å; D588-G615 PolarHBondContact OD1-N 2.84Å; D588-G615 PolarHBondContact OD2-N 3.12Å; L591-G615 WeakPolarHBondContact CD1-O 3.38Å; T612-G615 WeakPolarHBondContact O-CA 3.4Å; T612-G615 PolarHBondContact O-N 3.18Å; G615-K617 VanDerWaalsContact C-N 3.31Å; G615-K617 PolarHBondContact O-N 2.89Å; G615-L618 WeakPolarHBondContact O-CB 3.44Å; G615-L618 PolarHBondContact O-N 3.11Å; G615-L618 VanDerWaalsContact O-N 3.09Å; G615-L619 PolarHBondContact O-N 3.46Å
616	I	97.8	Very high	95.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63	-38.2	177.1	-61	-55.3	0	0	0	111.8	T612 D613 L618 L619 T620 L633 L639 A643 M647	T612-I616 PolarHBondContact O-N 3.3Å; D613-I616 PolarHBondContact O-N 3.46Å; I616-L618 VanDerWaalsContact C-N 3.34Å; I616-L618 PolarHBondContact O-N 3.08Å; I616-L619 WeakPolarHBondContact O-CB 3.21Å; I616-L619 PolarHBondContact O-N 3.24Å; I616-T620 WeakPolarHBondContact O-CG2 3.14Å; I616-T620 PolarHBondContact O-N 3.05Å; I616-T620 PolarHBondContact O-OG1 3.18Å; I616-L633 HydrophobicContact CD1-CD1 3.7Å; I616-L633 HydrophobicContact CD1-CD2 3.94Å; I616-L639 HydrophobicContact CD1-CD1 4.36Å; I616-L639 HydrophobicContact CD1-CD2 4.29Å; I616-L639 HydrophobicContact CG1-CD1 4.33Å; I616-L639 HydrophobicContact CG1-CD2 3.59Å; I616-A643 HydrophobicContact CB-CB 3.98Å; I616-A643 HydrophobicContact CG1-CB 3.87Å; I616-A643 HydrophobicContact CG2-CB 3.98Å; I616-M647 HydrophobicContact CG2-CG 3.42Å; I616-M647 VanDerWaalsContact CG2-CG 3.42Å; I616-M647 HydrophobicContact CG2-SD 3.65Å
617	K	97.6	Very high	95.1	Very high	93 Å²	93	37.3 Å²	37.3	40%	0.404	20%	0.2	S	C	.	.	H	α-helix	trans	-56.3	-48.9	170.8	-175.1	-178	174.6	-176.8	0	111.5	D613 Q614 G615 L619 T620 D621 I646	D613-K617 PolarHBondContact O-N 3Å; Q614-K617 WeakPolarHBondContact O-CB 3.22Å; Q614-K617 PolarHBondContact O-N 2.9Å; G615-K617 VanDerWaalsContact C-N 3.31Å; G615-K617 PolarHBondContact O-N 2.89Å; K617-L619 VanDerWaalsContact C-N 3.3Å; K617-L619 PolarHBondContact O-N 3.05Å; K617-T620 PolarHBondContact O-N 3.24Å; K617-T620 VanDerWaalsContact O-N 3.12Å; K617-T620 PolarHBondContact O-OG1 3.15Å; K617-D621 PolarHBondContact O-N 3.15Å; K617-I646 HydrophobicContact CB-CD1 4.2Å
618	L	97.2	Very high	95.4	Very high	29 Å²	29	37.2 Å²	37.2	15%	0.152	20%	0.199	C	C	.	.	H	α-helix	trans	-59.4	-40.7	176.6	-65	166.8	0	0	0	111.9	D588 L591 Q592 I595 Q614 G615 I616 T620 D621 G622	D588-L618 HydrophobicContact CB-CD1 4.34Å; L591-L618 HydrophobicContact CB-CB 4.15Å; Q592-L618 HydrophobicContact CB-CD1 4.15Å; I595-L618 HydrophobicContact CD1-CB 4.33Å; I595-L618 HydrophobicContact CD1-CD2 3.89Å; Q614-L618 WeakPolarHBondContact O-CG 3.3Å; Q614-L618 PolarHBondContact O-N 3.23Å; G615-L618 WeakPolarHBondContact O-CB 3.44Å; G615-L618 PolarHBondContact O-N 3.11Å; G615-L618 VanDerWaalsContact O-N 3.09Å; I616-L618 VanDerWaalsContact C-N 3.34Å; I616-L618 PolarHBondContact O-N 3.08Å; L618-T620 VanDerWaalsContact C-N 3.32Å; L618-T620 PolarHBondContact O-N 3.49Å; L618-D621 PolarHBondContact O-N 2.62Å; L618-G622 PolarHBondContact O-N 3.33Å
619	L	96.9	Very high	95.6	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-42.9	175.2	179.6	154.3	0	0	0	111.8	L591 V603 G615 I616 K617 D621 G622 Y624 L628 L631 L651	L591-L619 HydrophobicContact CD1-CB 4.17Å; L591-L619 HydrophobicContact CD2-CB 4.06Å; L591-L619 HydrophobicContact CD2-CD1 3.86Å; L591-L619 HydrophobicContact CD2-CG 4.35Å; V603-L619 HydrophobicContact CG1-CD1 4.04Å; G615-L619 PolarHBondContact O-N 3.46Å; I616-L619 WeakPolarHBondContact O-CB 3.21Å; I616-L619 PolarHBondContact O-N 3.24Å; K617-L619 VanDerWaalsContact C-N 3.3Å; K617-L619 PolarHBondContact O-N 3.05Å; L619-D621 VanDerWaalsContact C-N 3.33Å; L619-G622 PolarHBondContact O-N 3.37Å; L619-Y624 WeakPolarHBondContact CA-OH 3.47Å; L619-Y624 HydrophobicContact CG-CE2 4.22Å; L619-Y624 WeakPolarHBondContact O-CE2 3.39Å; L619-Y624 PolarHBondContact O-OH 2.85Å; L619-L628 HydrophobicContact CD2-CD2 3.99Å; L619-L631 HydrophobicContact CD1-CD1 3.93Å; L619-L651 HydrophobicContact CD2-CD1 4Å; L619-L651 HydrophobicContact CD2-CD2 4.17Å
620	T	96.5	Very high	95.9	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-76.4	-17.8	179.1	60	0	0	0	0	114.5	I616 K617 L618 G622 A625 I646 M647 R650 L651	I616-T620 WeakPolarHBondContact O-CG2 3.14Å; I616-T620 PolarHBondContact O-N 3.05Å; I616-T620 PolarHBondContact O-OG1 3.18Å; K617-T620 PolarHBondContact O-N 3.24Å; K617-T620 VanDerWaalsContact O-N 3.12Å; K617-T620 PolarHBondContact O-OG1 3.15Å; L618-T620 VanDerWaalsContact C-N 3.32Å; L618-T620 PolarHBondContact O-N 3.49Å; T620-G622 VanDerWaalsContact C-N 3.28Å; T620-A625 VanDerWaalsContact O-CB 3.31Å; T620-A625 WeakPolarHBondContact O-CB 3.44Å; T620-I646 HydrophobicContact CG2-CG2 3.99Å; T620-I646 WeakPolarHBondContact OG1-CG2 3.49Å; T620-M647 HydrophobicContact CG2-CG 4.32Å; T620-R650 HydrophobicContact CG2-CB 4.1Å; T620-R650 PolarHBondContact O-NH2 3.44Å; T620-L651 HydrophobicContact CG2-CD1 4.31Å; T620-L651 HydrophobicContact CG2-CD2 4.14Å; T620-L651 HydrophobicContact CG2-CG 4.04Å
621	D	95.6	Very high	96.1	Very high	73 Å²	73	39.7 Å²	39.7	39%	0.39	21%	0.205	S	C	.	.	H	α-helix	trans	-81.6	-9.2	173.5	-73.5	-23.4	0	0	0	112.4	K617 L618 L619 R650	K617-D621 PolarHBondContact O-N 3.15Å; L618-D621 PolarHBondContact O-N 2.62Å; L619-D621 VanDerWaalsContact C-N 3.33Å; D621-R650 IonicContact OD1-NH1 3.9Å
622	G	92.9	Very high	96.2	Very high	4 Å²	4	41.7 Å²	41.7	4%	0.041	21%	0.212	C	C	.	.	S	Bend	trans	-65.7	148.5	176.9	0	0	0	0	0	113.9	I595 L618 L619 T620 Y624 A625	I595-G622 WeakPolarHBondContact O-CA 3.07Å; L618-G622 PolarHBondContact O-N 3.33Å; L619-G622 PolarHBondContact O-N 3.37Å; T620-G622 VanDerWaalsContact C-N 3.28Å; G622-Y624 PolarHBondContact O-N 3.07Å; G622-Y624 VanDerWaalsContact O-N 3.14Å; G622-A625 VanDerWaalsContact O-CB 3.28Å; G622-A625 WeakPolarHBondContact O-CB 3.38Å; G622-A625 PolarHBondContact O-N 3.09Å
623	A	89.5	Confident	96.2	Very high	66 Å²	66	39.6 Å²	39.6	55%	0.545	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-22.4	177.3	0	0	0	0	0	113.1	I595	I595-A623 PolarHBondContact O-N 3.11Å
624	Y	93.4	Very high	96.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-7.2	177	60.1	-99.2	0	0	0	114.5	L594 L597 L600 L619 G622 E626 N627 L628	L594-Y624 HydrophobicContact CB-CE1 3.87Å; L594-Y624 VanDerWaalsContact O-CE1 3.28Å; L594-Y624 WeakPolarHBondContact O-CE1 3.4Å; L597-Y624 HydrophobicContact CB-CD1 4.27Å; L597-Y624 WeakPolarHBondContact O-CB 3.28Å; L597-Y624 WeakPolarHBondContact O-CD1 3.46Å; L597-Y624 PolarHBondContact O-N 3.44Å; L600-Y624 HydrophobicContact CB-CD1 3.96Å; L600-Y624 HydrophobicContact CB-CD2 3.94Å; L600-Y624 HydrophobicContact CB-CG 3.55Å; L600-Y624 HydrophobicContact CD2-CD1 4.1Å; L600-Y624 HydrophobicContact CD2-CD2 4.01Å; L600-Y624 HydrophobicContact CD2-CE1 3.99Å; L600-Y624 HydrophobicContact CD2-CE2 3.9Å; L600-Y624 HydrophobicContact CD2-CG 4.12Å; L600-Y624 HydrophobicContact CG-CD2 4.48Å; L600-Y624 HydrophobicContact CG-CG 4.46Å; L619-Y624 WeakPolarHBondContact CA-OH 3.47Å; L619-Y624 HydrophobicContact CG-CE2 4.22Å; L619-Y624 WeakPolarHBondContact O-CE2 3.39Å; L619-Y624 PolarHBondContact O-OH 2.85Å; G622-Y624 PolarHBondContact O-N 3.07Å; G622-Y624 VanDerWaalsContact O-N 3.14Å; Y624-E626 PolarHBondContact O-N 2.88Å; Y624-E626 VanDerWaalsContact O-N 3.15Å; Y624-N627 CarbonylContact O-C 3.23Å; Y624-N627 WeakPolarHBondContact O-CA 3.45Å; Y624-N627 PolarHBondContact O-N 3.18Å; Y624-L628 HydrophobicContact CD2-CD1 4.36Å; Y624-L628 PolarHBondContact O-N 3.5Å
625	A	95.1	Very high	95.9	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.008	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-38.5	-171.3	0	0	0	0	0	112.9	T620 G622 N627 L651	T620-A625 VanDerWaalsContact O-CB 3.31Å; T620-A625 WeakPolarHBondContact O-CB 3.44Å; G622-A625 VanDerWaalsContact O-CB 3.28Å; G622-A625 WeakPolarHBondContact O-CB 3.38Å; G622-A625 PolarHBondContact O-N 3.09Å; A625-N627 VanDerWaalsContact C-N 3.29Å; A625-N627 PolarHBondContact O-N 3Å; A625-L651 HydrophobicContact CB-CD2 4.02Å; A625-L651 WeakPolarHBondContact O-CD2 3.43Å
626	E	92.1	Very high	95.8	Very high	137 Å²	137	35.9 Å²	35.9	64%	0.64	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-17.6	176	-65.2	-176.4	-174.4	0	0	113.2	Y624 N653	Y624-E626 PolarHBondContact O-N 2.88Å; Y624-E626 VanDerWaalsContact O-N 3.15Å; E626-N653 VanDerWaalsContact O-CB 3.27Å; E626-N653 WeakPolarHBondContact O-CB 3.5Å; E626-N653 VanDerWaalsContact O-CG 3.3Å; E626-N653 PolarHBondContact O-ND2 3.14Å
627	N	94.2	Very high	95.6	Very high	78 Å²	78	39.2 Å²	39.2	42%	0.417	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-8.1	-179.6	-67.9	-42.5	0	0	0	113.5	Y624 A625 K629	Y624-N627 CarbonylContact O-C 3.23Å; Y624-N627 WeakPolarHBondContact O-CA 3.45Å; Y624-N627 PolarHBondContact O-N 3.18Å; A625-N627 VanDerWaalsContact C-N 3.29Å; A625-N627 PolarHBondContact O-N 3Å; N627-K629 PolarHBondContact O-N 3.24Å
628	L	97.6	Very high	95.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.199	C	C	.	.			trans	-65.4	127.7	-176.9	-165	71.4	0	0	0	111	V603 L619 Y624 L631 L651 N653 L654	V603-L628 HydrophobicContact CB-CD1 4.26Å; V603-L628 HydrophobicContact CG2-CD1 3.67Å; L619-L628 HydrophobicContact CD2-CD2 3.99Å; Y624-L628 HydrophobicContact CD2-CD1 4.36Å; Y624-L628 PolarHBondContact O-N 3.5Å; L628-L631 HydrophobicContact CD2-CB 4.37Å; L628-L631 HydrophobicContact CD2-CD2 4.37Å; L628-L651 HydrophobicContact CB-CD2 4.38Å; L628-L651 HydrophobicContact CD2-CD1 4.09Å; L628-L651 HydrophobicContact CD2-CD2 3.99Å; L628-N653 CarbonylContact O-C 3.54Å; L628-N653 VanDerWaalsContact O-C 3.28Å; L628-L654 HydrophobicContact CD2-CD1 4.33Å; L628-L654 HydrophobicContact CG-CD1 4.3Å; L628-L654 PolarHBondContact O-N 3.25Å
629	K	98.1	Very high	95.6	Very high	116 Å²	116	38.4 Å²	38.4	50%	0.504	19%	0.192	S	C	.	.			trans	-112.7	-36.4	-176.1	-63.7	-177.4	-175.9	173.4	0	112.6	T601 N627 A655 Y656	T601-K629 PolarHBondContact O-N 2.8Å; N627-K629 PolarHBondContact O-N 3.24Å; K629-A655 HydrophobicContact CB-CB 4.47Å; K629-A655 WeakPolarHBondContact O-CA 3.24Å; K629-A655 WeakPolarHBondContact O-CB 3.36Å; K629-A655 PolarHBondContact O-N 3.38Å; K629-Y656 PolarHBondContact O-N 2.77Å
630	E	98.5	Very high	95.6	Very high	66 Å²	66	40.3 Å²	40.3	31%	0.308	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	129	-176.4	-49.3	-178.8	-174.7	0	0	110.5	T601 V602 V603 Y632 Y656	T601-E630 PolarHBondContact O-N 3.34Å; V602-E630 WeakPolarHBondContact CA-O 3.45Å; V602-E630 HydrophobicContact CB-CB 4.48Å; V602-E630 HydrophobicContact CG1-CB 4.21Å; V602-E630 HydrophobicContact CG2-CB 4.15Å; V602-E630 HydrophobicContact CG2-CG 4.17Å; V603-E630 PolarHBondContact N-O 3.16Å; E630-Y632 HydrophobicContact CB-CE2 3.85Å; E630-Y632 PolarHBondContact OE2-OH 2.95Å; E630-Y656 HydrophobicContact CB-CD1 4.43Å
631	L	98.5	Very high	95.6	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	122.4	-180	-179.2	56.5	0	0	0	110.2	V603 L619 L628 L633 M647 L651 L654 Y656 L657 S658	V603-L631 HydrophobicContact CB-CD1 3.91Å; V603-L631 HydrophobicContact CG1-CD1 3.86Å; V603-L631 WeakPolarHBondContact O-CA 3.27Å; L619-L631 HydrophobicContact CD1-CD1 3.93Å; L628-L631 HydrophobicContact CD2-CB 4.37Å; L628-L631 HydrophobicContact CD2-CD2 4.37Å; L631-L633 HydrophobicContact CD1-CD1 4.12Å; L631-L633 HydrophobicContact CD1-CD2 4.18Å; L631-L633 HydrophobicContact CD1-CG 3.9Å; L631-L633 HydrophobicContact CD2-CD1 3.81Å; L631-L633 HydrophobicContact CD2-CG 4.44Å; L631-L633 HydrophobicContact CG-CD1 3.83Å; L631-L633 HydrophobicContact CG-CG 3.91Å; L631-M647 HydrophobicContact CD2-CE 3.48Å; L631-M647 VanDerWaalsContact CD2-CE 3.48Å; L631-M647 HydrophobicContact CD2-SD 4.23Å; L631-L651 HydrophobicContact CD2-CD1 3.77Å; L631-L654 HydrophobicContact CB-CD1 3.76Å; L631-L654 HydrophobicContact CB-CD2 4.38Å; L631-Y656 PolarHBondContact N-O 3.06Å; L631-L657 HydrophobicContact CB-CD1 4.22Å; L631-L657 HydrophobicContact CD2-CD1 4.34Å; L631-L657 HydrophobicContact CG-CD1 4.25Å; L631-L657 WeakPolarHBondContact O-CA 3.44Å; L631-S658 PolarHBondContact O-N 3.27Å
632	Y	98.2	Very high	95.7	Very high	42 Å²	42	45.9 Å²	45.9	17%	0.165	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	117.1	179.2	-56.4	-118.8	0	0	0	108.8	V603 K604 L605 S606 E630 Y656	V603-Y632 PolarHBondContact O-N 3.24Å; K604-Y632 HydrophobicContact CB-CD2 4.19Å; K604-Y632 HydrophobicContact CB-CG 4.3Å; K604-Y632 HydrophobicContact CD-CD2 4.19Å; K604-Y632 HydrophobicContact CD-CE2 4.19Å; K604-Y632 HydrophobicContact CG-CD2 3.55Å; K604-Y632 HydrophobicContact CG-CE2 3.95Å; K604-Y632 HydrophobicContact CG-CG 4.07Å; L605-Y632 CarbonylContact C-O 3.55Å; L605-Y632 WeakPolarHBondContact CA-O 3.31Å; L605-Y632 PolarHBondContact N-O 3.34Å; S606-Y632 PolarHBondContact N-O 3.28Å; S606-Y632 WeakPolarHBondContact OG-CB 3.25Å; E630-Y632 HydrophobicContact CB-CE2 3.85Å; E630-Y632 PolarHBondContact OE2-OH 2.95Å; Y632-Y656 HydrophobicContact CD1-CD1 4.36Å; Y632-Y656 AromaticContact CD1-CE1 3.45Å; Y632-Y656 HydrophobicContact CD1-CE1 3.45Å; Y632-Y656 VanDerWaalsContact CD1-CE1 3.45Å; Y632-Y656 HydrophobicContact CD2-CD1 4.07Å; Y632-Y656 AromaticContact CD2-CE1 3.94Å; Y632-Y656 HydrophobicContact CD2-CE1 3.94Å; Y632-Y656 AromaticContact CE1-CD1 3.95Å; Y632-Y656 HydrophobicContact CE1-CD1 3.95Å; Y632-Y656 AromaticContact CE1-CE1 3.12Å; Y632-Y656 HydrophobicContact CE1-CE1 3.12Å; Y632-Y656 HydrophobicContact CE1-CE2 4.43Å; Y632-Y656 AromaticContact CE1-CZ 3.41Å; Y632-Y656 VanDerWaalsContact CE1-CZ 3.41Å; Y632-Y656 WeakPolarHBondContact CE1-OH 3.19Å; Y632-Y656 AromaticContact CE2-CD1 3.65Å; Y632-Y656 HydrophobicContact CE2-CD1 3.65Å; Y632-Y656 AromaticContact CE2-CE1 3.68Å; Y632-Y656 HydrophobicContact CE2-CE1 3.68Å; Y632-Y656 HydrophobicContact CG-CD1 4.41Å; Y632-Y656 AromaticContact CG-CE1 3.83Å; Y632-Y656 HydrophobicContact CG-CE1 3.83Å; Y632-Y656 AromaticContact CZ-CD1 3.55Å; Y632-Y656 AromaticContact CZ-CE1 3.23Å; Y632-Y656 AromaticContact CZ-CZ 3.74Å
633	L	97.6	Very high	95.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.225	C	C	.	.			trans	-134.2	28.7	-176.7	-67	171.8	0	0	0	110.4	L605 L611 I616 L631 C636 L639 M647 S658 L659 C662	L605-L633 HydrophobicContact CB-CD2 4.15Å; L605-L633 HydrophobicContact CD1-CD2 4.47Å; L611-L633 HydrophobicContact CD1-CD2 4.41Å; I616-L633 HydrophobicContact CD1-CD1 3.7Å; I616-L633 HydrophobicContact CD1-CD2 3.94Å; L631-L633 HydrophobicContact CD1-CD1 4.12Å; L631-L633 HydrophobicContact CD1-CD2 4.18Å; L631-L633 HydrophobicContact CD1-CG 3.9Å; L631-L633 HydrophobicContact CD2-CD1 3.81Å; L631-L633 HydrophobicContact CD2-CG 4.44Å; L631-L633 HydrophobicContact CG-CD1 3.83Å; L631-L633 HydrophobicContact CG-CG 3.91Å; L633-C636 WeakPolarHBondContact O-CB 3.35Å; L633-C636 PolarHBondContact O-N 3.5Å; L633-C636 PolarHBondContact O-SG 3.36Å; L633-C636 VanDerWaalsContact O-SG 3.34Å; L633-L639 HydrophobicContact CB-CD1 4.1Å; L633-L639 HydrophobicContact CD1-CD1 4.02Å; L633-L639 HydrophobicContact CD2-CD1 4.36Å; L633-L639 HydrophobicContact CG-CD1 4.4Å; L633-M647 HydrophobicContact CD1-CE 4.29Å; L633-M647 HydrophobicContact CD1-SD 4.11Å; L633-S658 CarbonylContact C-O 3.6Å; L633-S658 WeakPolarHBondContact CA-O 3.45Å; L633-S658 PolarHBondContact N-O 3.49Å; L633-L659 HydrophobicContact CB-CD2 3.97Å; L633-L659 HydrophobicContact CD1-CD2 4.18Å; L633-C662 PolarHBondContact O-SG 3.3Å
634	A	95.4	Very high	96.3	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	145.3	178.2	0	0	0	0	0	110.5	S606 G607 C636 A660 A854	S606-A634 CarbonylContact C-O 3.52Å; S606-A634 WeakPolarHBondContact CA-O 3.46Å; S606-A634 PolarHBondContact OG-N 3.17Å; G607-A634 PolarHBondContact N-O 3.25Å; A634-C636 PolarHBondContact O-N 3.17Å; A634-A660 CarbonylContact C-O 3.47Å; A634-A660 WeakPolarHBondContact CA-O 3.21Å; A634-A660 HydrophobicContact CB-CB 3.93Å; A634-A660 WeakPolarHBondContact CB-O 3.2Å; A634-A854 HydrophobicContact CB-CB 4.29Å
635	R	94.7	Very high	96.5	Very high	48 Å²	48	47.3 Å²	47.3	18%	0.181	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	37.7	-177.6	-54.6	-175.4	-67.3	-135.4	-2.8	113.5	D582 A660	D582-R635 IonicContact OD1-CZ 2.84Å; D582-R635 IonicContact OD1-NE 3.87Å; D582-R635 IonicContact OD1-NH2 3.79Å; D582-R635 PolarHBondContact OD1-NH2 2.72Å; D582-R635 IonicContact OD2-NH2 2.73Å; D582-R635 PolarHBondContact OD2-NH2 2.94Å; R635-A660 PolarHBondContact N-O 3.44Å
636	C	95.5	Very high	96.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.231	C	C	.	.			trans	-98.6	84	169.8	-67.1	0	0	0	0	108.8	L605 L633 A634 K638 L639	L605-C636 PolarHBondContact O-SG 2.76Å; L605-C636 VanDerWaalsContact O-SG 3.35Å; L633-C636 WeakPolarHBondContact O-CB 3.35Å; L633-C636 PolarHBondContact O-N 3.5Å; L633-C636 PolarHBondContact O-SG 3.36Å; L633-C636 VanDerWaalsContact O-SG 3.34Å; A634-C636 PolarHBondContact O-N 3.17Å; C636-K638 VanDerWaalsContact C-N 3.27Å; C636-K638 PolarHBondContact O-N 2.94Å; C636-K638 VanDerWaalsContact O-N 3.15Å; C636-L639 HydrophobicContact CB-CD1 3.46Å; C636-L639 VanDerWaalsContact CB-CD1 3.46Å; C636-L639 HydrophobicContact CB-CG 3.7Å; C636-L639 PolarHBondContact O-N 2.92Å
637	D	92.4	Very high	96.8	Very high	69 Å²	69	42.9 Å²	42.9	37%	0.369	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-19.8	-160.2	-66.8	-8.1	0	0	0	115.5	L664	D637-L664 VanDerWaalsContact O-CD1 3.25Å; D637-L664 WeakPolarHBondContact O-CD1 3.41Å
638	K	96.5	Very high	96.9	Very high	105 Å²	105	39.3 Å²	39.3	46%	0.457	18%	0.182	S	C	.	.	B	Isolated β-bridge	trans	-94.2	-0.9	-179.4	-56	176.1	-173.7	174.9	0	113.7	E609 L611 T612 C636	E609-K638 WeakPolarHBondContact O-CE 3.37Å; L611-K638 WeakPolarHBondContact O-CB 3.49Å; T612-K638 HydrophobicContact CG2-CB 4.47Å; T612-K638 HydrophobicContact CG2-CD 4.11Å; C636-K638 VanDerWaalsContact C-N 3.27Å; C636-K638 PolarHBondContact O-N 2.94Å; C636-K638 VanDerWaalsContact O-N 3.15Å
639	L	97.5	Very high	96.7	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.205	C	C	.	.			trans	-77	130	178.6	-62.2	-174	0	0	0	111.3	I616 L633 C636 A643 L664 I665	I616-L639 HydrophobicContact CD1-CD1 4.36Å; I616-L639 HydrophobicContact CD1-CD2 4.29Å; I616-L639 HydrophobicContact CG1-CD1 4.33Å; I616-L639 HydrophobicContact CG1-CD2 3.59Å; L633-L639 HydrophobicContact CB-CD1 4.1Å; L633-L639 HydrophobicContact CD1-CD1 4.02Å; L633-L639 HydrophobicContact CD2-CD1 4.36Å; L633-L639 HydrophobicContact CG-CD1 4.4Å; C636-L639 HydrophobicContact CB-CD1 3.46Å; C636-L639 VanDerWaalsContact CB-CD1 3.46Å; C636-L639 HydrophobicContact CB-CG 3.7Å; C636-L639 PolarHBondContact O-N 2.92Å; L639-A643 HydrophobicContact CB-CB 4.48Å; L639-A643 HydrophobicContact CD2-CB 4.24Å; L639-L664 WeakPolarHBondContact O-CB 3.41Å; L639-I665 HydrophobicContact CB-CD1 4.42Å; L639-I665 WeakPolarHBondContact O-CG1 3.48Å
640	T	97.6	Very high	96.6	Very high	40 Å²	40	42.5 Å²	42.5	25%	0.245	20%	0.2	C	C	.	.			trans	-114.9	-178.5	178.3	80.8	0	0	0	0	111.5	D613 K642 A643 L664	D613-T640 PolarHBondContact OD1-N 3.17Å; D613-T640 PolarHBondContact OD2-OG1 2.96Å; T640-K642 PolarHBondContact O-N 3.45Å; T640-K642 PolarHBondContact OG1-N 3.46Å; T640-A643 WeakPolarHBondContact O-CB 3.31Å; T640-A643 PolarHBondContact O-N 3.29Å; T640-L664 HydrophobicContact CG2-CB 4.19Å; T640-L664 HydrophobicContact CG2-CD1 4.2Å
641	D	97.8	Very high	96.5	Very high	44 Å²	44	39.4 Å²	39.4	24%	0.235	19%	0.185	C	C	.	.	H	α-helix	trans	-56.7	-24.5	176.6	-65.6	-5.2	0	0	0	113.6	A643 I644 H645 I665 S666 A669	D641-A643 PolarHBondContact O-N 3.44Å; D641-I644 PolarHBondContact O-N 3.11Å; D641-H645 PolarHBondContact O-N 3.49Å; D641-I665 WeakPolarHBondContact OD1-CA 3.24Å; D641-S666 PolarHBondContact OD1-N 3.17Å; D641-S666 WeakPolarHBondContact OD2-CB 3.32Å; D641-S666 PolarHBondContact OD2-OG 2.92Å; D641-A669 HydrophobicContact CB-CB 3.89Å; D641-A669 VanDerWaalsContact OD1-CB 3.23Å; D641-A669 WeakPolarHBondContact OD1-CB 3.27Å
642	K	97.5	Very high	96.3	Very high	147 Å²	147	44 Å²	44	64%	0.639	21%	0.209	S	C	*	.	H	α-helix	trans	-63.1	-41.1	176.1	-66.4	179.2	179.9	175.7	0	112.2	D613 T640 I644 H645 I646	D613-K642 HydrophobicContact CB-CB 4.44Å; T640-K642 PolarHBondContact O-N 3.45Å; T640-K642 PolarHBondContact OG1-N 3.46Å; K642-I644 VanDerWaalsContact C-N 3.3Å; K642-I644 PolarHBondContact O-N 3.33Å; K642-H645 PolarHBondContact O-N 3.09Å; K642-I646 WeakPolarHBondContact O-CD1 3.3Å; K642-I646 VanDerWaalsContact O-CG1 3.28Å; K642-I646 WeakPolarHBondContact O-CG1 3.49Å; K642-I646 PolarHBondContact O-N 3.45Å; K642-I646 VanDerWaalsContact O-N 3.09Å
643	A	97.4	Very high	96.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-57.9	-46.3	175.1	0	0	0	0	0	110.9	D613 I616 L639 T640 D641 H645 I646 M647	D613-A643 HydrophobicContact CB-CB 4.41Å; D613-A643 VanDerWaalsContact OD1-CB 3.28Å; D613-A643 WeakPolarHBondContact OD1-CB 3.49Å; I616-A643 HydrophobicContact CB-CB 3.98Å; I616-A643 HydrophobicContact CG1-CB 3.87Å; I616-A643 HydrophobicContact CG2-CB 3.98Å; L639-A643 HydrophobicContact CB-CB 4.48Å; L639-A643 HydrophobicContact CD2-CB 4.24Å; T640-A643 WeakPolarHBondContact O-CB 3.31Å; T640-A643 PolarHBondContact O-N 3.29Å; D641-A643 PolarHBondContact O-N 3.44Å; A643-H645 PolarHBondContact O-N 3.13Å; A643-I646 PolarHBondContact O-N 2.82Å; A643-M647 WeakPolarHBondContact O-CG 3.43Å; A643-M647 PolarHBondContact O-N 3.29Å
644	I	97.5	Very high	96.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-68.5	-37	-177.4	-53.4	-47.8	0	0	0	111.7	D641 K642 M647 S648 L659 I665 A669 L673	D641-I644 PolarHBondContact O-N 3.11Å; K642-I644 VanDerWaalsContact C-N 3.3Å; K642-I644 PolarHBondContact O-N 3.33Å; I644-M647 HydrophobicContact CD1-CE 4.22Å; I644-M647 HydrophobicContact CD1-SD 3.84Å; I644-M647 PolarHBondContact O-N 2.8Å; I644-S648 WeakPolarHBondContact O-CB 3.48Å; I644-S648 PolarHBondContact O-N 3.42Å; I644-L659 HydrophobicContact CD1-CD1 3.53Å; I644-L659 HydrophobicContact CD1-CD2 3.76Å; I644-L659 HydrophobicContact CD1-CG 4.3Å; I644-L659 HydrophobicContact CG1-CD1 4.24Å; I644-I665 HydrophobicContact CD1-CD1 4.05Å; I644-I665 HydrophobicContact CG1-CD1 4.06Å; I644-I665 HydrophobicContact CG1-CG2 4.15Å; I644-A669 HydrophobicContact CB-CB 3.68Å; I644-A669 HydrophobicContact CG1-CB 3.85Å; I644-A669 HydrophobicContact CG2-CB 3.87Å; I644-A669 WeakPolarHBondContact CG2-O 3.37Å; I644-L673 HydrophobicContact CG2-CD2 3.51Å; I644-L673 HydrophobicContact CG2-CG 3.9Å
645	H	97.4	Very high	96.4	Very high	101 Å²	101	45.6 Å²	45.6	47%	0.468	22%	0.224	S	C	.	.	H	α-helix	trans	-60.7	-44.6	173.1	-179.8	71.9	0	0	0	112.7	D641 K642 A643 M647 S648 V649 L672	D641-H645 PolarHBondContact O-N 3.49Å; K642-H645 PolarHBondContact O-N 3.09Å; A643-H645 PolarHBondContact O-N 3.13Å; H645-M647 VanDerWaalsContact C-N 3.32Å; H645-M647 PolarHBondContact O-N 2.57Å; H645-S648 PolarHBondContact O-N 2.85Å; H645-S648 PolarHBondContact O-OG 2.91Å; H645-S648 VanDerWaalsContact O-OG 3.04Å; H645-V649 WeakPolarHBondContact O-CG2 3.28Å; H645-V649 PolarHBondContact O-N 2.91Å; H645-L672 HydrophobicContact CB-CD1 3.68Å
646	I	95.9	Very high	96.6	Very high	45 Å²	45	44.1 Å²	44.1	23%	0.231	22%	0.218	C	C	.	.	H	α-helix	trans	-65	-41.5	177.8	-62.4	162.5	0	0	0	110.2	K617 T620 K642 A643 V649 R650	K617-I646 HydrophobicContact CB-CD1 4.2Å; T620-I646 HydrophobicContact CG2-CG2 3.99Å; T620-I646 WeakPolarHBondContact OG1-CG2 3.49Å; K642-I646 WeakPolarHBondContact O-CD1 3.3Å; K642-I646 VanDerWaalsContact O-CG1 3.28Å; K642-I646 WeakPolarHBondContact O-CG1 3.49Å; K642-I646 PolarHBondContact O-N 3.45Å; K642-I646 VanDerWaalsContact O-N 3.09Å; A643-I646 PolarHBondContact O-N 2.82Å; I646-V649 PolarHBondContact O-N 3.45Å; I646-R650 PolarHBondContact O-N 3.32Å
647	M	97	Very high	96.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-62.7	-44.5	176.7	-71.1	168.2	52.3	0	0	112.6	I616 T620 L631 L633 A643 I644 H645 V649 R650 L651 L657	I616-M647 HydrophobicContact CG2-CG 3.42Å; I616-M647 VanDerWaalsContact CG2-CG 3.42Å; I616-M647 HydrophobicContact CG2-SD 3.65Å; T620-M647 HydrophobicContact CG2-CG 4.32Å; L631-M647 HydrophobicContact CD2-CE 3.48Å; L631-M647 VanDerWaalsContact CD2-CE 3.48Å; L631-M647 HydrophobicContact CD2-SD 4.23Å; L633-M647 HydrophobicContact CD1-CE 4.29Å; L633-M647 HydrophobicContact CD1-SD 4.11Å; A643-M647 WeakPolarHBondContact O-CG 3.43Å; A643-M647 PolarHBondContact O-N 3.29Å; I644-M647 HydrophobicContact CD1-CE 4.22Å; I644-M647 HydrophobicContact CD1-SD 3.84Å; I644-M647 PolarHBondContact O-N 2.8Å; H645-M647 VanDerWaalsContact C-N 3.32Å; H645-M647 PolarHBondContact O-N 2.57Å; M647-V649 PolarHBondContact O-N 2.85Å; M647-R650 PolarHBondContact O-N 3.18Å; M647-L651 HydrophobicContact CB-CD1 3.96Å; M647-L651 HydrophobicContact CB-CG 4.43Å; M647-L651 HydrophobicContact CE-CD1 4.25Å; M647-L651 HydrophobicContact CG-CD1 3.78Å; M647-L651 WeakPolarHBondContact O-CB 3.33Å; M647-L651 PolarHBondContact O-N 3.18Å; M647-L657 HydrophobicContact CE-CD1 3.76Å; M647-L657 HydrophobicContact CE-CD2 4.23Å
648	S	95.7	Very high	96.9	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.014	20%	0.201	C	C	.	.	H	α-helix	trans	-62.8	-27.7	-176.1	74.7	0	0	0	0	112.4	I644 H645 L652	I644-S648 WeakPolarHBondContact O-CB 3.48Å; I644-S648 PolarHBondContact O-N 3.42Å; H645-S648 PolarHBondContact O-N 2.85Å; H645-S648 PolarHBondContact O-OG 2.91Å; H645-S648 VanDerWaalsContact O-OG 3.04Å; S648-L652 WeakPolarHBondContact O-CD2 3.25Å
649	V	94.6	Very high	97	Very high	82 Å²	82	35.9 Å²	35.9	50%	0.497	18%	0.179	S	C	.	.	H	α-helix	trans	-81.7	-35	178	177.3	0	0	0	0	112.4	H645 I646 M647	H645-V649 WeakPolarHBondContact O-CG2 3.28Å; H645-V649 PolarHBondContact O-N 2.91Å; I646-V649 PolarHBondContact O-N 3.45Å; M647-V649 PolarHBondContact O-N 2.85Å
650	R	94.8	Very high	96.9	Very high	102 Å²	102	36 Å²	36	39%	0.385	18%	0.181	S	C	.	.	H	α-helix	trans	-106.4	-32.9	-169.1	-63.8	-61.8	-64.2	-85.5	-3.7	114.8	T620 D621 I646 M647 L652	T620-R650 HydrophobicContact CG2-CB 4.1Å; T620-R650 PolarHBondContact O-NH2 3.44Å; D621-R650 IonicContact OD1-NH1 3.9Å; I646-R650 PolarHBondContact O-N 3.32Å; M647-R650 PolarHBondContact O-N 3.18Å; R650-L652 VanDerWaalsContact C-N 3.31Å; R650-L652 PolarHBondContact O-N 2.86Å
651	L	96.6	Very high	96.8	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.178	C	C	.	.			trans	-93.6	49.7	-173.1	-55.6	-178.1	0	0	0	112.2	L619 T620 A625 L628 L631 M647 N653 L654 L676	L619-L651 HydrophobicContact CD2-CD1 4Å; L619-L651 HydrophobicContact CD2-CD2 4.17Å; T620-L651 HydrophobicContact CG2-CD1 4.31Å; T620-L651 HydrophobicContact CG2-CD2 4.14Å; T620-L651 HydrophobicContact CG2-CG 4.04Å; A625-L651 HydrophobicContact CB-CD2 4.02Å; A625-L651 WeakPolarHBondContact O-CD2 3.43Å; L628-L651 HydrophobicContact CB-CD2 4.38Å; L628-L651 HydrophobicContact CD2-CD1 4.09Å; L628-L651 HydrophobicContact CD2-CD2 3.99Å; L631-L651 HydrophobicContact CD2-CD1 3.77Å; M647-L651 HydrophobicContact CB-CD1 3.96Å; M647-L651 HydrophobicContact CB-CG 4.43Å; M647-L651 HydrophobicContact CE-CD1 4.25Å; M647-L651 HydrophobicContact CG-CD1 3.78Å; M647-L651 WeakPolarHBondContact O-CB 3.33Å; M647-L651 PolarHBondContact O-N 3.18Å; L651-N653 PolarHBondContact O-N 2.73Å; L651-L654 HydrophobicContact CB-CB 4.37Å; L651-L654 VanDerWaalsContact O-CB 3.27Å; L651-L654 WeakPolarHBondContact O-CB 3.43Å; L651-L654 PolarHBondContact O-N 3.2Å; L651-L654 VanDerWaalsContact O-N 3.08Å; L651-L676 WeakPolarHBondContact O-CD2 3.45Å
652	L	95.4	Very high	96.7	Very high	97 Å²	97	33.4 Å²	33.4	51%	0.508	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-15.2	-171.6	-57.2	179.3	0	0	0	114.3	S648 R650 L676	S648-L652 WeakPolarHBondContact O-CD2 3.25Å; R650-L652 VanDerWaalsContact C-N 3.31Å; R650-L652 PolarHBondContact O-N 2.86Å; L652-L676 HydrophobicContact CD2-CD2 4.42Å
653	N	96.7	Very high	96.5	Very high	53 Å²	53	29 Å²	29	28%	0.283	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	5.5	179	-74.2	-23.7	0	0	0	114.6	E626 L628 L651 A655 K678	E626-N653 VanDerWaalsContact O-CB 3.27Å; E626-N653 WeakPolarHBondContact O-CB 3.5Å; E626-N653 VanDerWaalsContact O-CG 3.3Å; E626-N653 PolarHBondContact O-ND2 3.14Å; L628-N653 CarbonylContact O-C 3.54Å; L628-N653 VanDerWaalsContact O-C 3.28Å; L651-N653 PolarHBondContact O-N 2.73Å; N653-A655 PolarHBondContact O-N 3.5Å; N653-K678 WeakPolarHBondContact OD1-CD 3.47Å; N653-K678 WeakPolarHBondContact OD1-CE 3.45Å; N653-K678 PolarHBondContact OD1-NZ 3.42Å
654	L	98	Very high	96.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.176	C	C	.	.			trans	-63.1	129	179.5	-157.9	69.9	0	0	0	111.1	L628 L631 L651 L657 L676 K678 L679	L628-L654 HydrophobicContact CD2-CD1 4.33Å; L628-L654 HydrophobicContact CG-CD1 4.3Å; L628-L654 PolarHBondContact O-N 3.25Å; L631-L654 HydrophobicContact CB-CD1 3.76Å; L631-L654 HydrophobicContact CB-CD2 4.38Å; L651-L654 HydrophobicContact CB-CB 4.37Å; L651-L654 VanDerWaalsContact O-CB 3.27Å; L651-L654 WeakPolarHBondContact O-CB 3.43Å; L651-L654 PolarHBondContact O-N 3.2Å; L651-L654 VanDerWaalsContact O-N 3.08Å; L654-L657 HydrophobicContact CD2-CB 3.88Å; L654-L657 HydrophobicContact CD2-CD1 4.13Å; L654-L657 HydrophobicContact CD2-CD2 4.25Å; L654-L657 HydrophobicContact CD2-CG 4.31Å; L654-L676 HydrophobicContact CD2-CD1 4.33Å; L654-K678 CarbonylContact O-C 3.59Å; L654-K678 WeakPolarHBondContact O-CB 3.26Å; L654-L679 HydrophobicContact CB-CD2 4.26Å; L654-L679 HydrophobicContact CD2-CD2 4.18Å; L654-L679 HydrophobicContact CG-CD2 4.05Å; L654-L679 PolarHBondContact O-N 3.06Å; L654-L679 VanDerWaalsContact O-N 3.14Å
655	A	97.8	Very high	96.4	Very high	22 Å²	22	33.2 Å²	33.2	18%	0.182	18%	0.176	C	C	.	.			trans	-110.1	-35.5	-176.7	0	0	0	0	0	111.3	K629 N653 W680 Q681	K629-A655 HydrophobicContact CB-CB 4.47Å; K629-A655 WeakPolarHBondContact O-CA 3.24Å; K629-A655 WeakPolarHBondContact O-CB 3.36Å; K629-A655 PolarHBondContact O-N 3.38Å; N653-A655 PolarHBondContact O-N 3.5Å; A655-W680 PolarHBondContact O-N 2.81Å; A655-W680 PolarHBondContact O-NE1 3.35Å; A655-Q681 PolarHBondContact O-N 2.85Å
656	Y	98.4	Very high	96.2	Very high	18 Å²	18	30.6 Å²	30.6	7%	0.071	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	134.3	176.2	178.6	-83.2	0	0	0	110.8	K629 E630 L631 Y632 Q681	K629-Y656 PolarHBondContact O-N 2.77Å; E630-Y656 HydrophobicContact CB-CD1 4.43Å; L631-Y656 PolarHBondContact N-O 3.06Å; Y632-Y656 HydrophobicContact CD1-CD1 4.36Å; Y632-Y656 AromaticContact CD1-CE1 3.45Å; Y632-Y656 HydrophobicContact CD1-CE1 3.45Å; Y632-Y656 VanDerWaalsContact CD1-CE1 3.45Å; Y632-Y656 HydrophobicContact CD2-CD1 4.07Å; Y632-Y656 AromaticContact CD2-CE1 3.94Å; Y632-Y656 HydrophobicContact CD2-CE1 3.94Å; Y632-Y656 AromaticContact CE1-CD1 3.95Å; Y632-Y656 HydrophobicContact CE1-CD1 3.95Å; Y632-Y656 AromaticContact CE1-CE1 3.12Å; Y632-Y656 HydrophobicContact CE1-CE1 3.12Å; Y632-Y656 HydrophobicContact CE1-CE2 4.43Å; Y632-Y656 AromaticContact CE1-CZ 3.41Å; Y632-Y656 VanDerWaalsContact CE1-CZ 3.41Å; Y632-Y656 WeakPolarHBondContact CE1-OH 3.19Å; Y632-Y656 AromaticContact CE2-CD1 3.65Å; Y632-Y656 HydrophobicContact CE2-CD1 3.65Å; Y632-Y656 AromaticContact CE2-CE1 3.68Å; Y632-Y656 HydrophobicContact CE2-CE1 3.68Å; Y632-Y656 HydrophobicContact CG-CD1 4.41Å; Y632-Y656 AromaticContact CG-CE1 3.83Å; Y632-Y656 HydrophobicContact CG-CE1 3.83Å; Y632-Y656 AromaticContact CZ-CD1 3.55Å; Y632-Y656 AromaticContact CZ-CE1 3.23Å; Y632-Y656 AromaticContact CZ-CZ 3.74Å; Y656-Q681 WeakPolarHBondContact CA-O 3.44Å; Y656-Q681 HydrophobicContact CD2-CB 3.83Å; Y656-Q681 HydrophobicContact CD2-CG 3.63Å; Y656-Q681 HydrophobicContact CE2-CB 4.35Å; Y656-Q681 HydrophobicContact CE2-CG 3.63Å
657	L	98.3	Very high	96.2	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	129.8	172.4	178.6	59	0	0	0	111.4	L631 M647 L654 L659 L673 L679 Q681 I682 N683	L631-L657 HydrophobicContact CB-CD1 4.22Å; L631-L657 HydrophobicContact CD2-CD1 4.34Å; L631-L657 HydrophobicContact CG-CD1 4.25Å; L631-L657 WeakPolarHBondContact O-CA 3.44Å; M647-L657 HydrophobicContact CE-CD1 3.76Å; M647-L657 HydrophobicContact CE-CD2 4.23Å; L654-L657 HydrophobicContact CD2-CB 3.88Å; L654-L657 HydrophobicContact CD2-CD1 4.13Å; L654-L657 HydrophobicContact CD2-CD2 4.25Å; L654-L657 HydrophobicContact CD2-CG 4.31Å; L657-L659 HydrophobicContact CD1-CD2 4.26Å; L657-L659 HydrophobicContact CD1-CG 4.05Å; L657-L659 HydrophobicContact CD2-CD1 3.93Å; L657-L659 HydrophobicContact CD2-CG 4.27Å; L657-L659 HydrophobicContact CG-CD1 4.26Å; L657-L659 HydrophobicContact CG-CG 4.06Å; L657-L673 HydrophobicContact CD2-CD1 4Å; L657-L673 HydrophobicContact CD2-CD2 3.53Å; L657-L673 HydrophobicContact CD2-CG 4.44Å; L657-L679 HydrophobicContact CB-CD2 3.93Å; L657-Q681 PolarHBondContact N-O 3.46Å; L657-I682 WeakPolarHBondContact O-CA 3.36Å; L657-N683 PolarHBondContact O-N 3.4Å
658	S	97.8	Very high	96.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.3	168.1	-173.5	0	0	0	0	111	L631 L633 N683	L631-S658 PolarHBondContact O-N 3.27Å; L633-S658 CarbonylContact C-O 3.6Å; L633-S658 WeakPolarHBondContact CA-O 3.45Å; L633-S658 PolarHBondContact N-O 3.49Å; S658-N683 WeakPolarHBondContact CA-O 3.19Å; S658-N683 PolarHBondContact OG-ND2 2.87Å
659	L	97.3	Very high	96.1	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.183	C	C	.	.			trans	-125.9	23.9	173.1	-63.2	168.4	0	0	0	110.5	L633 I644 L657 S661 C662 I665 F670 L673 N683 L684 T687	L633-L659 HydrophobicContact CB-CD2 3.97Å; L633-L659 HydrophobicContact CD1-CD2 4.18Å; I644-L659 HydrophobicContact CD1-CD1 3.53Å; I644-L659 HydrophobicContact CD1-CD2 3.76Å; I644-L659 HydrophobicContact CD1-CG 4.3Å; I644-L659 HydrophobicContact CG1-CD1 4.24Å; L657-L659 HydrophobicContact CD1-CD2 4.26Å; L657-L659 HydrophobicContact CD1-CG 4.05Å; L657-L659 HydrophobicContact CD2-CD1 3.93Å; L657-L659 HydrophobicContact CD2-CG 4.27Å; L657-L659 HydrophobicContact CG-CD1 4.26Å; L657-L659 HydrophobicContact CG-CG 4.06Å; L659-S661 PolarHBondContact O-N 3.5Å; L659-C662 WeakPolarHBondContact O-CB 3.4Å; L659-C662 PolarHBondContact O-N 3.4Å; L659-C662 PolarHBondContact O-SG 3.2Å; L659-I665 HydrophobicContact CB-CD1 4.36Å; L659-I665 HydrophobicContact CD1-CD1 4.21Å; L659-I665 HydrophobicContact CD2-CD1 3.97Å; L659-I665 HydrophobicContact CG-CD1 4.42Å; L659-F670 HydrophobicContact CD1-CE1 4.36Å; L659-L673 HydrophobicContact CD1-CD1 4.24Å; L659-N683 PolarHBondContact N-O 2.95Å; L659-L684 HydrophobicContact CB-CD2 3.86Å; L659-L684 HydrophobicContact CD1-CD2 4.04Å; L659-L684 HydrophobicContact CG-CD2 4.39Å; L659-T687 WeakPolarHBondContact O-CG2 3.37Å
660	A	95.8	Very high	96.3	Very high	4 Å²	4	27.7 Å²	27.7	3%	0.033	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	138.1	-176.5	0	0	0	0	0	111.1	A634 R635 C662 N683 N685	A634-A660 CarbonylContact C-O 3.47Å; A634-A660 WeakPolarHBondContact CA-O 3.21Å; A634-A660 HydrophobicContact CB-CB 3.93Å; A634-A660 WeakPolarHBondContact CB-O 3.2Å; R635-A660 PolarHBondContact N-O 3.44Å; A660-C662 VanDerWaalsContact C-N 3.26Å; A660-C662 PolarHBondContact O-N 2.9Å; A660-N683 PolarHBondContact N-O 3.29Å; A660-N685 CarbonylContact C-O 3.18Å; A660-N685 VanDerWaalsContact CA-O 3.26Å; A660-N685 WeakPolarHBondContact CA-O 3.35Å; A660-N685 HydrophobicContact CB-CB 4.08Å
661	S	95.3	Very high	96.3	Very high	28 Å²	28	27.1 Å²	27.1	20%	0.196	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	31.5	179.9	-54.4	0	0	0	0	114.5	L659 P663 N685	L659-S661 PolarHBondContact O-N 3.5Å; S661-P663 VanDerWaalsContact O-CD 3.32Å; S661-P663 WeakPolarHBondContact O-CD 3.35Å; S661-N685 PolarHBondContact N-O 3.5Å
662	C	95.7	Very high	96.3	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.171	C	C	.	.			trans	-92.9	102.2	168.1	-67.3	0	0	0	0	110.3	L633 L659 A660 L664 I665	L633-C662 PolarHBondContact O-SG 3.3Å; L659-C662 WeakPolarHBondContact O-CB 3.4Å; L659-C662 PolarHBondContact O-N 3.4Å; L659-C662 PolarHBondContact O-SG 3.2Å; A660-C662 VanDerWaalsContact C-N 3.26Å; A660-C662 PolarHBondContact O-N 2.9Å; C662-L664 PolarHBondContact O-N 2.81Å; C662-I665 HydrophobicContact CB-CD1 3.55Å; C662-I665 HydrophobicContact CB-CG1 3.96Å
663	P	92.5	Very high	96.3	Very high	55 Å²	55	24.3 Å²	24.3	36%	0.357	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-14.8	-165.3	31.7	-36.4	0	0	0	114.9	S661 K688	S661-P663 VanDerWaalsContact O-CD 3.32Å; S661-P663 WeakPolarHBondContact O-CD 3.35Å; P663-K688 WeakPolarHBondContact O-CD 3.45Å; P663-K688 WeakPolarHBondContact O-CE 3.26Å; P663-K688 PolarHBondContact O-NZ 2.91Å
664	L	96.1	Very high	96.1	Very high	89 Å²	89	22.1 Å²	22.1	47%	0.466	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	-1.2	-178	-58.8	-179.9	0	0	0	113.4	D637 L639 T640 C662	D637-L664 VanDerWaalsContact O-CD1 3.25Å; D637-L664 WeakPolarHBondContact O-CD1 3.41Å; L639-L664 WeakPolarHBondContact O-CB 3.41Å; T640-L664 HydrophobicContact CG2-CB 4.19Å; T640-L664 HydrophobicContact CG2-CD1 4.2Å; C662-L664 PolarHBondContact O-N 2.81Å
665	I	96.4	Very high	95.8	Very high	0 Å²	0	27 Å²	27	0%	0	16%	0.159	C	C	.	.			trans	-90.9	133.6	177.6	-55.5	-178.8	0	0	0	109.7	L639 D641 I644 L659 C662 A669 F670	L639-I665 HydrophobicContact CB-CD1 4.42Å; L639-I665 WeakPolarHBondContact O-CG1 3.48Å; D641-I665 WeakPolarHBondContact OD1-CA 3.24Å; I644-I665 HydrophobicContact CD1-CD1 4.05Å; I644-I665 HydrophobicContact CG1-CD1 4.06Å; I644-I665 HydrophobicContact CG1-CG2 4.15Å; L659-I665 HydrophobicContact CB-CD1 4.36Å; L659-I665 HydrophobicContact CD1-CD1 4.21Å; L659-I665 HydrophobicContact CD2-CD1 3.97Å; L659-I665 HydrophobicContact CG-CD1 4.42Å; C662-I665 HydrophobicContact CB-CD1 3.55Å; C662-I665 HydrophobicContact CB-CG1 3.96Å; I665-A669 HydrophobicContact CG2-CB 3.55Å; I665-F670 HydrophobicContact CB-CZ 4.2Å; I665-F670 HydrophobicContact CG2-CD1 4.3Å; I665-F670 HydrophobicContact CG2-CE1 3.57Å; I665-F670 HydrophobicContact CG2-CE2 4.23Å; I665-F670 HydrophobicContact CG2-CZ 3.54Å
666	S	94.8	Very high	95.7	Very high	46 Å²	46	26 Å²	26	32%	0.322	15%	0.151	S	C	.	.			trans	-119.8	177.2	-175.5	91.2	0	0	0	0	113	D641 G668 A669 F670	D641-S666 PolarHBondContact OD1-N 3.17Å; D641-S666 WeakPolarHBondContact OD2-CB 3.32Å; D641-S666 PolarHBondContact OD2-OG 2.92Å; S666-G668 PolarHBondContact O-N 3.27Å; S666-G668 PolarHBondContact OG-N 3.24Å; S666-A669 WeakPolarHBondContact O-CB 3.43Å; S666-A669 PolarHBondContact O-N 3.33Å; S666-F670 VanDerWaalsContact O-CD2 3.22Å; S666-F670 WeakPolarHBondContact O-CD2 3.14Å; S666-F670 PolarHBondContact O-N 2.9Å
667	D	95.5	Very high	95.5	Very high	29 Å²	29	29.5 Å²	29.5	16%	0.155	17%	0.168	C	C	.	.	H	α-helix	trans	-54.5	-32.6	175.5	-88.1	10.1	0	0	0	113.8	A669 F670 E671 L689 G690 R692 G693	D667-A669 PolarHBondContact O-N 3.36Å; D667-F670 PolarHBondContact O-N 3.1Å; D667-F670 VanDerWaalsContact O-N 3.09Å; D667-E671 WeakPolarHBondContact O-CG 3.24Å; D667-E671 PolarHBondContact O-N 3.32Å; D667-L689 WeakPolarHBondContact OD1-CA 3.02Å; D667-G690 PolarHBondContact OD1-N 3.28Å; D667-G690 VanDerWaalsContact OD2-C 3.28Å; D667-G690 WeakPolarHBondContact OD2-CA 3.43Å; D667-G690 PolarHBondContact OD2-N 2.92Å; D667-R692 HydrophobicContact CB-CB 4.37Å; D667-R692 WeakPolarHBondContact OD2-CB 3.43Å; D667-R692 PolarHBondContact OD2-N 3.17Å; D667-G693 PolarHBondContact OD2-N 2.76Å
668	G	95	Very high	95.4	Very high	38 Å²	38	34 Å²	34	39%	0.392	19%	0.187	S	C	.	.	H	α-helix	trans	-58	-37	176.6	0	0	0	0	0	112.6	S666 L672	S666-G668 PolarHBondContact O-N 3.27Å; S666-G668 PolarHBondContact OG-N 3.24Å; G668-L672 WeakPolarHBondContact O-CG 3.43Å
669	A	96.3	Very high	95.4	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-74.2	-39.4	173.9	0	0	0	0	0	113.3	D641 I644 I665 S666 D667 E671 L672 L673	D641-A669 HydrophobicContact CB-CB 3.89Å; D641-A669 VanDerWaalsContact OD1-CB 3.23Å; D641-A669 WeakPolarHBondContact OD1-CB 3.27Å; I644-A669 HydrophobicContact CB-CB 3.68Å; I644-A669 HydrophobicContact CG1-CB 3.85Å; I644-A669 HydrophobicContact CG2-CB 3.87Å; I644-A669 WeakPolarHBondContact CG2-O 3.37Å; I665-A669 HydrophobicContact CG2-CB 3.55Å; S666-A669 WeakPolarHBondContact O-CB 3.43Å; S666-A669 PolarHBondContact O-N 3.33Å; D667-A669 PolarHBondContact O-N 3.36Å; A669-E671 VanDerWaalsContact C-N 3.3Å; A669-E671 PolarHBondContact O-N 3.45Å; A669-L672 WeakPolarHBondContact O-CB 3.38Å; A669-L672 PolarHBondContact O-N 3.26Å; A669-L672 VanDerWaalsContact O-N 3.11Å; A669-L673 PolarHBondContact O-N 3.45Å
670	F	96.9	Very high	95.4	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-69.1	-30	-179.3	-57.4	-46.7	0	0	0	112.5	L659 I665 S666 D667 L672 L673 L684 T687 L689	L659-F670 HydrophobicContact CD1-CE1 4.36Å; I665-F670 HydrophobicContact CB-CZ 4.2Å; I665-F670 HydrophobicContact CG2-CD1 4.3Å; I665-F670 HydrophobicContact CG2-CE1 3.57Å; I665-F670 HydrophobicContact CG2-CE2 4.23Å; I665-F670 HydrophobicContact CG2-CZ 3.54Å; S666-F670 VanDerWaalsContact O-CD2 3.22Å; S666-F670 WeakPolarHBondContact O-CD2 3.14Å; S666-F670 PolarHBondContact O-N 2.9Å; D667-F670 PolarHBondContact O-N 3.1Å; D667-F670 VanDerWaalsContact O-N 3.09Å; F670-L672 VanDerWaalsContact C-N 3.3Å; F670-L672 PolarHBondContact O-N 3.26Å; F670-L673 HydrophobicContact CD1-CD1 3.87Å; F670-L673 WeakPolarHBondContact O-CB 3.43Å; F670-L673 PolarHBondContact O-N 3.22Å; F670-L684 HydrophobicContact CD1-CD1 3.68Å; F670-L684 HydrophobicContact CD1-CD2 4.11Å; F670-L684 HydrophobicContact CE1-CD1 3.82Å; F670-L684 HydrophobicContact CE1-CD2 3.64Å; F670-L684 HydrophobicContact CE1-CG 4.23Å; F670-L684 HydrophobicContact CG-CD1 4.2Å; F670-L684 HydrophobicContact CZ-CD1 4.43Å; F670-L684 HydrophobicContact CZ-CD2 4.46Å; F670-T687 HydrophobicContact CZ-CG2 4.23Å; F670-L689 HydrophobicContact CB-CD1 3.86Å; F670-L689 HydrophobicContact CD2-CB 4.03Å; F670-L689 HydrophobicContact CD2-CD1 3.29Å; F670-L689 HydrophobicContact CD2-CG 4.27Å; F670-L689 HydrophobicContact CE2-CB 3.8Å; F670-L689 HydrophobicContact CE2-CD1 3.96Å; F670-L689 HydrophobicContact CG-CD1 3.67Å
671	E	96.5	Very high	95.5	Very high	91 Å²	91	39.9 Å²	39.9	43%	0.425	21%	0.21	S	C	.	.	H	α-helix	trans	-60.6	-39.3	169	-72.2	-179.7	-141.3	0	0	111.9	D667 A669 L673 G674 A696	D667-E671 WeakPolarHBondContact O-CG 3.24Å; D667-E671 PolarHBondContact O-N 3.32Å; A669-E671 VanDerWaalsContact C-N 3.3Å; A669-E671 PolarHBondContact O-N 3.45Å; E671-L673 VanDerWaalsContact C-N 3.32Å; E671-L673 PolarHBondContact O-N 3.19Å; E671-G674 PolarHBondContact O-N 3.36Å; E671-A696 HydrophobicContact CB-CB 4.19Å; E671-A696 HydrophobicContact CG-CB 3.91Å
672	L	96.1	Very high	95.6	Very high	38 Å²	38	38.5 Å²	38.5	20%	0.199	20%	0.201	C	C	.	.	H	α-helix	trans	-68.2	-30.7	176.8	-61.9	171.6	0	0	0	112.5	H645 G668 A669 F670 G674 Q675	H645-L672 HydrophobicContact CB-CD1 3.68Å; G668-L672 WeakPolarHBondContact O-CG 3.43Å; A669-L672 WeakPolarHBondContact O-CB 3.38Å; A669-L672 PolarHBondContact O-N 3.26Å; A669-L672 VanDerWaalsContact O-N 3.11Å; F670-L672 VanDerWaalsContact C-N 3.3Å; F670-L672 PolarHBondContact O-N 3.26Å; L672-G674 PolarHBondContact O-N 2.77Å; L672-Q675 VanDerWaalsContact O-CB 3.29Å; L672-Q675 WeakPolarHBondContact O-CB 3.16Å; L672-Q675 WeakPolarHBondContact O-CG 3.1Å; L672-Q675 PolarHBondContact O-N 3.43Å
673	L	96	Very high	95.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-61.5	-26.2	173.8	-64.7	-176.5	0	0	0	112.5	I644 L657 L659 A669 F670 E671 Q675 L676 L684 L697	I644-L673 HydrophobicContact CG2-CD2 3.51Å; I644-L673 HydrophobicContact CG2-CG 3.9Å; L657-L673 HydrophobicContact CD2-CD1 4Å; L657-L673 HydrophobicContact CD2-CD2 3.53Å; L657-L673 HydrophobicContact CD2-CG 4.44Å; L659-L673 HydrophobicContact CD1-CD1 4.24Å; A669-L673 PolarHBondContact O-N 3.45Å; F670-L673 HydrophobicContact CD1-CD1 3.87Å; F670-L673 WeakPolarHBondContact O-CB 3.43Å; F670-L673 PolarHBondContact O-N 3.22Å; E671-L673 VanDerWaalsContact C-N 3.32Å; E671-L673 PolarHBondContact O-N 3.19Å; L673-Q675 PolarHBondContact O-N 3.41Å; L673-L676 HydrophobicContact CD2-CD1 3.92Å; L673-L676 WeakPolarHBondContact O-CB 3.37Å; L673-L676 PolarHBondContact O-N 3.31Å; L673-L684 HydrophobicContact CD1-CD2 4.41Å; L673-L697 HydrophobicContact CB-CD2 3.91Å; L673-L697 HydrophobicContact CD1-CD2 4.45Å
674	G	91.6	Very high	95.9	Very high	7 Å²	7	36 Å²	36	7%	0.072	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-16.1	173.3	0	0	0	0	0	113.9	E671 L672 Q677	E671-G674 PolarHBondContact O-N 3.36Å; L672-G674 PolarHBondContact O-N 2.77Å; G674-Q677 PolarHBondContact O-NE2 3.08Å
675	Q	90.7	Very high	95.9	Very high	101 Å²	101	32 Å²	32	47%	0.472	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-20.8	176	-59.1	174.5	0.7	0	0	112.9	L672 L673 Q677	L672-Q675 VanDerWaalsContact O-CB 3.29Å; L672-Q675 WeakPolarHBondContact O-CB 3.16Å; L672-Q675 WeakPolarHBondContact O-CG 3.1Å; L672-Q675 PolarHBondContact O-N 3.43Å; L673-Q675 PolarHBondContact O-N 3.41Å; Q675-Q677 VanDerWaalsContact C-N 3.34Å; Q675-Q677 WeakPolarHBondContact O-CG 3.12Å; Q675-Q677 PolarHBondContact O-N 3.49Å; Q675-Q677 PolarHBondContact O-NE2 3.35Å
676	L	95.7	Very high	95.8	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	18%	0.175	C	C	.	.			trans	-82	74.1	-176	-65.2	178.4	0	0	0	111.8	L651 L652 L654 L673 K678 L679 L700	L651-L676 WeakPolarHBondContact O-CD2 3.45Å; L652-L676 HydrophobicContact CD2-CD2 4.42Å; L654-L676 HydrophobicContact CD2-CD1 4.33Å; L673-L676 HydrophobicContact CD2-CD1 3.92Å; L673-L676 WeakPolarHBondContact O-CB 3.37Å; L673-L676 PolarHBondContact O-N 3.31Å; L676-K678 PolarHBondContact O-N 3.19Å; L676-L679 HydrophobicContact CB-CD1 3.6Å; L676-L679 HydrophobicContact CB-CG 3.85Å; L676-L679 HydrophobicContact CD1-CD1 3.86Å; L676-L679 HydrophobicContact CD1-CG 4.49Å; L676-L679 HydrophobicContact CG-CD1 4.37Å; L676-L679 WeakPolarHBondContact O-CB 3.35Å; L676-L679 PolarHBondContact O-N 3.16Å; L676-L700 VanDerWaalsContact O-CD2 3.32Å; L676-L700 WeakPolarHBondContact O-CD2 3.34Å
677	Q	94.6	Very high	95.8	Very high	93 Å²	93	31.9 Å²	31.9	44%	0.435	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-11.8	-170.8	-56.5	-52.7	-51.6	0	0	116.1	G674 Q675 P701	G674-Q677 PolarHBondContact O-NE2 3.08Å; Q675-Q677 VanDerWaalsContact C-N 3.34Å; Q675-Q677 WeakPolarHBondContact O-CG 3.12Å; Q675-Q677 PolarHBondContact O-N 3.49Å; Q675-Q677 PolarHBondContact O-NE2 3.35Å; Q677-P701 HydrophobicContact CB-CG 4.45Å
678	K	97.1	Very high	95.7	Very high	93 Å²	93	36.6 Å²	36.6	40%	0.404	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-9.5	178.7	-61.5	-156.9	-169	176.4	0	114.2	N653 L654 L676 W680	N653-K678 WeakPolarHBondContact OD1-CD 3.47Å; N653-K678 WeakPolarHBondContact OD1-CE 3.45Å; N653-K678 PolarHBondContact OD1-NZ 3.42Å; L654-K678 CarbonylContact O-C 3.59Å; L654-K678 WeakPolarHBondContact O-CB 3.26Å; L676-K678 PolarHBondContact O-N 3.19Å; K678-W680 PolarHBondContact O-N 3.2Å
679	L	97.9	Very high	95.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.163	C	C	.	.			trans	-61	125	177.2	-76	175.4	0	0	0	110.4	L654 L657 L676 I682 L700 K702 L703	L654-L679 HydrophobicContact CB-CD2 4.26Å; L654-L679 HydrophobicContact CD2-CD2 4.18Å; L654-L679 HydrophobicContact CG-CD2 4.05Å; L654-L679 PolarHBondContact O-N 3.06Å; L654-L679 VanDerWaalsContact O-N 3.14Å; L657-L679 HydrophobicContact CB-CD2 3.93Å; L676-L679 HydrophobicContact CB-CD1 3.6Å; L676-L679 HydrophobicContact CB-CG 3.85Å; L676-L679 HydrophobicContact CD1-CD1 3.86Å; L676-L679 HydrophobicContact CD1-CG 4.49Å; L676-L679 HydrophobicContact CG-CD1 4.37Å; L676-L679 WeakPolarHBondContact O-CB 3.35Å; L676-L679 PolarHBondContact O-N 3.16Å; L679-I682 HydrophobicContact CB-CD1 4.23Å; L679-I682 HydrophobicContact CB-CG1 4.26Å; L679-I682 HydrophobicContact CD1-CD1 3.71Å; L679-I682 HydrophobicContact CD1-CG1 4.07Å; L679-L700 HydrophobicContact CB-CD1 4.33Å; L679-K702 CarbonylContact O-C 3.56Å; L679-K702 WeakPolarHBondContact O-CB 3.17Å; L679-L703 PolarHBondContact O-N 2.89Å
680	W	97.4	Very high	95.8	Very high	100 Å²	100	35.1 Å²	35.1	38%	0.379	17%	0.166	S	C	.	.			trans	-114.6	-23.1	174.2	77	-83.8	0	0	0	112.2	A655 K678 K702 R704 E705	A655-W680 PolarHBondContact O-N 2.81Å; A655-W680 PolarHBondContact O-NE1 3.35Å; K678-W680 PolarHBondContact O-N 3.2Å; W680-K702 VanDerWaalsContact CA-O 3.25Å; W680-K702 WeakPolarHBondContact CA-O 3.27Å; W680-K702 HydrophobicContact CB-CB 4.4Å; W680-K702 VanDerWaalsContact CB-O 3.26Å; W680-K702 WeakPolarHBondContact CB-O 3.31Å; W680-R704 HydrophobicContact CE3-CB 4.18Å; W680-R704 PolarHBondContact O-N 2.89Å; W680-E705 HydrophobicContact CE3-CG 4.4Å; W680-E705 HydrophobicContact CZ3-CG 3.87Å; W680-E705 PolarHBondContact O-N 3.29Å
681	Q	97.6	Very high	95.9	Very high	28 Å²	28	36.8 Å²	36.8	13%	0.131	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	130.7	176.2	-179.5	172.8	41.7	0	0	110.8	A655 Y656 L657 E705	A655-Q681 PolarHBondContact O-N 2.85Å; Y656-Q681 WeakPolarHBondContact CA-O 3.44Å; Y656-Q681 HydrophobicContact CD2-CB 3.83Å; Y656-Q681 HydrophobicContact CD2-CG 3.63Å; Y656-Q681 HydrophobicContact CE2-CB 4.35Å; Y656-Q681 HydrophobicContact CE2-CG 3.63Å; L657-Q681 PolarHBondContact N-O 3.46Å; Q681-E705 WeakPolarHBondContact CA-O 3.38Å; Q681-E705 HydrophobicContact CB-CB 4.13Å; Q681-E705 HydrophobicContact CG-CB 3.84Å; Q681-E705 PolarHBondContact NE2-OE2 3.36Å
682	I	97.8	Very high	95.9	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	133.8	178.2	-52.2	178.6	0	0	0	109.9	L657 L679 L684 L697 L700 L703 E705 L706 K707	L657-I682 WeakPolarHBondContact O-CA 3.36Å; L679-I682 HydrophobicContact CB-CD1 4.23Å; L679-I682 HydrophobicContact CB-CG1 4.26Å; L679-I682 HydrophobicContact CD1-CD1 3.71Å; L679-I682 HydrophobicContact CD1-CG1 4.07Å; I682-L684 HydrophobicContact CG2-CD1 4.09Å; I682-L684 HydrophobicContact CG2-CD2 3.77Å; I682-L684 HydrophobicContact CG2-CG 3.66Å; I682-L697 HydrophobicContact CD1-CD2 4.01Å; I682-L700 HydrophobicContact CD1-CD1 3.42Å; I682-L700 VanDerWaalsContact CD1-CD1 3.42Å; I682-L703 HydrophobicContact CB-CD1 4.46Å; I682-L703 HydrophobicContact CD1-CD1 3.97Å; I682-L703 HydrophobicContact CG1-CD1 3.86Å; I682-E705 PolarHBondContact N-O 3.13Å; I682-L706 HydrophobicContact CB-CD1 4.21Å; I682-K707 PolarHBondContact O-N 2.95Å
683	N	97.4	Very high	95.9	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	110.3	173.7	-176.5	6.5	0	0	0	111.7	L657 S658 L659 A660 N685 K707 N853	L657-N683 PolarHBondContact O-N 3.4Å; S658-N683 WeakPolarHBondContact CA-O 3.19Å; S658-N683 PolarHBondContact OG-ND2 2.87Å; L659-N683 PolarHBondContact N-O 2.95Å; A660-N683 PolarHBondContact N-O 3.29Å; N683-N685 WeakPolarHBondContact OD1-CB 3.46Å; N683-N685 PolarHBondContact OD1-N 3.46Å; N683-N685 PolarHBondContact OD1-ND2 2.97Å; N683-K707 HydrophobicContact CB-CB 4.24Å; N683-K707 HydrophobicContact CB-CD 4.37Å; N683-N853 PolarHBondContact ND2-O 3.11Å
684	L	97.3	Very high	96	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	18%	0.179	C	C	.	.			trans	-122.3	23.8	180	-52.4	179.5	0	0	0	111.4	L659 F670 L673 I682 S686 T687 L689 L697 K707 V708 C711	L659-L684 HydrophobicContact CB-CD2 3.86Å; L659-L684 HydrophobicContact CD1-CD2 4.04Å; L659-L684 HydrophobicContact CG-CD2 4.39Å; F670-L684 HydrophobicContact CD1-CD1 3.68Å; F670-L684 HydrophobicContact CD1-CD2 4.11Å; F670-L684 HydrophobicContact CE1-CD1 3.82Å; F670-L684 HydrophobicContact CE1-CD2 3.64Å; F670-L684 HydrophobicContact CE1-CG 4.23Å; F670-L684 HydrophobicContact CG-CD1 4.2Å; F670-L684 HydrophobicContact CZ-CD1 4.43Å; F670-L684 HydrophobicContact CZ-CD2 4.46Å; L673-L684 HydrophobicContact CD1-CD2 4.41Å; I682-L684 HydrophobicContact CG2-CD1 4.09Å; I682-L684 HydrophobicContact CG2-CD2 3.77Å; I682-L684 HydrophobicContact CG2-CG 3.66Å; L684-S686 PolarHBondContact O-N 3.1Å; L684-T687 HydrophobicContact CB-CG2 4.31Å; L684-T687 WeakPolarHBondContact O-CB 3.35Å; L684-T687 VanDerWaalsContact O-CG2 3.27Å; L684-T687 WeakPolarHBondContact O-CG2 3.33Å; L684-T687 PolarHBondContact O-N 3.09Å; L684-T687 PolarHBondContact O-OG1 3.4Å; L684-L689 HydrophobicContact CB-CD2 4.45Å; L684-L689 HydrophobicContact CD1-CD1 4.27Å; L684-L689 HydrophobicContact CD1-CD2 4Å; L684-L697 HydrophobicContact CD1-CD1 3.61Å; L684-K707 PolarHBondContact N-O 3.38Å; L684-V708 HydrophobicContact CB-CG1 4.33Å; L684-C711 PolarHBondContact O-SG 2.96Å
685	N	95.3	Very high	96.2	Very high	7 Å²	7	40.7 Å²	40.7	4%	0.037	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	137.4	179.7	-73.7	-11.9	0	0	0	111.3	A660 S661 N683 T687 K707 V708 S709 N853	A660-N685 CarbonylContact C-O 3.18Å; A660-N685 VanDerWaalsContact CA-O 3.26Å; A660-N685 WeakPolarHBondContact CA-O 3.35Å; A660-N685 HydrophobicContact CB-CB 4.08Å; S661-N685 PolarHBondContact N-O 3.5Å; N683-N685 WeakPolarHBondContact OD1-CB 3.46Å; N683-N685 PolarHBondContact OD1-N 3.46Å; N683-N685 PolarHBondContact OD1-ND2 2.97Å; N685-T687 VanDerWaalsContact C-N 3.25Å; N685-T687 PolarHBondContact O-N 3.45Å; N685-K707 PolarHBondContact N-O 3.37Å; N685-K707 WeakPolarHBondContact OD1-CB 3.24Å; N685-K707 PolarHBondContact OD1-O 2.88Å; N685-V708 PolarHBondContact OD1-N 2.96Å; N685-V708 VanDerWaalsContact OD1-N 3.1Å; N685-S709 CarbonylContact C-O 3.42Å; N685-S709 VanDerWaalsContact CA-O 3.32Å; N685-S709 WeakPolarHBondContact CA-O 3.4Å; N685-S709 WeakPolarHBondContact OD1-CB 3.38Å; N685-S709 PolarHBondContact OD1-N 2.84Å; N685-N853 WeakPolarHBondContact ND2-CB 3.46Å; N685-N853 PolarHBondContact ND2-ND2 3.29Å
686	S	94.2	Very high	96.5	Very high	34 Å²	34	37 Å²	37	24%	0.238	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.1	36.8	175.7	-49.7	0	0	0	0	113.8	L684 S709 R710	L684-S686 PolarHBondContact O-N 3.1Å; S686-S709 PolarHBondContact N-O 3.18Å; S686-R710 WeakPolarHBondContact OG-CD 3.36Å
687	T	95	Very high	96.5	Very high	9 Å²	9	37 Å²	37	6%	0.055	17%	0.171	C	C	.	.	S	Bend	trans	-103.5	175.5	170	62.6	0	0	0	0	110.4	L659 F670 L684 N685 L689	L659-T687 WeakPolarHBondContact O-CG2 3.37Å; F670-T687 HydrophobicContact CZ-CG2 4.23Å; L684-T687 HydrophobicContact CB-CG2 4.31Å; L684-T687 WeakPolarHBondContact O-CB 3.35Å; L684-T687 VanDerWaalsContact O-CG2 3.27Å; L684-T687 WeakPolarHBondContact O-CG2 3.33Å; L684-T687 PolarHBondContact O-N 3.09Å; L684-T687 PolarHBondContact O-OG1 3.4Å; N685-T687 VanDerWaalsContact C-N 3.25Å; N685-T687 PolarHBondContact O-N 3.45Å; T687-L689 PolarHBondContact O-N 3.32Å; T687-L689 VanDerWaalsContact O-N 3.16Å
688	K	93.4	Very high	96.5	Very high	128 Å²	128	32.6 Å²	32.6	56%	0.557	15%	0.151	S	C	*	.			trans	-83	32.2	173.9	-64.8	176.2	174.5	157.2	0	113	P663 G690	P663-K688 WeakPolarHBondContact O-CD 3.45Å; P663-K688 WeakPolarHBondContact O-CE 3.26Å; P663-K688 PolarHBondContact O-NZ 2.91Å; K688-G690 PolarHBondContact O-N 3.04Å
689	L	96.9	Very high	96.4	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.152	C	C	.	.			trans	-65.7	124.3	176.9	-179.3	71.6	0	0	0	110.3	D667 F670 L684 T687 L694 L697 V708 C711 I714	D667-L689 WeakPolarHBondContact OD1-CA 3.02Å; F670-L689 HydrophobicContact CB-CD1 3.86Å; F670-L689 HydrophobicContact CD2-CB 4.03Å; F670-L689 HydrophobicContact CD2-CD1 3.29Å; F670-L689 HydrophobicContact CD2-CG 4.27Å; F670-L689 HydrophobicContact CE2-CB 3.8Å; F670-L689 HydrophobicContact CE2-CD1 3.96Å; F670-L689 HydrophobicContact CG-CD1 3.67Å; L684-L689 HydrophobicContact CB-CD2 4.45Å; L684-L689 HydrophobicContact CD1-CD1 4.27Å; L684-L689 HydrophobicContact CD1-CD2 4Å; T687-L689 PolarHBondContact O-N 3.32Å; T687-L689 VanDerWaalsContact O-N 3.16Å; L689-L694 HydrophobicContact CD1-CB 4.47Å; L689-L694 HydrophobicContact CD2-CB 4.48Å; L689-L694 HydrophobicContact CD2-CD1 4.33Å; L689-L694 HydrophobicContact CG-CB 4.44Å; L689-L697 HydrophobicContact CD1-CD1 4.47Å; L689-V708 HydrophobicContact CD2-CB 3.98Å; L689-V708 HydrophobicContact CD2-CG1 3.33Å; L689-C711 HydrophobicContact CB-CB 4.04Å; L689-I714 HydrophobicContact CD2-CD1 4.08Å; L689-I714 HydrophobicContact CG-CD1 4.43Å
690	G	96.8	Very high	96.3	Very high	6 Å²	6	31.3 Å²	31.3	6%	0.062	15%	0.154	C	C	.	.	B	Isolated β-bridge	trans	-117.2	-167.2	173.1	0	0	0	0	0	112.3	D667 K688 R692 L694	D667-G690 PolarHBondContact OD1-N 3.28Å; D667-G690 VanDerWaalsContact OD2-C 3.28Å; D667-G690 WeakPolarHBondContact OD2-CA 3.43Å; D667-G690 PolarHBondContact OD2-N 2.92Å; K688-G690 PolarHBondContact O-N 3.04Å; G690-R692 VanDerWaalsContact C-N 3.33Å; G690-R692 PolarHBondContact O-N 2.8Å; G690-L694 WeakPolarHBondContact O-CB 3.37Å; G690-L694 PolarHBondContact O-N 3.41Å
691	D	97.9	Very high	96.1	Very high	36 Å²	36	29.7 Å²	29.7	19%	0.193	16%	0.156	C	C	.	.	H	α-helix	trans	-64.6	-31.8	-171.9	-72.7	-18.1	0	0	0	114.3	S695 T715 G718	D691-S695 WeakPolarHBondContact O-CB 3.47Å; D691-S695 PolarHBondContact O-N 3.4Å; D691-T715 PolarHBondContact OD1-N 3.05Å; D691-T715 PolarHBondContact OD1-OG1 2.99Å; D691-T715 PolarHBondContact OD2-OG1 2.84Å; D691-G718 VanDerWaalsContact CG-N 3.32Å; D691-G718 VanDerWaalsContact OD1-CA 3.26Å; D691-G718 WeakPolarHBondContact OD1-CA 3.1Å; D691-G718 PolarHBondContact OD1-N 2.92Å
692	R	96.5	Very high	96.1	Very high	189 Å²	189	33.3 Å²	33.3	71%	0.713	17%	0.171	S	C	*	.	H	α-helix	trans	-73.6	-49	-177.9	-62.7	-178.2	179.8	-179.1	0	110.2	D667 G690 L694 S695 A696	D667-R692 HydrophobicContact CB-CB 4.37Å; D667-R692 WeakPolarHBondContact OD2-CB 3.43Å; D667-R692 PolarHBondContact OD2-N 3.17Å; G690-R692 VanDerWaalsContact C-N 3.33Å; G690-R692 PolarHBondContact O-N 2.8Å; R692-L694 PolarHBondContact O-N 3.18Å; R692-S695 WeakPolarHBondContact O-CB 3.21Å; R692-S695 PolarHBondContact O-N 2.72Å; R692-A696 PolarHBondContact O-N 3.4Å; R692-A696 VanDerWaalsContact O-N 3.12Å
693	G	96.5	Very high	96.1	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.3	-48.2	175.9	0	0	0	0	0	111.1	D667 S695 A696 L697	D667-G693 PolarHBondContact OD2-N 2.76Å; G693-S695 PolarHBondContact O-N 2.73Å; G693-A696 PolarHBondContact O-N 2.91Å; G693-L697 WeakPolarHBondContact O-CG 3.38Å; G693-L697 PolarHBondContact O-N 3.36Å
694	L	97.9	Very high	96.1	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-61.2	-44.3	179	-177.8	64.4	0	0	0	111.7	L689 G690 R692 A696 L697 L706 I714 L719 F722	L689-L694 HydrophobicContact CD1-CB 4.47Å; L689-L694 HydrophobicContact CD2-CB 4.48Å; L689-L694 HydrophobicContact CD2-CD1 4.33Å; L689-L694 HydrophobicContact CG-CB 4.44Å; G690-L694 WeakPolarHBondContact O-CB 3.37Å; G690-L694 PolarHBondContact O-N 3.41Å; R692-L694 PolarHBondContact O-N 3.18Å; L694-A696 VanDerWaalsContact C-N 3.27Å; L694-A696 PolarHBondContact O-N 3.37Å; L694-L697 PolarHBondContact O-N 3.32Å; L694-L706 HydrophobicContact CD1-CD2 3.75Å; L694-I714 HydrophobicContact CD2-CB 4.44Å; L694-I714 HydrophobicContact CD2-CD1 4Å; L694-I714 HydrophobicContact CD2-CG1 4.09Å; L694-I714 HydrophobicContact CD2-CG2 3.5Å; L694-I714 VanDerWaalsContact CD2-CG2 3.5Å; L694-L719 HydrophobicContact CD2-CB 4.4Å; L694-L719 HydrophobicContact CD2-CD1 4.48Å; L694-F722 HydrophobicContact CD1-CB 4.43Å; L694-F722 HydrophobicContact CD1-CD2 4.1Å; L694-F722 HydrophobicContact CD1-CG 4.14Å; L694-F722 HydrophobicContact CD2-CB 4.47Å; L694-F722 HydrophobicContact CG-CB 3.92Å; L694-F722 HydrophobicContact CG-CD2 4.43Å; L694-F722 HydrophobicContact CG-CG 4.18Å; L694-F722 VanDerWaalsContact O-CD2 3.31Å; L694-F722 WeakPolarHBondContact O-CD2 3.4Å
695	S	96.4	Very high	96.1	Very high	29 Å²	29	39.3 Å²	39.3	20%	0.203	20%	0.197	C	C	.	.	H	α-helix	trans	-56.5	-41.9	177.1	-180	0	0	0	0	112.1	D691 R692 G693 G698 K721	D691-S695 WeakPolarHBondContact O-CB 3.47Å; D691-S695 PolarHBondContact O-N 3.4Å; R692-S695 WeakPolarHBondContact O-CB 3.21Å; R692-S695 PolarHBondContact O-N 2.72Å; G693-S695 PolarHBondContact O-N 2.73Å; S695-G698 PolarHBondContact O-N 3.44Å; S695-K721 VanDerWaalsContact OG-CB 3.3Å; S695-K721 WeakPolarHBondContact OG-CB 3.48Å
696	A	95.9	Very high	96.3	Very high	23 Å²	23	39 Å²	39	19%	0.19	20%	0.195	C	C	.	.	H	α-helix	trans	-67.1	-36.2	-178.8	0	0	0	0	0	112.8	E671 R692 G693 L694 G698 S699	E671-A696 HydrophobicContact CB-CB 4.19Å; E671-A696 HydrophobicContact CG-CB 3.91Å; R692-A696 PolarHBondContact O-N 3.4Å; R692-A696 VanDerWaalsContact O-N 3.12Å; G693-A696 PolarHBondContact O-N 2.91Å; L694-A696 VanDerWaalsContact C-N 3.27Å; L694-A696 PolarHBondContact O-N 3.37Å; A696-G698 PolarHBondContact O-N 2.84Å; A696-S699 WeakPolarHBondContact O-CB 3.46Å; A696-S699 PolarHBondContact O-N 3.02Å; A696-S699 PolarHBondContact O-OG 2.67Å
697	L	97.2	Very high	96.4	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62	-23.6	176.4	-61.6	177.3	0	0	0	112.9	L673 I682 L684 L689 G693 L694 S699 L700 L706 F722	L673-L697 HydrophobicContact CB-CD2 3.91Å; L673-L697 HydrophobicContact CD1-CD2 4.45Å; I682-L697 HydrophobicContact CD1-CD2 4.01Å; L684-L697 HydrophobicContact CD1-CD1 3.61Å; L689-L697 HydrophobicContact CD1-CD1 4.47Å; G693-L697 WeakPolarHBondContact O-CG 3.38Å; G693-L697 PolarHBondContact O-N 3.36Å; L694-L697 PolarHBondContact O-N 3.32Å; L697-S699 PolarHBondContact O-N 2.97Å; L697-L700 HydrophobicContact CD2-CD1 4.17Å; L697-L700 WeakPolarHBondContact O-CB 3.26Å; L697-L700 WeakPolarHBondContact O-CG 3.34Å; L697-L700 PolarHBondContact O-N 3.02Å; L697-L706 HydrophobicContact CD1-CD1 4.12Å; L697-F722 HydrophobicContact CB-CD2 4.41Å; L697-F722 HydrophobicContact CB-CE2 4.37Å
698	G	94.8	Very high	96.5	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.01	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-23.2	176	0	0	0	0	0	113.1	S695 A696 L700 F722 L725 G726	S695-G698 PolarHBondContact O-N 3.44Å; A696-G698 PolarHBondContact O-N 2.84Å; G698-L700 PolarHBondContact O-N 3.1Å; G698-F722 VanDerWaalsContact CA-CD2 3.45Å; G698-L725 VanDerWaalsContact C-CB 3.45Å; G698-L725 CarbonylContact O-C 3.57Å; G698-L725 WeakPolarHBondContact O-CB 3.5Å; G698-G726 PolarHBondContact O-N 3.29Å
699	S	93.9	Very high	96.6	Very high	60 Å²	60	32.6 Å²	32.6	42%	0.42	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-10.6	178.8	68.9	0	0	0	0	114.2	A696 L697 P701	A696-S699 WeakPolarHBondContact O-CB 3.46Å; A696-S699 PolarHBondContact O-N 3.02Å; A696-S699 PolarHBondContact O-OG 2.67Å; L697-S699 PolarHBondContact O-N 2.97Å; S699-P701 WeakPolarHBondContact O-CD 3.12Å
700	L	96.5	Very high	96.4	Very high	6 Å²	6	34.6 Å²	34.6	3%	0.031	17%	0.17	C	C	.	.			trans	-73.3	113.5	-177.1	-70	171.7	0	0	0	111.5	L676 L679 I682 L697 G698 K702 L703	L676-L700 VanDerWaalsContact O-CD2 3.32Å; L676-L700 WeakPolarHBondContact O-CD2 3.34Å; L679-L700 HydrophobicContact CB-CD1 4.33Å; I682-L700 HydrophobicContact CD1-CD1 3.42Å; I682-L700 VanDerWaalsContact CD1-CD1 3.42Å; L697-L700 HydrophobicContact CD2-CD1 4.17Å; L697-L700 WeakPolarHBondContact O-CB 3.26Å; L697-L700 WeakPolarHBondContact O-CG 3.34Å; L697-L700 PolarHBondContact O-N 3.02Å; G698-L700 PolarHBondContact O-N 3.1Å; L700-K702 VanDerWaalsContact C-N 3.28Å; L700-K702 PolarHBondContact O-N 3.47Å; L700-L703 HydrophobicContact CB-CB 3.86Å; L700-L703 PolarHBondContact O-N 2.93Å
701	P	94	Very high	96.3	Very high	66 Å²	66	34.3 Å²	34.3	43%	0.429	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-25.6	-170.1	27.3	-35.4	0	0	0	113.3	Q677 S699 R704 N728	Q677-P701 HydrophobicContact CB-CG 4.45Å; S699-P701 WeakPolarHBondContact O-CD 3.12Å; P701-R704 PolarHBondContact O-NH1 3.37Å; P701-N728 PolarHBondContact O-ND2 3.32Å
702	K	96.4	Very high	96	Very high	105 Å²	105	36.3 Å²	36.3	46%	0.457	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-5	-178.1	-66.1	-161.6	-174.3	-177.7	0	114.1	L679 W680 L700 R704	L679-K702 CarbonylContact O-C 3.56Å; L679-K702 WeakPolarHBondContact O-CB 3.17Å; W680-K702 VanDerWaalsContact CA-O 3.25Å; W680-K702 WeakPolarHBondContact CA-O 3.27Å; W680-K702 HydrophobicContact CB-CB 4.4Å; W680-K702 VanDerWaalsContact CB-O 3.26Å; W680-K702 WeakPolarHBondContact CB-O 3.31Å; L700-K702 VanDerWaalsContact C-N 3.28Å; L700-K702 PolarHBondContact O-N 3.47Å; K702-R704 PolarHBondContact O-N 3.2Å; K702-R704 PolarHBondContact O-NH1 3.18Å; K702-R704 VanDerWaalsContact O-NH1 3.1Å
703	L	97.6	Very high	96	Very high	6 Å²	6	29.9 Å²	29.9	3%	0.031	17%	0.168	C	C	.	.			trans	-59.2	126.6	-179.4	-168.2	66.8	0	0	0	110.2	L679 I682 L700 E705 L706 F722 L729	L679-L703 PolarHBondContact O-N 2.89Å; I682-L703 HydrophobicContact CB-CD1 4.46Å; I682-L703 HydrophobicContact CD1-CD1 3.97Å; I682-L703 HydrophobicContact CG1-CD1 3.86Å; L700-L703 HydrophobicContact CB-CB 3.86Å; L700-L703 PolarHBondContact O-N 2.93Å; L703-E705 WeakPolarHBondContact CD1-O 3.43Å; L703-L706 HydrophobicContact CD2-CB 4.46Å; L703-F722 HydrophobicContact CD2-CE2 3.85Å; L703-F722 HydrophobicContact CD2-CZ 4.16Å; L703-L729 HydrophobicContact CD2-CD1 4.38Å; L703-L729 HydrophobicContact CG-CD1 4.16Å
704	R	97.7	Very high	96	Very high	71 Å²	71	29.9 Å²	29.9	27%	0.268	17%	0.168	S	C	.	.			trans	-125	-31.8	175.8	-59.9	-58.1	-175.5	-93.8	1.5	111.3	W680 P701 K702 N728 L729 E730 Y731	W680-R704 HydrophobicContact CE3-CB 4.18Å; W680-R704 PolarHBondContact O-N 2.89Å; P701-R704 PolarHBondContact O-NH1 3.37Å; K702-R704 PolarHBondContact O-N 3.2Å; K702-R704 PolarHBondContact O-NH1 3.18Å; K702-R704 VanDerWaalsContact O-NH1 3.1Å; R704-N728 WeakPolarHBondContact CD-O 3.48Å; R704-L729 WeakPolarHBondContact O-CD1 3.48Å; R704-E730 HydrophobicContact CB-CB 4.44Å; R704-E730 HydrophobicContact CB-CG 4.45Å; R704-E730 WeakPolarHBondContact CD-OE1 3.37Å; R704-E730 IonicContact NE-OE1 3.73Å; R704-E730 WeakPolarHBondContact O-CA 2.95Å; R704-E730 PolarHBondContact O-N 3.39Å; R704-Y731 PolarHBondContact O-N 3.26Å
705	E	98.1	Very high	96	Very high	50 Å²	50	32.1 Å²	32.1	23%	0.234	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	126.6	-178.9	-55.2	-159.2	-174.7	0	0	111.7	W680 Q681 I682 L703 Y731	W680-E705 HydrophobicContact CE3-CG 4.4Å; W680-E705 HydrophobicContact CZ3-CG 3.87Å; W680-E705 PolarHBondContact O-N 3.29Å; Q681-E705 WeakPolarHBondContact CA-O 3.38Å; Q681-E705 HydrophobicContact CB-CB 4.13Å; Q681-E705 HydrophobicContact CG-CB 3.84Å; Q681-E705 PolarHBondContact NE2-OE2 3.36Å; I682-E705 PolarHBondContact N-O 3.13Å; L703-E705 WeakPolarHBondContact CD1-O 3.43Å; E705-Y731 WeakPolarHBondContact CA-O 3.41Å; E705-Y731 HydrophobicContact CB-CD1 4.41Å; E705-Y731 HydrophobicContact CG-CG 4.46Å
706	L	98.1	Very high	96	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	122.6	177.4	179	63.2	0	0	0	110.4	I682 L694 L697 L703 V708 F722 L729 Y731 I732 D733	I682-L706 HydrophobicContact CB-CD1 4.21Å; L694-L706 HydrophobicContact CD1-CD2 3.75Å; L697-L706 HydrophobicContact CD1-CD1 4.12Å; L703-L706 HydrophobicContact CD2-CB 4.46Å; L706-V708 HydrophobicContact CD1-CG1 3.67Å; L706-V708 HydrophobicContact CD2-CG1 4.14Å; L706-V708 HydrophobicContact CG-CG1 3.78Å; L706-V708 HydrophobicContact CG-CG2 4.47Å; L706-F722 HydrophobicContact CD2-CD2 4.36Å; L706-F722 HydrophobicContact CD2-CE1 4.17Å; L706-F722 HydrophobicContact CD2-CE2 3.62Å; L706-F722 HydrophobicContact CD2-CZ 3.5Å; L706-L729 HydrophobicContact CB-CD1 4.09Å; L706-Y731 PolarHBondContact N-O 3.28Å; L706-I732 HydrophobicContact CB-CG1 4.49Å; L706-I732 WeakPolarHBondContact O-CA 3.41Å; L706-D733 PolarHBondContact O-N 3.36Å
707	K	97.6	Very high	96.1	Very high	33 Å²	33	35 Å²	35	14%	0.143	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	114.2	174.2	-57.8	-177.3	174.5	-168.9	0	109.8	I682 N683 L684 N685 Y731 D733 N853	I682-K707 PolarHBondContact O-N 2.95Å; N683-K707 HydrophobicContact CB-CB 4.24Å; N683-K707 HydrophobicContact CB-CD 4.37Å; L684-K707 PolarHBondContact N-O 3.38Å; N685-K707 PolarHBondContact N-O 3.37Å; N685-K707 WeakPolarHBondContact OD1-CB 3.24Å; N685-K707 PolarHBondContact OD1-O 2.88Å; K707-Y731 HydrophobicContact CG-CE1 3.88Å; K707-D733 HydrophobicContact CB-CB 4.38Å; K707-D733 HydrophobicContact CG-CB 4.37Å; K707-N853 PolarHBondContact NZ-OD1 2.95Å
708	V	96.9	Very high	96.1	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.191	C	C	.	.			trans	-136.6	29.9	-177	-67	0	0	0	0	111.6	L684 N685 L689 L706 R710 C711 I714 D733 L734 C737	L684-V708 HydrophobicContact CB-CG1 4.33Å; N685-V708 PolarHBondContact OD1-N 2.96Å; N685-V708 VanDerWaalsContact OD1-N 3.1Å; L689-V708 HydrophobicContact CD2-CB 3.98Å; L689-V708 HydrophobicContact CD2-CG1 3.33Å; L706-V708 HydrophobicContact CD1-CG1 3.67Å; L706-V708 HydrophobicContact CD2-CG1 4.14Å; L706-V708 HydrophobicContact CG-CG1 3.78Å; L706-V708 HydrophobicContact CG-CG2 4.47Å; V708-R710 PolarHBondContact O-N 3.26Å; V708-C711 HydrophobicContact CB-CB 4.45Å; V708-C711 VanDerWaalsContact O-CB 3.31Å; V708-C711 WeakPolarHBondContact O-CB 3.08Å; V708-C711 PolarHBondContact O-N 3.07Å; V708-C711 PolarHBondContact O-SG 3.19Å; V708-I714 HydrophobicContact CB-CD1 4.06Å; V708-I714 HydrophobicContact CG2-CD1 4.04Å; V708-D733 CarbonylContact C-O 3.45Å; V708-D733 VanDerWaalsContact CG2-O 3.28Å; V708-D733 WeakPolarHBondContact CG2-O 3.5Å; V708-D733 PolarHBondContact N-O 3Å; V708-L734 HydrophobicContact CG2-CD2 3.63Å; V708-L734 HydrophobicContact CG2-CG 4.49Å; V708-C737 PolarHBondContact O-SG 3.42Å; V708-C737 VanDerWaalsContact O-SG 3.39Å
709	S	94.6	Very high	96.3	Very high	3 Å²	3	35 Å²	35	2%	0.021	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	138	175.6	-178.3	0	0	0	0	110.8	N685 S686 C711 D733 S735	N685-S709 CarbonylContact C-O 3.42Å; N685-S709 VanDerWaalsContact CA-O 3.32Å; N685-S709 WeakPolarHBondContact CA-O 3.4Å; N685-S709 WeakPolarHBondContact OD1-CB 3.38Å; N685-S709 PolarHBondContact OD1-N 2.84Å; S686-S709 PolarHBondContact N-O 3.18Å; S709-C711 PolarHBondContact O-N 3.05Å; S709-D733 PolarHBondContact N-O 2.98Å; S709-S735 CarbonylContact C-O 3.35Å; S709-S735 WeakPolarHBondContact CA-O 3.48Å; S709-S735 VanDerWaalsContact CB-OG 3.27Å; S709-S735 WeakPolarHBondContact CB-OG 3.27Å; S709-S735 PolarHBondContact OG-O 3.25Å; S709-S735 VanDerWaalsContact OG-O 3.1Å; S709-S735 PolarHBondContact OG-OG 3.23Å
710	R	92.7	Very high	96.4	Very high	43 Å²	43	34.9 Å²	34.9	16%	0.162	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	21.4	179.4	-57.1	168.8	-177	-153.8	-4	115.4	S686 V708 T712 S735 F736 I846	S686-R710 WeakPolarHBondContact OG-CD 3.36Å; V708-R710 PolarHBondContact O-N 3.26Å; R710-T712 VanDerWaalsContact C-N 3.27Å; R710-T712 PolarHBondContact O-N 3.09Å; R710-T712 VanDerWaalsContact O-N 3.09Å; R710-S735 PolarHBondContact N-O 2.97Å; R710-F736 HydrophobicContact CB-CB 4.43Å; R710-F736 HydrophobicContact CG-CB 3.54Å; R710-F736 HydrophobicContact CG-CD2 4.24Å; R710-F736 HydrophobicContact CG-CG 4.07Å; R710-I846 PolarHBondContact NH1-O 3.33Å; R710-I846 PolarHBondContact NH2-O 3.32Å
711	C	95	Very high	96.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.204	C	C	.	.			trans	-83.1	78.9	167.5	-62.2	0	0	0	0	108.4	L684 L689 V708 S709 A713 I714	L684-C711 PolarHBondContact O-SG 2.96Å; L689-C711 HydrophobicContact CB-CB 4.04Å; V708-C711 HydrophobicContact CB-CB 4.45Å; V708-C711 VanDerWaalsContact O-CB 3.31Å; V708-C711 WeakPolarHBondContact O-CB 3.08Å; V708-C711 PolarHBondContact O-N 3.07Å; V708-C711 PolarHBondContact O-SG 3.19Å; S709-C711 PolarHBondContact O-N 3.05Å; C711-A713 PolarHBondContact O-N 3.32Å; C711-A713 VanDerWaalsContact O-N 3.16Å; C711-I714 HydrophobicContact CB-CD1 3.4Å; C711-I714 HydrophobicContact CB-CG1 3.91Å; C711-I714 WeakPolarHBondContact O-CB 3.49Å; C711-I714 WeakPolarHBondContact O-CG1 3.23Å; C711-I714 PolarHBondContact O-N 3.08Å; C711-I714 VanDerWaalsContact O-N 3.12Å
712	T	92.2	Very high	96.6	Very high	78 Å²	78	36.6 Å²	36.6	48%	0.479	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-16.5	-168.1	55.4	0	0	0	0	114.3	R710 I714 N739	R710-T712 VanDerWaalsContact C-N 3.27Å; R710-T712 PolarHBondContact O-N 3.09Å; R710-T712 VanDerWaalsContact O-N 3.09Å; T712-I714 VanDerWaalsContact C-N 3.26Å; T712-I714 PolarHBondContact O-N 2.84Å; T712-N739 PolarHBondContact O-ND2 2.62Å
713	A	95.1	Very high	96.6	Very high	54 Å²	54	31.6 Å²	31.6	45%	0.446	16%	0.162	S	C	.	.	B	Isolated β-bridge	trans	-77.9	-8.6	175.8	0	0	0	0	0	113.5	C711	C711-A713 PolarHBondContact O-N 3.32Å; C711-A713 VanDerWaalsContact O-N 3.16Å
714	I	97.1	Very high	96.5	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.186	C	C	.	.			trans	-73	126.7	175.5	-61.8	170.8	0	0	0	109.8	L689 L694 V708 C711 T712 N739 L740	L689-I714 HydrophobicContact CD2-CD1 4.08Å; L689-I714 HydrophobicContact CG-CD1 4.43Å; L694-I714 HydrophobicContact CD2-CB 4.44Å; L694-I714 HydrophobicContact CD2-CD1 4Å; L694-I714 HydrophobicContact CD2-CG1 4.09Å; L694-I714 HydrophobicContact CD2-CG2 3.5Å; L694-I714 VanDerWaalsContact CD2-CG2 3.5Å; V708-I714 HydrophobicContact CB-CD1 4.06Å; V708-I714 HydrophobicContact CG2-CD1 4.04Å; C711-I714 HydrophobicContact CB-CD1 3.4Å; C711-I714 HydrophobicContact CB-CG1 3.91Å; C711-I714 WeakPolarHBondContact O-CB 3.49Å; C711-I714 WeakPolarHBondContact O-CG1 3.23Å; C711-I714 PolarHBondContact O-N 3.08Å; C711-I714 VanDerWaalsContact O-N 3.12Å; T712-I714 VanDerWaalsContact C-N 3.26Å; T712-I714 PolarHBondContact O-N 2.84Å; I714-N739 WeakPolarHBondContact O-CB 3.5Å; I714-L740 HydrophobicContact CG2-CD2 4.03Å
715	T	97.7	Very high	96.3	Very high	47 Å²	47	38.2 Å²	38.2	29%	0.288	20%	0.198	S	C	.	.			trans	-113.7	176.5	171.7	81.1	0	0	0	0	111	D691 L717 G718 L719 N739	D691-T715 PolarHBondContact OD1-N 3.05Å; D691-T715 PolarHBondContact OD1-OG1 2.99Å; D691-T715 PolarHBondContact OD2-OG1 2.84Å; T715-L717 PolarHBondContact O-N 2.77Å; T715-L717 PolarHBondContact OG1-N 3.19Å; T715-G718 PolarHBondContact O-N 3.15Å; T715-L719 PolarHBondContact O-N 3.33Å; T715-N739 HydrophobicContact CG2-CB 4.4Å
716	D	98	Very high	95.9	Very high	22 Å²	22	36.1 Å²	36.1	12%	0.118	19%	0.191	C	C	.	.	H	α-helix	trans	-55.7	-32.3	173.7	-70.3	-21.3	0	0	0	112.6	Q720 T741 G744	D716-Q720 VanDerWaalsContact O-CB 3.23Å; D716-Q720 WeakPolarHBondContact O-CB 3.33Å; D716-Q720 WeakPolarHBondContact O-CG 3.38Å; D716-Q720 PolarHBondContact O-N 2.85Å; D716-Q720 PolarHBondContact O-NE2 3.22Å; D716-T741 PolarHBondContact OD1-N 3.29Å; D716-T741 WeakPolarHBondContact OD2-CB 3.46Å; D716-T741 PolarHBondContact OD2-OG1 2.59Å; D716-G744 VanDerWaalsContact OD1-CA 3.28Å; D716-G744 WeakPolarHBondContact OD1-CA 3.48Å; D716-G744 PolarHBondContact OD1-N 3.16Å; D716-G744 VanDerWaalsContact OD1-N 3.11Å
717	L	97.3	Very high	95.6	Very high	90 Å²	90	40.4 Å²	40.4	47%	0.471	21%	0.212	S	C	.	.	H	α-helix	trans	-66.5	-46.1	-178.5	-179.3	64.2	0	0	0	111.8	T715 Q720 K721	T715-L717 PolarHBondContact O-N 2.77Å; T715-L717 PolarHBondContact OG1-N 3.19Å; L717-Q720 PolarHBondContact O-N 3.28Å; L717-K721 WeakPolarHBondContact O-CG 3.41Å; L717-K721 PolarHBondContact O-N 3.37Å
718	G	97	Very high	95.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-63.4	-45.8	176.4	0	0	0	0	0	111.6	D691 T715 Q720 K721 F722	D691-G718 VanDerWaalsContact CG-N 3.32Å; D691-G718 VanDerWaalsContact OD1-CA 3.26Å; D691-G718 WeakPolarHBondContact OD1-CA 3.1Å; D691-G718 PolarHBondContact OD1-N 2.92Å; T715-G718 PolarHBondContact O-N 3.15Å; G718-Q720 VanDerWaalsContact C-N 3.33Å; G718-Q720 PolarHBondContact O-N 3.19Å; G718-K721 PolarHBondContact O-N 3.12Å; G718-F722 WeakPolarHBondContact O-CB 3.22Å; G718-F722 PolarHBondContact O-N 3.48Å
719	L	98	Very high	95.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-63.4	-39.3	178.6	-175	60.9	0	0	0	112	L694 T715 F722 A723 I732 L734 L740 I745 L748	L694-L719 HydrophobicContact CD2-CB 4.4Å; L694-L719 HydrophobicContact CD2-CD1 4.48Å; T715-L719 PolarHBondContact O-N 3.33Å; L719-F722 HydrophobicContact CD1-CD1 4.2Å; L719-A723 VanDerWaalsContact O-CB 3.23Å; L719-A723 WeakPolarHBondContact O-CB 3.25Å; L719-A723 PolarHBondContact O-N 3.26Å; L719-I732 HydrophobicContact CD1-CD1 4.3Å; L719-L734 HydrophobicContact CD1-CD1 4.06Å; L719-L734 HydrophobicContact CD1-CD2 4.22Å; L719-L734 HydrophobicContact CD2-CD1 3.91Å; L719-L740 HydrophobicContact CB-CD2 4.1Å; L719-L740 HydrophobicContact CD2-CD1 4.2Å; L719-L740 HydrophobicContact CD2-CD2 3.76Å; L719-I745 HydrophobicContact CD2-CD1 4.19Å; L719-L748 HydrophobicContact CD1-CD1 4.24Å; L719-L748 HydrophobicContact CD2-CB 4.42Å
720	Q	97.6	Very high	95.5	Very high	58 Å²	58	45.3 Å²	45.3	27%	0.271	24%	0.238	S	C	.	.	H	α-helix	trans	-59.4	-55.2	174.2	-79.4	171.4	40.3	0	0	111	D716 L717 G718 F722 A723 H724 T747	D716-Q720 VanDerWaalsContact O-CB 3.23Å; D716-Q720 WeakPolarHBondContact O-CB 3.33Å; D716-Q720 WeakPolarHBondContact O-CG 3.38Å; D716-Q720 PolarHBondContact O-N 2.85Å; D716-Q720 PolarHBondContact O-NE2 3.22Å; L717-Q720 PolarHBondContact O-N 3.28Å; G718-Q720 VanDerWaalsContact C-N 3.33Å; G718-Q720 PolarHBondContact O-N 3.19Å; Q720-F722 VanDerWaalsContact C-N 3.29Å; Q720-F722 PolarHBondContact O-N 3.3Å; Q720-A723 PolarHBondContact O-N 3.05Å; Q720-A723 VanDerWaalsContact O-N 3.16Å; Q720-H724 PolarHBondContact O-N 3.45Å; Q720-H724 VanDerWaalsContact O-N 3.11Å; Q720-H724 PolarHBondContact O-ND1 3.46Å; Q720-T747 HydrophobicContact CB-CG2 4.13Å; Q720-T747 HydrophobicContact CG-CG2 3.89Å; Q720-T747 WeakPolarHBondContact CG-OG1 3.31Å
721	K	96.8	Very high	95.7	Very high	108 Å²	108	45.3 Å²	45.3	47%	0.47	24%	0.238	S	C	.	.	H	α-helix	trans	-59.9	-41.7	-178.5	-70.8	179.3	177	-179	0	112.1	S695 L717 G718	S695-K721 VanDerWaalsContact OG-CB 3.3Å; S695-K721 WeakPolarHBondContact OG-CB 3.48Å; L717-K721 WeakPolarHBondContact O-CG 3.41Å; L717-K721 PolarHBondContact O-N 3.37Å; G718-K721 PolarHBondContact O-N 3.12Å
722	F	97.6	Very high	95.8	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-57.9	-52.4	172.8	166.9	-96	0	0	0	111.9	L694 L697 G698 L703 L706 G718 L719 Q720 H724 L725 G726 L729 I732	L694-F722 HydrophobicContact CD1-CB 4.43Å; L694-F722 HydrophobicContact CD1-CD2 4.1Å; L694-F722 HydrophobicContact CD1-CG 4.14Å; L694-F722 HydrophobicContact CD2-CB 4.47Å; L694-F722 HydrophobicContact CG-CB 3.92Å; L694-F722 HydrophobicContact CG-CD2 4.43Å; L694-F722 HydrophobicContact CG-CG 4.18Å; L694-F722 VanDerWaalsContact O-CD2 3.31Å; L694-F722 WeakPolarHBondContact O-CD2 3.4Å; L697-F722 HydrophobicContact CB-CD2 4.41Å; L697-F722 HydrophobicContact CB-CE2 4.37Å; G698-F722 VanDerWaalsContact CA-CD2 3.45Å; L703-F722 HydrophobicContact CD2-CE2 3.85Å; L703-F722 HydrophobicContact CD2-CZ 4.16Å; L706-F722 HydrophobicContact CD2-CD2 4.36Å; L706-F722 HydrophobicContact CD2-CE1 4.17Å; L706-F722 HydrophobicContact CD2-CE2 3.62Å; L706-F722 HydrophobicContact CD2-CZ 3.5Å; G718-F722 WeakPolarHBondContact O-CB 3.22Å; G718-F722 PolarHBondContact O-N 3.48Å; L719-F722 HydrophobicContact CD1-CD1 4.2Å; Q720-F722 VanDerWaalsContact C-N 3.29Å; Q720-F722 PolarHBondContact O-N 3.3Å; F722-H724 VanDerWaalsContact C-N 3.29Å; F722-H724 PolarHBondContact O-N 3.19Å; F722-L725 PolarHBondContact O-N 3.29Å; F722-G726 PolarHBondContact O-N 2.94Å; F722-L729 HydrophobicContact CE1-CD2 3.74Å; F722-L729 HydrophobicContact CZ-CD1 4.29Å; F722-L729 HydrophobicContact CZ-CD2 3.84Å; F722-I732 HydrophobicContact CE1-CD1 4.22Å
723	A	96.2	Very high	96.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.7	-35.9	-174.1	0	0	0	0	0	112.8	L719 Q720 L725 T747 L748 C751	L719-A723 VanDerWaalsContact O-CB 3.23Å; L719-A723 WeakPolarHBondContact O-CB 3.25Å; L719-A723 PolarHBondContact O-N 3.26Å; Q720-A723 PolarHBondContact O-N 3.05Å; Q720-A723 VanDerWaalsContact O-N 3.16Å; A723-L725 PolarHBondContact O-N 3.39Å; A723-T747 HydrophobicContact CB-CG2 4.22Å; A723-L748 HydrophobicContact CB-CD1 4.45Å; A723-C751 HydrophobicContact CB-CB 4.04Å; A723-C751 WeakPolarHBondContact O-CB 3.22Å
724	H	94.9	Very high	96.2	Very high	115 Å²	115	39.1 Å²	39.1	53%	0.532	19%	0.194	S	C	.	.	H	α-helix	trans	-60.7	-26.4	177.1	-75.7	90.1	0	0	0	113.5	Q720 F722 T747	Q720-H724 PolarHBondContact O-N 3.45Å; Q720-H724 VanDerWaalsContact O-N 3.11Å; Q720-H724 PolarHBondContact O-ND1 3.46Å; F722-H724 VanDerWaalsContact C-N 3.29Å; F722-H724 PolarHBondContact O-N 3.19Å; H724-T747 VanDerWaalsContact CE1-CG2 3.46Å; H724-T747 WeakPolarHBondContact CE1-CG2 3.32Å
725	L	93.1	Very high	96.1	Very high	101 Å²	101	39.1 Å²	39.1	53%	0.529	19%	0.194	S	C	.	.	H	α-helix	trans	-102.8	-38.7	179.8	-58	177.3	0	0	0	112	G698 F722 A723 I727	G698-L725 VanDerWaalsContact C-CB 3.45Å; G698-L725 CarbonylContact O-C 3.57Å; G698-L725 WeakPolarHBondContact O-CB 3.5Å; F722-L725 PolarHBondContact O-N 3.29Å; A723-L725 PolarHBondContact O-N 3.39Å; L725-I727 PolarHBondContact O-N 2.69Å
726	G	90.9	Very high	95.9	Very high	7 Å²	7	38.5 Å²	38.5	7%	0.072	19%	0.188	C	C	.	.			trans	-76.3	44.9	-177.1	0	0	0	0	0	114.9	G698 F722 N728 L729 C752	G698-G726 PolarHBondContact O-N 3.29Å; F722-G726 PolarHBondContact O-N 2.94Å; G726-N728 PolarHBondContact O-N 2.91Å; G726-N728 VanDerWaalsContact O-N 3.15Å; G726-L729 WeakPolarHBondContact O-CB 3.31Å; G726-L729 PolarHBondContact O-N 2.82Å; G726-C752 PolarHBondContact O-SG 3.3Å
727	I	90.9	Very high	95.7	Very high	89 Å²	89	37.5 Å²	37.5	46%	0.456	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-20.7	-170.7	60.4	171.2	0	0	0	114.7	L725	L725-I727 PolarHBondContact O-N 2.69Å
728	N	92.3	Very high	95.4	Very high	58 Å²	58	36.6 Å²	36.6	31%	0.31	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	7.9	-177.1	-66.4	-42	0	0	0	113.6	P701 R704 G726 E730	P701-N728 PolarHBondContact O-ND2 3.32Å; R704-N728 WeakPolarHBondContact CD-O 3.48Å; G726-N728 PolarHBondContact O-N 2.91Å; G726-N728 VanDerWaalsContact O-N 3.15Å; N728-E730 PolarHBondContact O-N 2.98Å
729	L	96.7	Very high	95.4	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	20%	0.197	C	C	.	.			trans	-66.2	133.9	-175.9	-163	73.7	0	0	0	111.9	L703 R704 L706 F722 G726 I732 C752 F754 L755	L703-L729 HydrophobicContact CD2-CD1 4.38Å; L703-L729 HydrophobicContact CG-CD1 4.16Å; R704-L729 WeakPolarHBondContact O-CD1 3.48Å; L706-L729 HydrophobicContact CB-CD1 4.09Å; F722-L729 HydrophobicContact CE1-CD2 3.74Å; F722-L729 HydrophobicContact CZ-CD1 4.29Å; F722-L729 HydrophobicContact CZ-CD2 3.84Å; G726-L729 WeakPolarHBondContact O-CB 3.31Å; G726-L729 PolarHBondContact O-N 2.82Å; L729-I732 HydrophobicContact CD2-CB 3.77Å; L729-I732 HydrophobicContact CD2-CD1 3.79Å; L729-I732 HydrophobicContact CD2-CG1 4.02Å; L729-C752 HydrophobicContact CB-CB 4.32Å; L729-F754 CarbonylContact O-C 3.4Å; L729-L755 HydrophobicContact CD2-CD2 4.2Å; L729-L755 HydrophobicContact CG-CD2 4.23Å; L729-L755 PolarHBondContact O-N 3.12Å
730	E	97.6	Very high	95.3	Very high	81 Å²	81	40.6 Å²	40.6	38%	0.379	20%	0.197	S	C	.	.			trans	-114	-31.3	-177.9	-66.6	178.2	-158.9	0	0	112.2	R704 N728 T756 S757	R704-E730 HydrophobicContact CB-CB 4.44Å; R704-E730 HydrophobicContact CB-CG 4.45Å; R704-E730 WeakPolarHBondContact CD-OE1 3.37Å; R704-E730 IonicContact NE-OE1 3.73Å; R704-E730 WeakPolarHBondContact O-CA 2.95Å; R704-E730 PolarHBondContact O-N 3.39Å; N728-E730 PolarHBondContact O-N 2.98Å; E730-T756 PolarHBondContact O-N 3.5Å; E730-T756 PolarHBondContact O-OG1 2.74Å; E730-S757 PolarHBondContact O-N 2.72Å; E730-S757 VanDerWaalsContact O-N 3.14Å
731	Y	98.2	Very high	95.3	Very high	43 Å²	43	39.8 Å²	39.8	17%	0.169	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	134.6	177.5	179.6	-76.2	0	0	0	110.3	R704 E705 L706 K707 D733 S757	R704-Y731 PolarHBondContact O-N 3.26Å; E705-Y731 WeakPolarHBondContact CA-O 3.41Å; E705-Y731 HydrophobicContact CB-CD1 4.41Å; E705-Y731 HydrophobicContact CG-CG 4.46Å; L706-Y731 PolarHBondContact N-O 3.28Å; K707-Y731 HydrophobicContact CG-CE1 3.88Å; Y731-D733 HydrophobicContact CE1-CB 3.87Å; Y731-S757 WeakPolarHBondContact CA-O 3.44Å; Y731-S757 WeakPolarHBondContact CD2-OG 3.1Å; Y731-S757 VanDerWaalsContact CE2-OG 3.25Å; Y731-S757 WeakPolarHBondContact CE2-OG 3.16Å
732	I	97.7	Very high	95.3	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	133.2	169.6	-160.2	175.9	0	0	0	112.2	L706 L719 F722 L729 L734 L748 L755 S757 I758 N759	L706-I732 HydrophobicContact CB-CG1 4.49Å; L706-I732 WeakPolarHBondContact O-CA 3.41Å; L719-I732 HydrophobicContact CD1-CD1 4.3Å; F722-I732 HydrophobicContact CE1-CD1 4.22Å; L729-I732 HydrophobicContact CD2-CB 3.77Å; L729-I732 HydrophobicContact CD2-CD1 3.79Å; L729-I732 HydrophobicContact CD2-CG1 4.02Å; I732-L734 HydrophobicContact CD1-CD1 3.73Å; I732-L734 HydrophobicContact CD1-CD2 4.08Å; I732-L734 HydrophobicContact CD1-CG 3.79Å; I732-L734 HydrophobicContact CG1-CD1 4.3Å; I732-L734 HydrophobicContact CG1-CD2 4.5Å; I732-L734 HydrophobicContact CG1-CG 3.97Å; I732-L748 HydrophobicContact CD1-CD1 4.03Å; I732-L748 HydrophobicContact CD1-CD2 4.36Å; I732-L748 HydrophobicContact CG2-CD2 4.16Å; I732-L755 HydrophobicContact CB-CD2 4.33Å; I732-L755 HydrophobicContact CG2-CD2 3.94Å; I732-S757 PolarHBondContact N-O 3.43Å; I732-S757 VanDerWaalsContact N-O 3.1Å; I732-I758 HydrophobicContact CG2-CG1 4.26Å; I732-I758 HydrophobicContact CG2-CG2 4.42Å; I732-N759 PolarHBondContact O-N 2.6Å
733	D	97.5	Very high	95.1	Very high	1 Å²	1	40.2 Å²	40.2	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	106.7	169.2	-170.4	-10	0	0	0	110.4	L706 K707 V708 S709 Y731 S735 N759	L706-D733 PolarHBondContact O-N 3.36Å; K707-D733 HydrophobicContact CB-CB 4.38Å; K707-D733 HydrophobicContact CG-CB 4.37Å; V708-D733 CarbonylContact C-O 3.45Å; V708-D733 VanDerWaalsContact CG2-O 3.28Å; V708-D733 WeakPolarHBondContact CG2-O 3.5Å; V708-D733 PolarHBondContact N-O 3Å; S709-D733 PolarHBondContact N-O 2.98Å; Y731-D733 HydrophobicContact CE1-CB 3.87Å; D733-S735 VanDerWaalsContact OD1-CB 3.23Å; D733-S735 WeakPolarHBondContact OD1-CB 3.49Å; D733-S735 PolarHBondContact OD1-N 3.21Å; D733-S735 PolarHBondContact OD1-OG 3Å; D733-N759 HydrophobicContact CB-CB 4.2Å; D733-N759 PolarHBondContact OD1-ND2 3.32Å; D733-N759 PolarHBondContact OD2-ND2 2.79Å
734	L	97.2	Very high	95.1	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.203	C	C	.	.			trans	-110.2	14.4	176.6	-70.2	165.3	0	0	0	111.2	V708 L719 I732 F736 C737 L740 I745 L748 N759 L760 C763	V708-L734 HydrophobicContact CG2-CD2 3.63Å; V708-L734 HydrophobicContact CG2-CG 4.49Å; L719-L734 HydrophobicContact CD1-CD1 4.06Å; L719-L734 HydrophobicContact CD1-CD2 4.22Å; L719-L734 HydrophobicContact CD2-CD1 3.91Å; I732-L734 HydrophobicContact CD1-CD1 3.73Å; I732-L734 HydrophobicContact CD1-CD2 4.08Å; I732-L734 HydrophobicContact CD1-CG 3.79Å; I732-L734 HydrophobicContact CG1-CD1 4.3Å; I732-L734 HydrophobicContact CG1-CD2 4.5Å; I732-L734 HydrophobicContact CG1-CG 3.97Å; L734-F736 PolarHBondContact O-N 3.25Å; L734-C737 VanDerWaalsContact O-CB 3.23Å; L734-C737 WeakPolarHBondContact O-CB 3.24Å; L734-C737 PolarHBondContact O-N 3.23Å; L734-C737 VanDerWaalsContact O-N 3.13Å; L734-C737 PolarHBondContact O-SG 2.76Å; L734-L740 HydrophobicContact CB-CD1 3.95Å; L734-L740 HydrophobicContact CD1-CD1 4.02Å; L734-L740 HydrophobicContact CD2-CD1 3.96Å; L734-L740 HydrophobicContact CG-CD1 4.2Å; L734-I745 HydrophobicContact CD1-CD1 4.39Å; L734-L748 HydrophobicContact CD1-CD2 3.85Å; L734-N759 PolarHBondContact N-O 3.39Å; L734-L760 HydrophobicContact CB-CD2 3.9Å; L734-L760 HydrophobicContact CD1-CD2 4.02Å; L734-C763 PolarHBondContact O-SG 3.17Å
735	S	94.3	Very high	95.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	141.9	-176.4	56.8	0	0	0	0	111.7	S709 R710 D733 C737 N759 A761	S709-S735 CarbonylContact C-O 3.35Å; S709-S735 WeakPolarHBondContact CA-O 3.48Å; S709-S735 VanDerWaalsContact CB-OG 3.27Å; S709-S735 WeakPolarHBondContact CB-OG 3.27Å; S709-S735 PolarHBondContact OG-O 3.25Å; S709-S735 VanDerWaalsContact OG-O 3.1Å; S709-S735 PolarHBondContact OG-OG 3.23Å; R710-S735 PolarHBondContact N-O 2.97Å; D733-S735 VanDerWaalsContact OD1-CB 3.23Å; D733-S735 WeakPolarHBondContact OD1-CB 3.49Å; D733-S735 PolarHBondContact OD1-N 3.21Å; D733-S735 PolarHBondContact OD1-OG 3Å; S735-C737 PolarHBondContact O-N 3.24Å; S735-C737 VanDerWaalsContact O-N 3.16Å; S735-N759 PolarHBondContact N-O 3.33Å; S735-A761 CarbonylContact C-O 3.38Å; S735-A761 WeakPolarHBondContact CA-O 3.46Å; S735-A761 VanDerWaalsContact CB-O 3.23Å; S735-A761 WeakPolarHBondContact CB-O 3.42Å
736	F	93.7	Very high	95.3	Very high	35 Å²	35	32.2 Å²	32.2	15%	0.154	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.1	22.5	-177.3	-53.3	-90.9	0	0	0	114.6	R710 L734 H738 A761 L849	R710-F736 HydrophobicContact CB-CB 4.43Å; R710-F736 HydrophobicContact CG-CB 3.54Å; R710-F736 HydrophobicContact CG-CD2 4.24Å; R710-F736 HydrophobicContact CG-CG 4.07Å; L734-F736 PolarHBondContact O-N 3.25Å; F736-H738 AromaticContact CD1-CE1 3.95Å; F736-H738 PolarHBondContact O-N 2.98Å; F736-A761 PolarHBondContact N-O 3.34Å; F736-L849 HydrophobicContact CE2-CD1 3.52Å; F736-L849 HydrophobicContact CZ-CD1 4.18Å
737	C	94.7	Very high	95.4	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.166	C	C	.	.			trans	-84	81	165.3	-62.6	0	0	0	0	109.2	V708 L734 S735 N739 L740	V708-C737 PolarHBondContact O-SG 3.42Å; V708-C737 VanDerWaalsContact O-SG 3.39Å; L734-C737 VanDerWaalsContact O-CB 3.23Å; L734-C737 WeakPolarHBondContact O-CB 3.24Å; L734-C737 PolarHBondContact O-N 3.23Å; L734-C737 VanDerWaalsContact O-N 3.13Å; L734-C737 PolarHBondContact O-SG 2.76Å; S735-C737 PolarHBondContact O-N 3.24Å; S735-C737 VanDerWaalsContact O-N 3.16Å; C737-N739 PolarHBondContact O-N 3.39Å; C737-N739 VanDerWaalsContact O-N 3.1Å; C737-L740 HydrophobicContact CB-CD1 3.55Å; C737-L740 HydrophobicContact CB-CG 3.91Å; C737-L740 PolarHBondContact O-N 3.46Å
738	H	91.6	Very high	95.7	Very high	71 Å²	71	28.8 Å²	28.8	33%	0.329	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-18.1	-165.9	-59.1	-52.1	0	0	0	115.9	F736 G762 L765	F736-H738 AromaticContact CD1-CE1 3.95Å; F736-H738 PolarHBondContact O-N 2.98Å; H738-G762 PolarHBondContact CE1-O 2.78Å; H738-G762 PolarHBondContact ND1-O 3.25Å; H738-L765 WeakPolarHBondContact O-CD1 3.49Å
739	N	95	Very high	95.7	Very high	85 Å²	85	26.1 Å²	26.1	46%	0.455	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	4.1	-177.9	-67.4	-31.3	0	0	0	113.7	T712 I714 T715 C737	T712-N739 PolarHBondContact O-ND2 2.62Å; I714-N739 WeakPolarHBondContact O-CB 3.5Å; T715-N739 HydrophobicContact CG2-CB 4.4Å; C737-N739 PolarHBondContact O-N 3.39Å; C737-N739 VanDerWaalsContact O-N 3.1Å
740	L	97	Very high	95.5	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.144	C	C	.	.			trans	-82.7	131.2	176.1	-67.1	178.5	0	0	0	111.5	I714 L719 L734 C737 L765	I714-L740 HydrophobicContact CG2-CD2 4.03Å; L719-L740 HydrophobicContact CB-CD2 4.1Å; L719-L740 HydrophobicContact CD2-CD1 4.2Å; L719-L740 HydrophobicContact CD2-CD2 3.76Å; L734-L740 HydrophobicContact CB-CD1 3.95Å; L734-L740 HydrophobicContact CD1-CD1 4.02Å; L734-L740 HydrophobicContact CD2-CD1 3.96Å; L734-L740 HydrophobicContact CG-CD1 4.2Å; C737-L740 HydrophobicContact CB-CD1 3.55Å; C737-L740 HydrophobicContact CB-CG 3.91Å; C737-L740 PolarHBondContact O-N 3.46Å; L740-L765 WeakPolarHBondContact O-CB 3.05Å
741	T	96.9	Very high	95.2	Very high	40 Å²	40	26.9 Å²	26.9	25%	0.245	14%	0.136	C	C	.	.			trans	-112.4	-179	173.6	86.7	0	0	0	0	111.1	D716 N743 G744 I745 L765	D716-T741 PolarHBondContact OD1-N 3.29Å; D716-T741 WeakPolarHBondContact OD2-CB 3.46Å; D716-T741 PolarHBondContact OD2-OG1 2.59Å; T741-N743 PolarHBondContact O-N 3.32Å; T741-N743 VanDerWaalsContact O-N 3.09Å; T741-N743 PolarHBondContact OG1-N 3.22Å; T741-G744 PolarHBondContact O-N 3.34Å; T741-I745 PolarHBondContact O-N 2.72Å; T741-L765 HydrophobicContact CG2-CB 4.31Å; T741-L765 HydrophobicContact CG2-CD1 4.06Å
742	N	96.4	Very high	95	Very high	28 Å²	28	24.9 Å²	24.9	15%	0.15	13%	0.128	C	C	.	.	H	α-helix	trans	-54.7	-26.8	174.5	-59.8	-36.2	0	0	0	113.2	I745 K746 T767 M769 A770 Y773	N742-I745 PolarHBondContact O-N 3.43Å; N742-K746 WeakPolarHBondContact O-CB 3.3Å; N742-K746 PolarHBondContact O-N 3.46Å; N742-T767 PolarHBondContact ND2-OG1 2.79Å; N742-T767 PolarHBondContact OD1-N 3.38Å; N742-M769 HydrophobicContact CB-CB 4.26Å; N742-A770 VanDerWaalsContact OD1-CB 3.26Å; N742-A770 WeakPolarHBondContact OD1-CB 3.45Å; N742-A770 PolarHBondContact OD1-N 3.45Å; N742-Y773 HydrophobicContact CB-CE2 4.42Å
743	N	95.2	Very high	94.6	Very high	90 Å²	90	28.1 Å²	28.1	48%	0.481	14%	0.141	S	C	.	.	H	α-helix	trans	-71.3	-40.7	-178.3	-72.9	-24.7	0	0	0	113	T741 I745 K746 T747	T741-N743 PolarHBondContact O-N 3.32Å; T741-N743 VanDerWaalsContact O-N 3.09Å; T741-N743 PolarHBondContact OG1-N 3.22Å; N743-I745 VanDerWaalsContact C-N 3.35Å; N743-K746 WeakPolarHBondContact O-CB 3.19Å; N743-K746 PolarHBondContact O-N 2.85Å; N743-T747 PolarHBondContact O-N 3.19Å; N743-T747 PolarHBondContact O-OG1 2.69Å
744	G	95.7	Very high	94.3	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-62.2	-45	172.6	0	0	0	0	0	111.2	D716 T741 K746 T747 L748	D716-G744 VanDerWaalsContact OD1-CA 3.28Å; D716-G744 WeakPolarHBondContact OD1-CA 3.48Å; D716-G744 PolarHBondContact OD1-N 3.16Å; D716-G744 VanDerWaalsContact OD1-N 3.11Å; T741-G744 PolarHBondContact O-N 3.34Å; G744-K746 PolarHBondContact O-N 3.06Å; G744-T747 PolarHBondContact O-N 3.11Å; G744-L748 PolarHBondContact O-N 2.93Å
745	I	96.8	Very high	94.2	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-67	-36.7	179.2	-55.8	-52.1	0	0	0	112.5	L719 L734 T741 N742 N743 T747 L748 A749 L760 L766 A770 I774	L719-I745 HydrophobicContact CD2-CD1 4.19Å; L734-I745 HydrophobicContact CD1-CD1 4.39Å; T741-I745 PolarHBondContact O-N 2.72Å; N742-I745 PolarHBondContact O-N 3.43Å; N743-I745 VanDerWaalsContact C-N 3.35Å; I745-T747 VanDerWaalsContact C-N 3.32Å; I745-T747 PolarHBondContact O-N 2.89Å; I745-L748 HydrophobicContact CD1-CD2 4.4Å; I745-L748 PolarHBondContact O-N 3.35Å; I745-A749 WeakPolarHBondContact O-CB 3.32Å; I745-A749 PolarHBondContact O-N 3.1Å; I745-L760 HydrophobicContact CD1-CD1 4.24Å; I745-L760 HydrophobicContact CD1-CD2 3.54Å; I745-L766 HydrophobicContact CG1-CD1 4.27Å; I745-L766 HydrophobicContact CG1-CD2 3.61Å; I745-A770 HydrophobicContact CB-CB 4.06Å; I745-A770 HydrophobicContact CG1-CB 4.25Å; I745-A770 HydrophobicContact CG2-CB 3.92Å; I745-I774 HydrophobicContact CG2-CD1 3.65Å; I745-I774 HydrophobicContact CG2-CG1 3.69Å
746	K	95.5	Very high	94.3	Very high	47 Å²	47	35.4 Å²	35.4	20%	0.204	18%	0.176	C	C	.	.	H	α-helix	trans	-53	-53.3	171.4	-179.1	-176.7	176.8	179.4	0	109.9	N742 N743 G744 L748 A749 F750 Y773	N742-K746 WeakPolarHBondContact O-CB 3.3Å; N742-K746 PolarHBondContact O-N 3.46Å; N743-K746 WeakPolarHBondContact O-CB 3.19Å; N743-K746 PolarHBondContact O-N 2.85Å; G744-K746 PolarHBondContact O-N 3.06Å; K746-L748 PolarHBondContact O-N 3.23Å; K746-A749 PolarHBondContact O-N 3.49Å; K746-F750 HydrophobicContact CG-CD2 4.16Å; K746-F750 HydrophobicContact CG-CE2 4.01Å; K746-F750 WeakPolarHBondContact O-CD2 3.33Å; K746-F750 PolarHBondContact O-N 3.41Å; K746-F750 VanDerWaalsContact O-N 3.09Å; K746-Y773 HydrophobicContact CB-CD1 4.38Å; K746-Y773 HydrophobicContact CB-CD2 3.61Å; K746-Y773 HydrophobicContact CB-CE1 4.48Å; K746-Y773 HydrophobicContact CB-CE2 3.73Å; K746-Y773 HydrophobicContact CB-CG 3.97Å; K746-Y773 HydrophobicContact CD-CE1 4.05Å; K746-Y773 HydrophobicContact CD-CE2 4.22Å; K746-Y773 HydrophobicContact CG-CD1 4.01Å; K746-Y773 HydrophobicContact CG-CD2 4.13Å; K746-Y773 HydrophobicContact CG-CE1 3.95Å; K746-Y773 HydrophobicContact CG-CE2 4.08Å; K746-Y773 HydrophobicContact CG-CG 4.1Å
747	T	93.4	Very high	94.5	Very high	24 Å²	24	34.3 Å²	34.3	15%	0.147	17%	0.173	C	C	.	.	H	α-helix	trans	-66.9	-42.6	-176.1	-53.5	0	0	0	0	111.8	Q720 A723 H724 N743 G744 I745 A749 F750 C751	Q720-T747 HydrophobicContact CB-CG2 4.13Å; Q720-T747 HydrophobicContact CG-CG2 3.89Å; Q720-T747 WeakPolarHBondContact CG-OG1 3.31Å; A723-T747 HydrophobicContact CB-CG2 4.22Å; H724-T747 VanDerWaalsContact CE1-CG2 3.46Å; H724-T747 WeakPolarHBondContact CE1-CG2 3.32Å; N743-T747 PolarHBondContact O-N 3.19Å; N743-T747 PolarHBondContact O-OG1 2.69Å; G744-T747 PolarHBondContact O-N 3.11Å; I745-T747 VanDerWaalsContact C-N 3.32Å; I745-T747 PolarHBondContact O-N 2.89Å; T747-A749 VanDerWaalsContact C-N 3.35Å; T747-A749 PolarHBondContact O-N 2.59Å; T747-F750 PolarHBondContact O-N 3Å; T747-C751 WeakPolarHBondContact O-CB 3.08Å; T747-C751 PolarHBondContact O-N 3.49Å; T747-C751 PolarHBondContact O-SG 3.06Å; T747-C751 VanDerWaalsContact O-SG 3.38Å
748	L	96.3	Very high	94.6	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-54.1	-49.7	173.8	-179.8	68.5	0	0	0	111.8	L719 A723 I732 L734 G744 I745 K746 F750 C752 L755	L719-L748 HydrophobicContact CD1-CD1 4.24Å; L719-L748 HydrophobicContact CD2-CB 4.42Å; A723-L748 HydrophobicContact CB-CD1 4.45Å; I732-L748 HydrophobicContact CD1-CD1 4.03Å; I732-L748 HydrophobicContact CD1-CD2 4.36Å; I732-L748 HydrophobicContact CG2-CD2 4.16Å; L734-L748 HydrophobicContact CD1-CD2 3.85Å; G744-L748 PolarHBondContact O-N 2.93Å; I745-L748 HydrophobicContact CD1-CD2 4.4Å; I745-L748 PolarHBondContact O-N 3.35Å; K746-L748 PolarHBondContact O-N 3.23Å; L748-F750 PolarHBondContact O-N 3.28Å; L748-C752 HydrophobicContact CD1-CB 4.18Å; L748-C752 VanDerWaalsContact O-CB 3.27Å; L748-C752 WeakPolarHBondContact O-CB 3.33Å; L748-C752 PolarHBondContact O-N 2.87Å; L748-L755 HydrophobicContact CD1-CD1 4.21Å; L748-L755 HydrophobicContact CD2-CD1 4.41Å; L748-L755 HydrophobicContact CG-CD1 3.97Å
749	A	92.5	Very high	94.9	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.008	16%	0.16	C	C	.	.	H	α-helix	trans	-64	-39.8	-178.7	0	0	0	0	0	112.7	I745 K746 T747 I774 V777	I745-A749 WeakPolarHBondContact O-CB 3.32Å; I745-A749 PolarHBondContact O-N 3.1Å; K746-A749 PolarHBondContact O-N 3.49Å; T747-A749 VanDerWaalsContact C-N 3.35Å; T747-A749 PolarHBondContact O-N 2.59Å; A749-I774 HydrophobicContact CB-CG1 4.43Å; A749-V777 WeakPolarHBondContact O-CG1 3.35Å
750	F	91.5	Very high	94.9	Very high	67 Å²	67	27.4 Å²	27.4	29%	0.294	14%	0.139	S	C	.	.	H	α-helix	trans	-74.6	-35.6	-177.9	-84.2	-107.7	0	0	0	113.3	F177 K746 T747 L748 R753 Y773 V777	F177-F750 HydrophobicContact CB-CZ 4.4Å; F177-F750 HydrophobicContact CD1-CZ 4.43Å; F177-F750 AromaticContact CD2-CE1 3.94Å; F177-F750 HydrophobicContact CD2-CE1 3.94Å; F177-F750 HydrophobicContact CD2-CE2 4.28Å; F177-F750 AromaticContact CD2-CZ 3.29Å; F177-F750 HydrophobicContact CD2-CZ 3.29Å; F177-F750 HydrophobicContact CE2-CE1 4.29Å; F177-F750 HydrophobicContact CE2-CE2 4.08Å; F177-F750 AromaticContact CE2-CZ 3.46Å; F177-F750 HydrophobicContact CE2-CZ 3.46Å; F177-F750 VanDerWaalsContact CE2-CZ 3.46Å; F177-F750 AromaticContact CG-CZ 3.81Å; F177-F750 HydrophobicContact CG-CZ 3.81Å; F177-F750 HydrophobicContact CZ-CE2 4.38Å; F177-F750 HydrophobicContact CZ-CZ 4.13Å; K746-F750 HydrophobicContact CG-CD2 4.16Å; K746-F750 HydrophobicContact CG-CE2 4.01Å; K746-F750 WeakPolarHBondContact O-CD2 3.33Å; K746-F750 PolarHBondContact O-N 3.41Å; K746-F750 VanDerWaalsContact O-N 3.09Å; T747-F750 PolarHBondContact O-N 3Å; L748-F750 PolarHBondContact O-N 3.28Å; F750-R753 WeakPolarHBondContact O-CG 3.23Å; F750-Y773 HydrophobicContact CE2-CD1 4.03Å; F750-V777 HydrophobicContact CD1-CG2 4.46Å; F750-V777 HydrophobicContact CD2-CG2 3.98Å; F750-V777 HydrophobicContact CE1-CG2 4.46Å; F750-V777 HydrophobicContact CE2-CG2 4.04Å; F750-V777 HydrophobicContact CG-CG2 4.28Å; F750-V777 HydrophobicContact CZ-CG2 4.32Å
751	C	92.2	Very high	94.7	Very high	32 Å²	32	27.8 Å²	27.8	22%	0.216	14%	0.141	C	C	.	.	H	α-helix	trans	-86.7	-44.5	-179	-60.6	0	0	0	0	112.5	A723 T747 R753	A723-C751 HydrophobicContact CB-CB 4.04Å; A723-C751 WeakPolarHBondContact O-CB 3.22Å; T747-C751 WeakPolarHBondContact O-CB 3.08Å; T747-C751 PolarHBondContact O-N 3.49Å; T747-C751 PolarHBondContact O-SG 3.06Å; T747-C751 VanDerWaalsContact O-SG 3.38Å; C751-R753 PolarHBondContact O-N 3.25Å
752	C	92.8	Very high	94.4	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.134	C	C	.	.			trans	-95.2	64.4	-173.9	-56.1	0	0	0	0	111.8	G726 L729 L748 F754 L755	G726-C752 PolarHBondContact O-SG 3.3Å; L729-C752 HydrophobicContact CB-CB 4.32Å; L748-C752 HydrophobicContact CD1-CB 4.18Å; L748-C752 VanDerWaalsContact O-CB 3.27Å; L748-C752 WeakPolarHBondContact O-CB 3.33Å; L748-C752 PolarHBondContact O-N 2.87Å; C752-F754 PolarHBondContact O-N 3.27Å; C752-F754 VanDerWaalsContact O-N 3.14Å; C752-L755 HydrophobicContact CB-CD1 3.72Å; C752-L755 HydrophobicContact CB-CG 3.91Å; C752-L755 WeakPolarHBondContact O-CD1 3.42Å; C752-L755 VanDerWaalsContact O-CG 3.24Å; C752-L755 WeakPolarHBondContact O-CG 3.28Å; C752-L755 PolarHBondContact O-N 2.85Å
753	R	89.2	Confident	94.2	Very high	69 Å²	69	25 Å²	25	26%	0.26	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-12.5	-169.8	-56.6	179.6	65.4	164.9	-4.6	114.8	N166 F750 C751 V777	N166-R753 PolarHBondContact OD1-NH2 3.1Å; F750-R753 WeakPolarHBondContact O-CG 3.23Å; C751-R753 PolarHBondContact O-N 3.25Å; R753-V777 HydrophobicContact CG-CG1 3.92Å
754	F	91.4	Very high	93.9	Very high	108 Å²	108	26.2 Å²	26.2	47%	0.474	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	4	178.7	-64.7	-68.8	0	0	0	113.6	L729 C752 T756	L729-F754 CarbonylContact O-C 3.4Å; C752-F754 PolarHBondContact O-N 3.27Å; C752-F754 VanDerWaalsContact O-N 3.14Å; F754-T756 WeakPolarHBondContact O-CG2 3.23Å; F754-T756 PolarHBondContact O-N 3.44Å
755	L	95.3	Very high	93.9	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.149	C	C	.	.			trans	-54.3	122.6	177	-78.4	167.8	0	0	0	111.6	L729 I732 L748 C752 I758 Y780 L781	L729-L755 HydrophobicContact CD2-CD2 4.2Å; L729-L755 HydrophobicContact CG-CD2 4.23Å; L729-L755 PolarHBondContact O-N 3.12Å; I732-L755 HydrophobicContact CB-CD2 4.33Å; I732-L755 HydrophobicContact CG2-CD2 3.94Å; L748-L755 HydrophobicContact CD1-CD1 4.21Å; L748-L755 HydrophobicContact CD2-CD1 4.41Å; L748-L755 HydrophobicContact CG-CD1 3.97Å; C752-L755 HydrophobicContact CB-CD1 3.72Å; C752-L755 HydrophobicContact CB-CG 3.91Å; C752-L755 WeakPolarHBondContact O-CD1 3.42Å; C752-L755 VanDerWaalsContact O-CG 3.24Å; C752-L755 WeakPolarHBondContact O-CG 3.28Å; C752-L755 PolarHBondContact O-N 2.85Å; L755-I758 HydrophobicContact CB-CD1 4.19Å; L755-I758 HydrophobicContact CB-CG1 4.23Å; L755-I758 HydrophobicContact CD1-CD1 3.86Å; L755-I758 HydrophobicContact CD1-CG1 4.1Å; L755-I758 HydrophobicContact CD2-CG1 4.26Å; L755-I758 HydrophobicContact CG-CG1 4.44Å; L755-Y780 CarbonylContact O-C 3.51Å; L755-L781 PolarHBondContact O-N 3.47Å
756	T	96.3	Very high	93.8	Very high	45 Å²	45	30.1 Å²	30.1	28%	0.276	15%	0.149	S	C	.	.			trans	-106.8	-23.3	175.4	67.1	0	0	0	0	111.7	E730 F754 K782 F783	E730-T756 PolarHBondContact O-N 3.5Å; E730-T756 PolarHBondContact O-OG1 2.74Å; F754-T756 WeakPolarHBondContact O-CG2 3.23Å; F754-T756 PolarHBondContact O-N 3.44Å; T756-K782 WeakPolarHBondContact O-CA 3.27Å; T756-K782 PolarHBondContact O-N 3.49Å; T756-F783 PolarHBondContact O-N 3.09Å
757	S	97.7	Very high	93.8	Very high	12 Å²	12	29.9 Å²	29.9	8%	0.084	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	125.9	-176.9	-175.7	0	0	0	0	110.7	E730 Y731 I732 F783	E730-S757 PolarHBondContact O-N 2.72Å; E730-S757 VanDerWaalsContact O-N 3.14Å; Y731-S757 WeakPolarHBondContact CA-O 3.44Å; Y731-S757 WeakPolarHBondContact CD2-OG 3.1Å; Y731-S757 VanDerWaalsContact CE2-OG 3.25Å; Y731-S757 WeakPolarHBondContact CE2-OG 3.16Å; I732-S757 PolarHBondContact N-O 3.43Å; I732-S757 VanDerWaalsContact N-O 3.1Å; S757-F783 WeakPolarHBondContact CA-O 3.23Å; S757-F783 WeakPolarHBondContact OG-CD1 3.46Å
758	I	97.6	Very high	93.8	Very high	1 Å²	1	29.8 Å²	29.8	1%	0.005	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	123.7	179.2	-62.6	172.4	0	0	0	108.7	I732 L755 L760 I774 L781 F783 L784 D785	I732-I758 HydrophobicContact CG2-CG1 4.26Å; I732-I758 HydrophobicContact CG2-CG2 4.42Å; L755-I758 HydrophobicContact CB-CD1 4.19Å; L755-I758 HydrophobicContact CB-CG1 4.23Å; L755-I758 HydrophobicContact CD1-CD1 3.86Å; L755-I758 HydrophobicContact CD1-CG1 4.1Å; L755-I758 HydrophobicContact CD2-CG1 4.26Å; L755-I758 HydrophobicContact CG-CG1 4.44Å; I758-L760 HydrophobicContact CG2-CD1 3.61Å; I758-L760 HydrophobicContact CG2-CD2 4.41Å; I758-L760 HydrophobicContact CG2-CG 3.62Å; I758-I774 HydrophobicContact CD1-CD1 4.21Å; I758-I774 HydrophobicContact CD1-CG1 4.25Å; I758-I774 HydrophobicContact CD1-CG2 3.93Å; I758-L781 HydrophobicContact CB-CD1 4.17Å; I758-L781 HydrophobicContact CD1-CD1 3.68Å; I758-L781 HydrophobicContact CG1-CD1 3.68Å; I758-F783 PolarHBondContact N-O 2.84Å; I758-L784 HydrophobicContact CB-CD1 3.94Å; I758-L784 HydrophobicContact CG2-CD1 4.01Å; I758-L784 WeakPolarHBondContact O-CA 3.27Å; I758-D785 PolarHBondContact O-N 2.95Å
759	N	97.2	Very high	93.7	Very high	10 Å²	10	32.4 Å²	32.4	5%	0.053	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	117.2	169.8	-174.9	0.3	0	0	0	110.4	I732 D733 L734 S735 A761 D785	I732-N759 PolarHBondContact O-N 2.6Å; D733-N759 HydrophobicContact CB-CB 4.2Å; D733-N759 PolarHBondContact OD1-ND2 3.32Å; D733-N759 PolarHBondContact OD2-ND2 2.79Å; L734-N759 PolarHBondContact N-O 3.39Å; S735-N759 PolarHBondContact N-O 3.33Å; N759-A761 WeakPolarHBondContact OD1-CB 3.39Å; N759-A761 PolarHBondContact OD1-N 3.06Å; N759-D785 HydrophobicContact CB-CB 4.38Å
760	L	96.4	Very high	93.8	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.005	16%	0.163	C	C	.	.			trans	-123.4	17.9	179.8	-68	165.5	0	0	0	111.7	L734 I745 I758 G762 C763 L766 I774 D785 L786 C789	L734-L760 HydrophobicContact CB-CD2 3.9Å; L734-L760 HydrophobicContact CD1-CD2 4.02Å; I745-L760 HydrophobicContact CD1-CD1 4.24Å; I745-L760 HydrophobicContact CD1-CD2 3.54Å; I758-L760 HydrophobicContact CG2-CD1 3.61Å; I758-L760 HydrophobicContact CG2-CD2 4.41Å; I758-L760 HydrophobicContact CG2-CG 3.62Å; L760-G762 PolarHBondContact O-N 3.43Å; L760-C763 VanDerWaalsContact O-CB 3.31Å; L760-C763 WeakPolarHBondContact O-CB 3.16Å; L760-C763 PolarHBondContact O-N 2.99Å; L760-C763 PolarHBondContact O-SG 3.2Å; L760-L766 HydrophobicContact CB-CD1 3.92Å; L760-L766 HydrophobicContact CD1-CD1 3.97Å; L760-L766 HydrophobicContact CD2-CD1 4.01Å; L760-L766 HydrophobicContact CG-CD1 4.18Å; L760-I774 HydrophobicContact CD1-CD1 3.73Å; L760-D785 PolarHBondContact N-O 3.07Å; L760-L786 HydrophobicContact CB-CD2 4.13Å; L760-L786 HydrophobicContact CD1-CD2 4.11Å; L760-C789 PolarHBondContact O-SG 2.93Å
761	A	93.1	Very high	94	Very high	7 Å²	7	29.2 Å²	29.2	6%	0.058	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	136.9	-177.1	0	0	0	0	0	111.9	S735 F736 N759 C763 S787	S735-A761 CarbonylContact C-O 3.38Å; S735-A761 WeakPolarHBondContact CA-O 3.46Å; S735-A761 VanDerWaalsContact CB-O 3.23Å; S735-A761 WeakPolarHBondContact CB-O 3.42Å; F736-A761 PolarHBondContact N-O 3.34Å; N759-A761 WeakPolarHBondContact OD1-CB 3.39Å; N759-A761 PolarHBondContact OD1-N 3.06Å; A761-C763 VanDerWaalsContact C-N 3.27Å; A761-C763 PolarHBondContact O-N 2.88Å; A761-S787 CarbonylContact C-O 3.36Å; A761-S787 WeakPolarHBondContact CA-O 3.37Å; A761-S787 WeakPolarHBondContact CB-O 3.36Å
762	G	89.9	Confident	94.1	Very high	9 Å²	9	28.5 Å²	28.5	9%	0.093	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	9.8	179.1	0	0	0	0	0	116	H738 L760 K764 S787	H738-G762 PolarHBondContact CE1-O 2.78Å; H738-G762 PolarHBondContact ND1-O 3.25Å; L760-G762 PolarHBondContact O-N 3.43Å; G762-K764 PolarHBondContact O-N 3.26Å; G762-K764 VanDerWaalsContact O-N 3.17Å; G762-S787 PolarHBondContact N-O 3.34Å
763	C	93	Very high	94.1	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.147	C	C	.	.			trans	-81.1	88.4	172.2	-61.3	0	0	0	0	110.3	L734 L760 A761 L765 L766	L734-C763 PolarHBondContact O-SG 3.17Å; L760-C763 VanDerWaalsContact O-CB 3.31Å; L760-C763 WeakPolarHBondContact O-CB 3.16Å; L760-C763 PolarHBondContact O-N 2.99Å; L760-C763 PolarHBondContact O-SG 3.2Å; A761-C763 VanDerWaalsContact C-N 3.27Å; A761-C763 PolarHBondContact O-N 2.88Å; C763-L765 VanDerWaalsContact C-N 3.3Å; C763-L765 PolarHBondContact O-N 3.25Å; C763-L766 HydrophobicContact CB-CD1 3.45Å; C763-L766 VanDerWaalsContact CB-CD1 3.45Å; C763-L766 HydrophobicContact CB-CG 3.67Å; C763-L766 PolarHBondContact O-N 3.42Å
764	K	89	Confident	94.3	Very high	116 Å²	116	26.5 Å²	26.5	50%	0.504	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-21.7	-166.6	-61.8	-174.6	178.5	-174	0	115.6	G762 L791	G762-K764 PolarHBondContact O-N 3.26Å; G762-K764 VanDerWaalsContact O-N 3.17Å; K764-L791 WeakPolarHBondContact O-CD1 3.12Å
765	L	94.1	Very high	94.3	Very high	83 Å²	83	21.7 Å²	21.7	44%	0.435	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	0.5	-177.6	-56.9	176.1	0	0	0	113.2	H738 L740 T741 C763	H738-L765 WeakPolarHBondContact O-CD1 3.49Å; L740-L765 WeakPolarHBondContact O-CB 3.05Å; T741-L765 HydrophobicContact CG2-CB 4.31Å; T741-L765 HydrophobicContact CG2-CD1 4.06Å; C763-L765 VanDerWaalsContact C-N 3.3Å; C763-L765 PolarHBondContact O-N 3.25Å
766	L	95.8	Very high	93.9	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.126	C	C	.	.			trans	-83	131.3	179.3	-58.7	-174.2	0	0	0	111.2	I745 L760 C763 A770 L791 I792	I745-L766 HydrophobicContact CG1-CD1 4.27Å; I745-L766 HydrophobicContact CG1-CD2 3.61Å; L760-L766 HydrophobicContact CB-CD1 3.92Å; L760-L766 HydrophobicContact CD1-CD1 3.97Å; L760-L766 HydrophobicContact CD2-CD1 4.01Å; L760-L766 HydrophobicContact CG-CD1 4.18Å; C763-L766 HydrophobicContact CB-CD1 3.45Å; C763-L766 VanDerWaalsContact CB-CD1 3.45Å; C763-L766 HydrophobicContact CB-CG 3.67Å; C763-L766 PolarHBondContact O-N 3.42Å; L766-A770 HydrophobicContact CB-CB 4.26Å; L766-A770 HydrophobicContact CD2-CB 4.14Å; L766-L791 WeakPolarHBondContact O-CB 3.36Å; L766-I792 HydrophobicContact CB-CD1 4.5Å
767	T	94.9	Very high	93.4	Very high	41 Å²	41	21 Å²	21	25%	0.252	12%	0.115	S	C	.	.			trans	-113.6	-177.1	175.6	76.2	0	0	0	0	110.5	N742 M769 A770 L791	N742-T767 PolarHBondContact ND2-OG1 2.79Å; N742-T767 PolarHBondContact OD1-N 3.38Å; T767-M769 PolarHBondContact O-N 2.96Å; T767-M769 PolarHBondContact OG1-N 3.36Å; T767-A770 PolarHBondContact O-N 3.15Å; T767-L791 HydrophobicContact CG2-CB 3.94Å; T767-L791 HydrophobicContact CG2-CD1 4.05Å
768	D	94	Very high	93	Very high	22 Å²	22	20.4 Å²	20.4	12%	0.118	11%	0.111	C	C	.	.	H	α-helix	trans	-54.5	-23.6	175.9	-62	-51.8	0	0	0	113.8	V771 Q772 T793 T795 S796 F799	D768-V771 PolarHBondContact O-N 3.36Å; D768-Q772 PolarHBondContact O-N 3.1Å; D768-T793 PolarHBondContact OD1-N 3.02Å; D768-T793 WeakPolarHBondContact OD2-CB 3.38Å; D768-T793 WeakPolarHBondContact OD2-CG2 3.16Å; D768-T793 PolarHBondContact OD2-N 3.26Å; D768-T793 PolarHBondContact OD2-OG1 2.84Å; D768-T795 VanDerWaalsContact CB-OG1 3.23Å; D768-T795 WeakPolarHBondContact CB-OG1 3.39Å; D768-T795 PolarHBondContact OD1-OG1 3.12Å; D768-T795 PolarHBondContact OD2-OG1 3.29Å; D768-S796 VanDerWaalsContact OD1-CB 3.3Å; D768-S796 WeakPolarHBondContact OD1-CB 3.39Å; D768-S796 PolarHBondContact OD1-N 3.26Å; D768-F799 HydrophobicContact CB-CE2 4.25Å
769	M	93.8	Very high	92.5	Very high	56 Å²	56	23.7 Å²	23.7	28%	0.276	13%	0.126	S	C	.	.	H	α-helix	trans	-61.9	-41.5	175.4	-69.6	-61.5	-62.1	0	0	112.7	M180 N742 T767 V771 Q772 Y773	M180-M769 HydrophobicContact CE-CE 3.81Å; M180-M769 HydrophobicContact CE-SD 4.17Å; N742-M769 HydrophobicContact CB-CB 4.26Å; T767-M769 PolarHBondContact O-N 2.96Å; T767-M769 PolarHBondContact OG1-N 3.36Å; M769-V771 VanDerWaalsContact C-N 3.29Å; M769-V771 PolarHBondContact O-N 3.14Å; M769-Q772 WeakPolarHBondContact O-CB 3.09Å; M769-Q772 PolarHBondContact O-N 3.1Å; M769-Q772 PolarHBondContact SD-OE1 2.74Å; M769-Y773 HydrophobicContact CB-CE2 4.34Å; M769-Y773 HydrophobicContact CE-CE2 4.35Å; M769-Y773 WeakPolarHBondContact O-CD2 3.46Å; M769-Y773 PolarHBondContact O-N 2.99Å
770	A	95.1	Very high	92.1	Very high	2 Å²	2	28.4 Å²	28.4	2%	0.017	14%	0.144	C	C	.	.	H	α-helix	trans	-59.6	-43.3	175.2	0	0	0	0	0	111.1	N742 I745 L766 T767 Q772 Y773 I774	N742-A770 VanDerWaalsContact OD1-CB 3.26Å; N742-A770 WeakPolarHBondContact OD1-CB 3.45Å; N742-A770 PolarHBondContact OD1-N 3.45Å; I745-A770 HydrophobicContact CB-CB 4.06Å; I745-A770 HydrophobicContact CG1-CB 4.25Å; I745-A770 HydrophobicContact CG2-CB 3.92Å; L766-A770 HydrophobicContact CB-CB 4.26Å; L766-A770 HydrophobicContact CD2-CB 4.14Å; T767-A770 PolarHBondContact O-N 3.15Å; A770-Q772 VanDerWaalsContact C-N 3.34Å; A770-Y773 PolarHBondContact O-N 2.99Å; A770-I774 WeakPolarHBondContact O-CG1 3.45Å; A770-I774 PolarHBondContact O-N 3.13Å
771	V	95	Very high	92	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-66.3	-38.3	177.2	-168.3	0	0	0	0	111.3	D768 M769 I774 S775 L786 I792 L800	D768-V771 PolarHBondContact O-N 3.36Å; M769-V771 VanDerWaalsContact C-N 3.29Å; M769-V771 PolarHBondContact O-N 3.14Å; V771-I774 PolarHBondContact O-N 3Å; V771-S775 VanDerWaalsContact O-CB 3.28Å; V771-S775 WeakPolarHBondContact O-CB 3.28Å; V771-S775 PolarHBondContact O-N 3.14Å; V771-S775 PolarHBondContact O-OG 3.44Å; V771-L786 HydrophobicContact CG1-CD1 4.49Å; V771-L786 HydrophobicContact CG2-CD1 3.72Å; V771-L786 HydrophobicContact CG2-CD2 4.47Å; V771-I792 HydrophobicContact CG2-CD1 3.86Å; V771-I792 HydrophobicContact CG2-CG1 4.48Å; V771-I792 HydrophobicContact CG2-CG2 4.16Å; V771-L800 HydrophobicContact CG1-CD1 4.01Å; V771-L800 HydrophobicContact CG1-CD2 3.54Å; V771-L800 HydrophobicContact CG1-CG 3.53Å
772	Q	93.9	Very high	92.1	Very high	16 Å²	16	32.1 Å²	32.1	8%	0.075	16%	0.159	C	C	.	.	H	α-helix	trans	-59	-48.1	174.7	-167.7	-179.4	8.5	0	0	111.2	Y176 D768 M769 A770 S775 G776 F799	Y176-Q772 PolarHBondContact OH-NE2 2.97Å; D768-Q772 PolarHBondContact O-N 3.1Å; M769-Q772 WeakPolarHBondContact O-CB 3.09Å; M769-Q772 PolarHBondContact O-N 3.1Å; M769-Q772 PolarHBondContact SD-OE1 2.74Å; A770-Q772 VanDerWaalsContact C-N 3.34Å; Q772-S775 PolarHBondContact O-N 3.41Å; Q772-S775 PolarHBondContact O-OG 3.47Å; Q772-G776 PolarHBondContact O-N 2.84Å; Q772-F799 HydrophobicContact CB-CD1 4.42Å; Q772-F799 HydrophobicContact CB-CD2 3.67Å; Q772-F799 HydrophobicContact CB-CE2 3.81Å; Q772-F799 HydrophobicContact CB-CG 4.02Å; Q772-F799 HydrophobicContact CB-CZ 4.25Å; Q772-F799 HydrophobicContact CG-CD1 3.95Å; Q772-F799 HydrophobicContact CG-CD2 4.1Å; Q772-F799 HydrophobicContact CG-CE1 3.95Å; Q772-F799 HydrophobicContact CG-CE2 4.11Å; Q772-F799 HydrophobicContact CG-CG 4.04Å; Q772-F799 HydrophobicContact CG-CZ 4.04Å
773	Y	93.5	Very high	92.4	Very high	25 Å²	25	33.3 Å²	33.3	10%	0.098	16%	0.162	C	C	.	.	H	α-helix	trans	-60.4	-47.9	177.6	-64.9	-49.5	0	0	0	112.5	F177 N742 K746 F750 M769 A770 S775 G776 V777	F177-Y773 HydrophobicContact CD1-CD1 4.27Å; F177-Y773 AromaticContact CD1-CE1 3.94Å; F177-Y773 HydrophobicContact CD1-CE1 3.94Å; F177-Y773 AromaticContact CE1-CD1 3.59Å; F177-Y773 HydrophobicContact CE1-CD1 3.59Å; F177-Y773 AromaticContact CE1-CE1 3.64Å; F177-Y773 HydrophobicContact CE1-CE1 3.64Å; F177-Y773 AromaticContact CZ-CD1 3.97Å; F177-Y773 HydrophobicContact CZ-CD1 3.97Å; F177-Y773 HydrophobicContact CZ-CE1 4.45Å; N742-Y773 HydrophobicContact CB-CE2 4.42Å; K746-Y773 HydrophobicContact CB-CD1 4.38Å; K746-Y773 HydrophobicContact CB-CD2 3.61Å; K746-Y773 HydrophobicContact CB-CE1 4.48Å; K746-Y773 HydrophobicContact CB-CE2 3.73Å; K746-Y773 HydrophobicContact CB-CG 3.97Å; K746-Y773 HydrophobicContact CD-CE1 4.05Å; K746-Y773 HydrophobicContact CD-CE2 4.22Å; K746-Y773 HydrophobicContact CG-CD1 4.01Å; K746-Y773 HydrophobicContact CG-CD2 4.13Å; K746-Y773 HydrophobicContact CG-CE1 3.95Å; K746-Y773 HydrophobicContact CG-CE2 4.08Å; K746-Y773 HydrophobicContact CG-CG 4.1Å; F750-Y773 HydrophobicContact CE2-CD1 4.03Å; M769-Y773 HydrophobicContact CB-CE2 4.34Å; M769-Y773 HydrophobicContact CE-CE2 4.35Å; M769-Y773 WeakPolarHBondContact O-CD2 3.46Å; M769-Y773 PolarHBondContact O-N 2.99Å; A770-Y773 PolarHBondContact O-N 2.99Å; Y773-S775 VanDerWaalsContact C-N 3.33Å; Y773-S775 PolarHBondContact O-N 3.16Å; Y773-G776 PolarHBondContact O-N 3.35Å; Y773-V777 PolarHBondContact O-N 3.2Å
774	I	94.2	Very high	92.5	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-57.5	-49.2	175.9	-68.8	168.6	0	0	0	110	I745 A749 I758 L760 A770 V771 G776 V777 C778 L781 L784	I745-I774 HydrophobicContact CG2-CD1 3.65Å; I745-I774 HydrophobicContact CG2-CG1 3.69Å; A749-I774 HydrophobicContact CB-CG1 4.43Å; I758-I774 HydrophobicContact CD1-CD1 4.21Å; I758-I774 HydrophobicContact CD1-CG1 4.25Å; I758-I774 HydrophobicContact CD1-CG2 3.93Å; L760-I774 HydrophobicContact CD1-CD1 3.73Å; A770-I774 WeakPolarHBondContact O-CG1 3.45Å; A770-I774 PolarHBondContact O-N 3.13Å; V771-I774 PolarHBondContact O-N 3Å; I774-G776 VanDerWaalsContact C-N 3.31Å; I774-G776 PolarHBondContact O-N 2.81Å; I774-V777 PolarHBondContact O-N 3.5Å; I774-C778 HydrophobicContact CG2-CB 4.18Å; I774-C778 VanDerWaalsContact O-CB 3.26Å; I774-C778 WeakPolarHBondContact O-CB 3.45Å; I774-C778 PolarHBondContact O-N 2.83Å; I774-L781 HydrophobicContact CG2-CD2 3.57Å; I774-L784 HydrophobicContact CD1-CD1 4.47Å
775	S	90.2	Very high	92.8	Very high	7 Å²	7	28.4 Å²	28.4	5%	0.049	14%	0.141	C	C	.	.	H	α-helix	trans	-64.9	-34.7	-177.4	76.5	0	0	0	0	113.5	V771 Q772 Y773 V777 F799 G803 C804	V771-S775 VanDerWaalsContact O-CB 3.28Å; V771-S775 WeakPolarHBondContact O-CB 3.28Å; V771-S775 PolarHBondContact O-N 3.14Å; V771-S775 PolarHBondContact O-OG 3.44Å; Q772-S775 PolarHBondContact O-N 3.41Å; Q772-S775 PolarHBondContact O-OG 3.47Å; Y773-S775 VanDerWaalsContact C-N 3.33Å; Y773-S775 PolarHBondContact O-N 3.16Å; S775-V777 VanDerWaalsContact C-N 3.29Å; S775-V777 PolarHBondContact O-N 3.36Å; S775-F799 WeakPolarHBondContact CB-O 3.23Å; S775-F799 WeakPolarHBondContact OG-CB 3.23Å; S775-G803 CarbonylContact O-C 3.55Å; S775-G803 WeakPolarHBondContact O-CA 3.46Å; S775-C804 VanDerWaalsContact CA-SG 3.57Å
776	G	86.8	Confident	92.9	Very high	24 Å²	24	24.5 Å²	24.5	25%	0.247	12%	0.121	C	C	.	.	H	α-helix	trans	-71.5	-21.2	-177.4	0	0	0	0	0	114	Q772 Y773 I774 H779	Q772-G776 PolarHBondContact O-N 2.84Å; Y773-G776 PolarHBondContact O-N 3.35Å; I774-G776 VanDerWaalsContact C-N 3.31Å; I774-G776 PolarHBondContact O-N 2.81Å; G776-H779 PolarHBondContact O-CE1 3.24Å; G776-H779 VanDerWaalsContact O-CE1 3.23Å
777	V	87.4	Confident	92.7	Very high	7 Å²	7	25 Å²	25	4%	0.042	12%	0.124	C	C	.	.	H	α-helix	trans	-127.5	-40.1	-171.5	-168.3	0	0	0	0	113.7	T173 A749 F750 R753 Y773 I774 S775 H779	T173-V777 HydrophobicContact CG2-CG2 4.25Å; A749-V777 WeakPolarHBondContact O-CG1 3.35Å; F750-V777 HydrophobicContact CD1-CG2 4.46Å; F750-V777 HydrophobicContact CD2-CG2 3.98Å; F750-V777 HydrophobicContact CE1-CG2 4.46Å; F750-V777 HydrophobicContact CE2-CG2 4.04Å; F750-V777 HydrophobicContact CG-CG2 4.28Å; F750-V777 HydrophobicContact CZ-CG2 4.32Å; R753-V777 HydrophobicContact CG-CG1 3.92Å; Y773-V777 PolarHBondContact O-N 3.2Å; I774-V777 PolarHBondContact O-N 3.5Å; S775-V777 VanDerWaalsContact C-N 3.29Å; S775-V777 PolarHBondContact O-N 3.36Å; V777-H779 VanDerWaalsContact C-N 3.27Å; V777-H779 PolarHBondContact O-CD2 3.16Å; V777-H779 PolarHBondContact O-N 2.63Å
778	C	87.5	Confident	92.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.12	C	C	.	.			trans	-82.1	64.9	-173.7	-58.2	0	0	0	0	111.9	I774 Y780 L781	I774-C778 HydrophobicContact CG2-CB 4.18Å; I774-C778 VanDerWaalsContact O-CB 3.26Å; I774-C778 WeakPolarHBondContact O-CB 3.45Å; I774-C778 PolarHBondContact O-N 2.83Å; C778-Y780 PolarHBondContact O-N 3.42Å; C778-Y780 VanDerWaalsContact O-N 3.1Å; C778-L781 HydrophobicContact CB-CB 4.34Å; C778-L781 VanDerWaalsContact O-CB 3.27Å; C778-L781 WeakPolarHBondContact O-CB 3.49Å; C778-L781 PolarHBondContact O-N 3.47Å; C778-L781 VanDerWaalsContact O-N 3.12Å
779	H	87.2	Confident	92.2	Very high	69 Å²	69	22.8 Å²	22.8	32%	0.319	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-12.7	-174.8	-54.4	-51.6	0	0	0	115.1	G776 V777	G776-H779 PolarHBondContact O-CE1 3.24Å; G776-H779 VanDerWaalsContact O-CE1 3.23Å; V777-H779 VanDerWaalsContact C-N 3.27Å; V777-H779 PolarHBondContact O-CD2 3.16Å; V777-H779 PolarHBondContact O-N 2.63Å
780	Y	90	Very high	91.8	Very high	109 Å²	109	24.9 Å²	24.9	43%	0.427	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	1.4	177.5	-61.9	-78.7	0	0	0	113.7	L755 C778 K782 K806	L755-Y780 CarbonylContact O-C 3.51Å; C778-Y780 PolarHBondContact O-N 3.42Å; C778-Y780 VanDerWaalsContact O-N 3.1Å; Y780-K782 PolarHBondContact O-N 2.78Å; Y780-K806 HydrophobicContact CD1-CD 4.45Å
781	L	93.8	Very high	91.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.146	C	C	.	.			trans	-61.8	123	-177.6	-165.9	71.7	0	0	0	111.4	L755 I758 I774 C778 F783 L784 K806 L807	L755-L781 PolarHBondContact O-N 3.47Å; I758-L781 HydrophobicContact CB-CD1 4.17Å; I758-L781 HydrophobicContact CD1-CD1 3.68Å; I758-L781 HydrophobicContact CG1-CD1 3.68Å; I774-L781 HydrophobicContact CG2-CD2 3.57Å; C778-L781 HydrophobicContact CB-CB 4.34Å; C778-L781 VanDerWaalsContact O-CB 3.27Å; C778-L781 WeakPolarHBondContact O-CB 3.49Å; C778-L781 PolarHBondContact O-N 3.47Å; C778-L781 VanDerWaalsContact O-N 3.12Å; L781-F783 WeakPolarHBondContact CD1-O 3.35Å; L781-L784 HydrophobicContact CD2-CB 4.02Å; L781-L784 HydrophobicContact CD2-CD1 4.44Å; L781-L784 HydrophobicContact CD2-CD2 4.17Å; L781-L784 HydrophobicContact CD2-CG 4.44Å; L781-K806 CarbonylContact O-C 3.4Å; L781-L807 HydrophobicContact CD2-CD1 4.3Å; L781-L807 HydrophobicContact CG-CD1 4.24Å; L781-L807 VanDerWaalsContact O-CA 3.31Å; L781-L807 WeakPolarHBondContact O-CA 3.1Å; L781-L807 PolarHBondContact O-N 2.83Å; L781-L807 VanDerWaalsContact O-N 3.16Å
782	K	95	Very high	91.5	Very high	87 Å²	87	29.2 Å²	29.2	38%	0.378	15%	0.146	S	C	.	.			trans	-109.4	-34.8	177.8	-69	176.6	164.9	-108.9	0	112.6	T756 Y780 K806 E808 H809	T756-K782 WeakPolarHBondContact O-CA 3.27Å; T756-K782 PolarHBondContact O-N 3.49Å; Y780-K782 PolarHBondContact O-N 2.78Å; K782-K806 WeakPolarHBondContact CA-O 3.31Å; K782-E808 IonicContact NZ-OE1 2.64Å; K782-E808 PolarHBondContact NZ-OE1 3.12Å; K782-E808 IonicContact NZ-OE2 3.63Å; K782-E808 PolarHBondContact NZ-OE2 3.16Å; K782-E808 PolarHBondContact O-N 2.99Å; K782-H809 PolarHBondContact O-N 3.01Å
783	F	95.9	Very high	91.4	Very high	34 Å²	34	30.8 Å²	30.8	15%	0.149	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	132.3	179.1	175.2	-90.6	0	0	0	110.7	T756 S757 I758 L781 D785 H809 R811	T756-F783 PolarHBondContact O-N 3.09Å; S757-F783 WeakPolarHBondContact CA-O 3.23Å; S757-F783 WeakPolarHBondContact OG-CD1 3.46Å; I758-F783 PolarHBondContact N-O 2.84Å; L781-F783 WeakPolarHBondContact CD1-O 3.35Å; F783-D785 HydrophobicContact CE1-CB 3.78Å; F783-D785 HydrophobicContact CZ-CB 3.74Å; F783-H809 WeakPolarHBondContact CA-O 3.28Å; F783-H809 HydrophobicContact CD2-CB 3.88Å; F783-H809 AromaticContact CD2-CG 3.75Å; F783-H809 AromaticContact CD2-ND1 3.56Å; F783-H809 AromaticContact CE2-CE1 3.87Å; F783-H809 AromaticContact CE2-ND1 3.61Å; F783-R811 HydrophobicContact CE2-CG 4.23Å
784	L	96.2	Very high	91.1	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	124.1	172.8	-178.6	60.4	0	0	0	110.2	I758 I774 L781 L786 L800 L807 H809 L810 R811	I758-L784 HydrophobicContact CB-CD1 3.94Å; I758-L784 HydrophobicContact CG2-CD1 4.01Å; I758-L784 WeakPolarHBondContact O-CA 3.27Å; I774-L784 HydrophobicContact CD1-CD1 4.47Å; L781-L784 HydrophobicContact CD2-CB 4.02Å; L781-L784 HydrophobicContact CD2-CD1 4.44Å; L781-L784 HydrophobicContact CD2-CD2 4.17Å; L781-L784 HydrophobicContact CD2-CG 4.44Å; L784-L786 HydrophobicContact CD1-CD2 4.13Å; L784-L786 HydrophobicContact CD1-CG 4.2Å; L784-L786 HydrophobicContact CD2-CD1 3.88Å; L784-L786 HydrophobicContact CD2-CG 4.19Å; L784-L786 HydrophobicContact CG-CD1 4.19Å; L784-L786 HydrophobicContact CG-CD2 4.41Å; L784-L786 HydrophobicContact CG-CG 3.95Å; L784-L800 HydrophobicContact CD2-CD1 4.06Å; L784-L800 HydrophobicContact CD2-CD2 3.55Å; L784-L800 HydrophobicContact CD2-CG 4.45Å; L784-L807 HydrophobicContact CB-CD1 3.96Å; L784-H809 PolarHBondContact N-O 2.66Å; L784-L810 HydrophobicContact CB-CD1 4.16Å; L784-L810 HydrophobicContact CD2-CD1 4.26Å; L784-L810 HydrophobicContact CG-CD1 4.27Å; L784-L810 WeakPolarHBondContact O-CA 3.31Å; L784-R811 PolarHBondContact O-N 2.71Å
785	D	95.6	Very high	90.9	Very high	12 Å²	12	34.5 Å²	34.5	6%	0.064	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	118.7	172.6	-161.3	-21.9	0	0	0	110.6	I758 N759 L760 F783 S787 R811	I758-D785 PolarHBondContact O-N 2.95Å; N759-D785 HydrophobicContact CB-CB 4.38Å; L760-D785 PolarHBondContact N-O 3.07Å; F783-D785 HydrophobicContact CE1-CB 3.78Å; F783-D785 HydrophobicContact CZ-CB 3.74Å; D785-S787 WeakPolarHBondContact OD1-CB 3.49Å; D785-S787 PolarHBondContact OD1-N 3.11Å; D785-S787 PolarHBondContact OD1-OG 3.2Å; D785-R811 HydrophobicContact CB-CB 4.05Å; D785-R811 VanDerWaalsContact CG-CB 3.47Å; D785-R811 WeakPolarHBondContact OD1-CB 3.1Å; D785-R811 WeakPolarHBondContact OD2-CD 3.1Å; D785-R811 IonicContact OD2-NH1 3.69Å
786	L	94.6	Very high	90.8	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.01	18%	0.177	C	C	.	.			trans	-120.7	19.1	177.6	-62.6	170.5	0	0	0	111	L760 V771 L784 G788 C789 I792 R811 L812 C815	L760-L786 HydrophobicContact CB-CD2 4.13Å; L760-L786 HydrophobicContact CD1-CD2 4.11Å; V771-L786 HydrophobicContact CG1-CD1 4.49Å; V771-L786 HydrophobicContact CG2-CD1 3.72Å; V771-L786 HydrophobicContact CG2-CD2 4.47Å; L784-L786 HydrophobicContact CD1-CD2 4.13Å; L784-L786 HydrophobicContact CD1-CG 4.2Å; L784-L786 HydrophobicContact CD2-CD1 3.88Å; L784-L786 HydrophobicContact CD2-CG 4.19Å; L784-L786 HydrophobicContact CG-CD1 4.19Å; L784-L786 HydrophobicContact CG-CD2 4.41Å; L784-L786 HydrophobicContact CG-CG 3.95Å; L786-G788 PolarHBondContact O-N 3.46Å; L786-C789 VanDerWaalsContact O-CB 3.26Å; L786-C789 WeakPolarHBondContact O-CB 3.43Å; L786-C789 PolarHBondContact O-N 3.21Å; L786-C789 VanDerWaalsContact O-N 3.1Å; L786-C789 PolarHBondContact O-SG 3.13Å; L786-I792 HydrophobicContact CB-CD1 4.09Å; L786-I792 HydrophobicContact CD1-CD1 3.96Å; L786-I792 HydrophobicContact CD2-CD1 3.73Å; L786-I792 HydrophobicContact CG-CD1 4.13Å; L786-R811 PolarHBondContact N-O 3.44Å; L786-L812 HydrophobicContact CB-CD2 3.84Å; L786-L812 HydrophobicContact CD1-CD2 4.19Å; L786-C815 PolarHBondContact O-SG 2.73Å
787	S	92.2	Very high	90.9	Very high	11 Å²	11	33.1 Å²	33.1	8%	0.077	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	136.1	-176	-57.8	0	0	0	0	111.6	A761 G762 D785 C789 L813	A761-S787 CarbonylContact C-O 3.36Å; A761-S787 WeakPolarHBondContact CA-O 3.37Å; A761-S787 WeakPolarHBondContact CB-O 3.36Å; G762-S787 PolarHBondContact N-O 3.34Å; D785-S787 WeakPolarHBondContact OD1-CB 3.49Å; D785-S787 PolarHBondContact OD1-N 3.11Å; D785-S787 PolarHBondContact OD1-OG 3.2Å; S787-C789 PolarHBondContact O-N 3.33Å; S787-L813 CarbonylContact C-O 3.37Å; S787-L813 WeakPolarHBondContact CA-O 3.29Å; S787-L813 VanDerWaalsContact CB-O 3.26Å; S787-L813 WeakPolarHBondContact CB-O 3.4Å; S787-L813 PolarHBondContact OG-N 3.2Å
788	G	88	Confident	90.9	Very high	16 Å²	16	34 Å²	34	17%	0.165	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.1	12.3	-177.9	0	0	0	0	0	115.6	L786 E790 L813	L786-G788 PolarHBondContact O-N 3.46Å; G788-E790 PolarHBondContact O-N 3.16Å; G788-L813 PolarHBondContact N-O 3.12Å
789	C	90.3	Very high	90.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.187	C	C	.	.			trans	-83.6	92.2	168	-60.7	0	0	0	0	109.5	L760 L786 S787 L791 I792	L760-C789 PolarHBondContact O-SG 2.93Å; L786-C789 VanDerWaalsContact O-CB 3.26Å; L786-C789 WeakPolarHBondContact O-CB 3.43Å; L786-C789 PolarHBondContact O-N 3.21Å; L786-C789 VanDerWaalsContact O-N 3.1Å; L786-C789 PolarHBondContact O-SG 3.13Å; S787-C789 PolarHBondContact O-N 3.33Å; C789-L791 VanDerWaalsContact C-N 3.35Å; C789-L791 PolarHBondContact O-N 3.1Å; C789-I792 HydrophobicContact CB-CB 4.37Å; C789-I792 HydrophobicContact CB-CD1 3.45Å; C789-I792 VanDerWaalsContact CB-CD1 3.45Å; C789-I792 HydrophobicContact CB-CG1 3.79Å; C789-I792 PolarHBondContact O-N 3.24Å
790	E	85.8	Confident	91	Very high	100 Å²	100	33.3 Å²	33.3	47%	0.467	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-28.9	-168.3	-64.6	175.6	-173.4	0	0	114.4	G788 I792 S817	G788-E790 PolarHBondContact O-N 3.16Å; E790-I792 VanDerWaalsContact C-N 3.31Å; E790-I792 PolarHBondContact O-N 3.46Å; E790-S817 PolarHBondContact O-OG 3.28Å; E790-S817 VanDerWaalsContact O-OG 3.1Å
791	L	91	Very high	90.6	Very high	91 Å²	91	34.2 Å²	34.2	48%	0.476	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-0.7	-178.8	-55.3	176.5	0	0	0	113.6	K764 L766 T767 C789	K764-L791 WeakPolarHBondContact O-CD1 3.12Å; L766-L791 WeakPolarHBondContact O-CB 3.36Å; T767-L791 HydrophobicContact CG2-CB 3.94Å; T767-L791 HydrophobicContact CG2-CD1 4.05Å; C789-L791 VanDerWaalsContact C-N 3.35Å; C789-L791 PolarHBondContact O-N 3.1Å
792	I	92.4	Very high	90	Very high	1 Å²	1	38.5 Å²	38.5	1%	0.005	19%	0.194	C	C	.	.			trans	-86.5	123.3	175.2	-61.4	-176.2	0	0	0	108.9	L766 V771 L786 C789 E790 S796 S817 I818	L766-I792 HydrophobicContact CB-CD1 4.5Å; V771-I792 HydrophobicContact CG2-CD1 3.86Å; V771-I792 HydrophobicContact CG2-CG1 4.48Å; V771-I792 HydrophobicContact CG2-CG2 4.16Å; L786-I792 HydrophobicContact CB-CD1 4.09Å; L786-I792 HydrophobicContact CD1-CD1 3.96Å; L786-I792 HydrophobicContact CD2-CD1 3.73Å; L786-I792 HydrophobicContact CG-CD1 4.13Å; C789-I792 HydrophobicContact CB-CB 4.37Å; C789-I792 HydrophobicContact CB-CD1 3.45Å; C789-I792 VanDerWaalsContact CB-CD1 3.45Å; C789-I792 HydrophobicContact CB-CG1 3.79Å; C789-I792 PolarHBondContact O-N 3.24Å; E790-I792 VanDerWaalsContact C-N 3.31Å; E790-I792 PolarHBondContact O-N 3.46Å; I792-S796 WeakPolarHBondContact CG2-OG 3.26Å; I792-S817 WeakPolarHBondContact O-CB 3.32Å; I792-I818 HydrophobicContact CG2-CD1 4.35Å
793	T	91.2	Very high	89.3	Confident	49 Å²	49	35.1 Å²	35.1	30%	0.301	18%	0.184	S	C	.	.			trans	-108	-177.1	-176.4	78.3	0	0	0	0	111.1	D768 T795 S796	D768-T793 PolarHBondContact OD1-N 3.02Å; D768-T793 WeakPolarHBondContact OD2-CB 3.38Å; D768-T793 WeakPolarHBondContact OD2-CG2 3.16Å; D768-T793 PolarHBondContact OD2-N 3.26Å; D768-T793 PolarHBondContact OD2-OG1 2.84Å; T793-T795 PolarHBondContact O-N 3.2Å; T793-T795 VanDerWaalsContact O-N 3.13Å; T793-T795 PolarHBondContact OG1-N 2.73Å; T793-T795 PolarHBondContact OG1-OG1 3.11Å; T793-S796 WeakPolarHBondContact O-CB 3.38Å; T793-S796 PolarHBondContact O-N 2.53Å; T793-S796 PolarHBondContact O-OG 3.3Å
794	E	88.6	Confident	88.8	Confident	33 Å²	33	33.8 Å²	33.8	15%	0.154	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-13.3	177.2	-58.2	173.8	152.9	0	0	113.9	S796 L797 I818 K819 K822	E794-S796 VanDerWaalsContact C-N 3.31Å; E794-L797 WeakPolarHBondContact O-CB 3.05Å; E794-L797 PolarHBondContact O-N 3.17Å; E794-I818 HydrophobicContact CG-CB 4.49Å; E794-I818 HydrophobicContact CG-CG2 4.42Å; E794-K819 WeakPolarHBondContact OE1-CB 3.41Å; E794-K819 WeakPolarHBondContact OE1-CG 3.43Å; E794-K819 PolarHBondContact OE1-N 2.79Å; E794-K822 HydrophobicContact CB-CD 4.18Å; E794-K822 HydrophobicContact CB-CG 4.23Å; E794-K822 HydrophobicContact CG-CB 4.48Å; E794-K822 HydrophobicContact CG-CD 4.42Å; E794-K822 HydrophobicContact CG-CG 4.36Å; E794-K822 WeakPolarHBondContact OE2-CD 3.47Å; E794-K822 WeakPolarHBondContact OE2-CE 3.34Å; E794-K822 IonicContact OE2-NZ 3.64Å; E794-K822 PolarHBondContact OE2-NZ 3.33Å
795	T	88.3	Confident	88.2	Confident	72 Å²	72	41.2 Å²	41.2	44%	0.442	21%	0.211	S	C	.	.	H	α-helix	trans	-66.3	-35.2	177.6	68.8	0	0	0	0	111.4	D768 T793 L797 G798 F799	D768-T795 VanDerWaalsContact CB-OG1 3.23Å; D768-T795 WeakPolarHBondContact CB-OG1 3.39Å; D768-T795 PolarHBondContact OD1-OG1 3.12Å; D768-T795 PolarHBondContact OD2-OG1 3.29Å; T793-T795 PolarHBondContact O-N 3.2Å; T793-T795 VanDerWaalsContact O-N 3.13Å; T793-T795 PolarHBondContact OG1-N 2.73Å; T793-T795 PolarHBondContact OG1-OG1 3.11Å; T795-L797 PolarHBondContact O-N 3.39Å; T795-L797 VanDerWaalsContact O-N 3.15Å; T795-G798 PolarHBondContact O-N 2.79Å; T795-F799 PolarHBondContact O-N 3.25Å
796	S	90.1	Very high	87.8	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-50.8	-36.9	173.3	63.6	0	0	0	0	114	D768 I792 T793 E794 G798 F799 L800	D768-S796 VanDerWaalsContact OD1-CB 3.3Å; D768-S796 WeakPolarHBondContact OD1-CB 3.39Å; D768-S796 PolarHBondContact OD1-N 3.26Å; I792-S796 WeakPolarHBondContact CG2-OG 3.26Å; T793-S796 WeakPolarHBondContact O-CB 3.38Å; T793-S796 PolarHBondContact O-N 2.53Å; T793-S796 PolarHBondContact O-OG 3.3Å; E794-S796 VanDerWaalsContact C-N 3.31Å; S796-G798 VanDerWaalsContact C-N 3.27Å; S796-G798 PolarHBondContact O-N 2.84Å; S796-F799 WeakPolarHBondContact O-CB 3.45Å; S796-F799 PolarHBondContact O-N 3.21Å; S796-F799 VanDerWaalsContact O-N 3.14Å; S796-L800 WeakPolarHBondContact O-CG 3.37Å; S796-L800 PolarHBondContact O-N 3.09Å
797	L	88.7	Confident	87.6	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.016	23%	0.231	C	C	.	.	H	α-helix	trans	-63.8	-35.1	179.6	-58.2	177.1	0	0	0	111.8	E794 T795 R801 L810 L812 I818 L823	E794-L797 WeakPolarHBondContact O-CB 3.05Å; E794-L797 PolarHBondContact O-N 3.17Å; T795-L797 PolarHBondContact O-N 3.39Å; T795-L797 VanDerWaalsContact O-N 3.15Å; L797-R801 VanDerWaalsContact O-CB 3.24Å; L797-R801 WeakPolarHBondContact O-CB 3.15Å; L797-R801 PolarHBondContact O-N 2.99Å; L797-L810 HydrophobicContact CD2-CD2 4.3Å; L797-L812 HydrophobicContact CD2-CD1 4.01Å; L797-I818 HydrophobicContact CD1-CG2 4.04Å; L797-L823 HydrophobicContact CD1-CB 4.28Å; L797-L823 HydrophobicContact CD1-CD1 3.99Å; L797-L823 HydrophobicContact CD2-CD1 3.61Å; L797-L823 HydrophobicContact CG-CD1 4.47Å
798	G	85.5	Confident	87.5	Confident	25 Å²	25	48.9 Å²	48.9	26%	0.258	24%	0.244	S	C	.	.	H	α-helix	trans	-63.9	-42	174.7	0	0	0	0	0	111.8	T795 S796 K802	T795-G798 PolarHBondContact O-N 2.79Å; S796-G798 VanDerWaalsContact C-N 3.27Å; S796-G798 PolarHBondContact O-N 2.84Å; G798-K802 WeakPolarHBondContact O-CG 3.38Å; G798-K802 PolarHBondContact O-N 3.3Å
799	F	88.1	Confident	87.7	Confident	49 Å²	49	49.4 Å²	49.4	22%	0.215	24%	0.242	C	C	.	.	H	α-helix	trans	-66	-51.3	177.2	-60.1	-41.3	0	0	0	112.1	D768 Q772 S775 T795 S796 R801 K802 G803	D768-F799 HydrophobicContact CB-CE2 4.25Å; Q772-F799 HydrophobicContact CB-CD1 4.42Å; Q772-F799 HydrophobicContact CB-CD2 3.67Å; Q772-F799 HydrophobicContact CB-CE2 3.81Å; Q772-F799 HydrophobicContact CB-CG 4.02Å; Q772-F799 HydrophobicContact CB-CZ 4.25Å; Q772-F799 HydrophobicContact CG-CD1 3.95Å; Q772-F799 HydrophobicContact CG-CD2 4.1Å; Q772-F799 HydrophobicContact CG-CE1 3.95Å; Q772-F799 HydrophobicContact CG-CE2 4.11Å; Q772-F799 HydrophobicContact CG-CG 4.04Å; Q772-F799 HydrophobicContact CG-CZ 4.04Å; S775-F799 WeakPolarHBondContact CB-O 3.23Å; S775-F799 WeakPolarHBondContact OG-CB 3.23Å; T795-F799 PolarHBondContact O-N 3.25Å; S796-F799 WeakPolarHBondContact O-CB 3.45Å; S796-F799 PolarHBondContact O-N 3.21Å; S796-F799 VanDerWaalsContact O-N 3.14Å; F799-R801 VanDerWaalsContact C-N 3.25Å; F799-R801 PolarHBondContact O-N 3.23Å; F799-K802 PolarHBondContact O-N 3.2Å; F799-G803 PolarHBondContact O-N 3.1Å
800	L	88.8	Confident	87.9	Confident	6 Å²	6	49.4 Å²	49.4	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-55.8	-42.3	177.5	-68.7	175.8	0	0	0	111.9	V771 L784 S796 K802 C804 L807 L810	V771-L800 HydrophobicContact CG1-CD1 4.01Å; V771-L800 HydrophobicContact CG1-CD2 3.54Å; V771-L800 HydrophobicContact CG1-CG 3.53Å; L784-L800 HydrophobicContact CD2-CD1 4.06Å; L784-L800 HydrophobicContact CD2-CD2 3.55Å; L784-L800 HydrophobicContact CD2-CG 4.45Å; S796-L800 WeakPolarHBondContact O-CG 3.37Å; S796-L800 PolarHBondContact O-N 3.09Å; L800-K802 VanDerWaalsContact C-N 3.32Å; L800-K802 PolarHBondContact O-N 3.32Å; L800-C804 HydrophobicContact CD2-CB 4.45Å; L800-C804 PolarHBondContact O-N 2.82Å; L800-L807 HydrophobicContact CB-CD2 4.49Å; L800-L807 HydrophobicContact CD1-CD2 4.42Å; L800-L807 HydrophobicContact CD2-CD2 4.45Å; L800-L810 HydrophobicContact CD1-CD1 4Å; L800-L810 HydrophobicContact CD1-CD2 4Å
801	R	82.3	Confident	88.2	Confident	128 Å²	128	48.2 Å²	48.2	48%	0.483	23%	0.233	S	C	.	.	H	α-helix	trans	-63.4	-35.5	177.4	-171	-175.5	77.2	173.7	-0	113.1	L797 F799 S826 K830	L797-R801 VanDerWaalsContact O-CB 3.24Å; L797-R801 WeakPolarHBondContact O-CB 3.15Å; L797-R801 PolarHBondContact O-N 2.99Å; F799-R801 VanDerWaalsContact C-N 3.25Å; F799-R801 PolarHBondContact O-N 3.23Å; R801-S826 WeakPolarHBondContact CD-O 3.28Å; R801-K830 HydrophobicContact CG-CD 3.96Å
802	K	81.6	Confident	88.2	Confident	90 Å²	90	44 Å²	44	39%	0.391	21%	0.211	S	C	.	.	H	α-helix	trans	-76.8	-43.4	-179.6	-74.5	178.7	-177.7	-178.3	0	111	E195 G798 F799 L800	E195-K802 IonicContact OE1-NZ 2.7Å; E195-K802 PolarHBondContact OE1-NZ 2.94Å; G798-K802 WeakPolarHBondContact O-CG 3.38Å; G798-K802 PolarHBondContact O-N 3.3Å; F799-K802 PolarHBondContact O-N 3.2Å; L800-K802 VanDerWaalsContact C-N 3.32Å; L800-K802 PolarHBondContact O-N 3.32Å
803	G	80.3	Confident	88	Confident	15 Å²	15	46.1 Å²	46.1	16%	0.155	22%	0.222	C	C	.	.	H	α-helix	trans	-101.8	-44.2	-168	0	0	0	0	0	116.9	S775 F799 K805	S775-G803 CarbonylContact O-C 3.55Å; S775-G803 WeakPolarHBondContact O-CA 3.46Å; F799-G803 PolarHBondContact O-N 3.1Å; G803-K805 PolarHBondContact O-N 3.26Å; G803-K805 VanDerWaalsContact O-N 3.11Å
804	C	84.9	Confident	87.7	Confident	7 Å²	7	46.5 Å²	46.5	5%	0.047	22%	0.218	C	C	.	.			trans	-90.5	65.4	-173	-61.8	0	0	0	0	112	S775 L800 K806 L807	S775-C804 VanDerWaalsContact CA-SG 3.57Å; L800-C804 HydrophobicContact CD2-CB 4.45Å; L800-C804 PolarHBondContact O-N 2.82Å; C804-K806 PolarHBondContact O-N 3.44Å; C804-K806 VanDerWaalsContact O-N 3.08Å; C804-L807 HydrophobicContact CB-CB 4.01Å; C804-L807 HydrophobicContact CB-CD2 4.46Å; C804-L807 WeakPolarHBondContact O-CB 3.47Å; C804-L807 PolarHBondContact O-N 2.64Å; C804-L807 VanDerWaalsContact O-N 3.14Å
805	K	83.7	Confident	87.6	Confident	156 Å²	156	45 Å²	45	68%	0.678	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-14	-175.1	-64.3	-178.2	-179.2	174.3	0	115.1	G803	G803-K805 PolarHBondContact O-N 3.26Å; G803-K805 VanDerWaalsContact O-N 3.11Å
806	K	87.6	Confident	87.3	Confident	106 Å²	106	46.8 Å²	46.8	46%	0.461	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.1	10	179.5	-65.2	-171.8	175.7	179.9	0	113.4	Y780 L781 K782 C804 E808	Y780-K806 HydrophobicContact CD1-CD 4.45Å; L781-K806 CarbonylContact O-C 3.4Å; K782-K806 WeakPolarHBondContact CA-O 3.31Å; C804-K806 PolarHBondContact O-N 3.44Å; C804-K806 VanDerWaalsContact O-N 3.08Å; K806-E808 PolarHBondContact O-N 3.31Å
807	L	89.6	Confident	87.1	Confident	6 Å²	6	49.3 Å²	49.3	3%	0.031	23%	0.231	C	C	.	.			trans	-68.7	113.7	-177.8	-170.7	66.5	0	0	0	110.1	L781 L784 L800 C804 L810 I831	L781-L807 HydrophobicContact CD2-CD1 4.3Å; L781-L807 HydrophobicContact CG-CD1 4.24Å; L781-L807 VanDerWaalsContact O-CA 3.31Å; L781-L807 WeakPolarHBondContact O-CA 3.1Å; L781-L807 PolarHBondContact O-N 2.83Å; L781-L807 VanDerWaalsContact O-N 3.16Å; L784-L807 HydrophobicContact CB-CD1 3.96Å; L800-L807 HydrophobicContact CB-CD2 4.49Å; L800-L807 HydrophobicContact CD1-CD2 4.42Å; L800-L807 HydrophobicContact CD2-CD2 4.45Å; C804-L807 HydrophobicContact CB-CB 4.01Å; C804-L807 HydrophobicContact CB-CD2 4.46Å; C804-L807 WeakPolarHBondContact O-CB 3.47Å; C804-L807 PolarHBondContact O-N 2.64Å; C804-L807 VanDerWaalsContact O-N 3.14Å; L807-L810 HydrophobicContact CD2-CB 4.29Å; L807-I831 HydrophobicContact CD2-CD1 3.73Å; L807-I831 HydrophobicContact CD2-CG1 4.31Å; L807-I831 HydrophobicContact CG-CD1 4.35Å; L807-I831 HydrophobicContact CG-CG1 4.46Å
808	E	91.3	Very high	87	Confident	73 Å²	73	49.2 Å²	49.2	34%	0.341	23%	0.23	S	C	.	.			trans	-97.2	-37.1	-177.3	-71.2	162.7	-164.7	0	0	110.6	K782 K806 I831 E832 R833	K782-E808 IonicContact NZ-OE1 2.64Å; K782-E808 PolarHBondContact NZ-OE1 3.12Å; K782-E808 IonicContact NZ-OE2 3.63Å; K782-E808 PolarHBondContact NZ-OE2 3.16Å; K782-E808 PolarHBondContact O-N 2.99Å; K806-E808 PolarHBondContact O-N 3.31Å; E808-I831 WeakPolarHBondContact O-CG2 3.31Å; E808-E832 PolarHBondContact O-N 3.05Å; E808-E832 VanDerWaalsContact O-N 3.1Å; E808-R833 PolarHBondContact O-N 3.41Å
809	H	92.1	Very high	86.8	Confident	28 Å²	28	55.1 Å²	55.1	13%	0.13	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	121.8	-176.8	-172	-177	0	0	0	112.2	K782 F783 L784 R811 R833 E835	K782-H809 PolarHBondContact O-N 3.01Å; F783-H809 WeakPolarHBondContact CA-O 3.28Å; F783-H809 HydrophobicContact CD2-CB 3.88Å; F783-H809 AromaticContact CD2-CG 3.75Å; F783-H809 AromaticContact CD2-ND1 3.56Å; F783-H809 AromaticContact CE2-CE1 3.87Å; F783-H809 AromaticContact CE2-ND1 3.61Å; L784-H809 PolarHBondContact N-O 2.66Å; H809-R811 WeakPolarHBondContact NE2-CG 3.26Å; H809-R833 VanDerWaalsContact CA-O 3.3Å; H809-R833 WeakPolarHBondContact CA-O 3.26Å; H809-R833 HydrophobicContact CB-CB 4.35Å; H809-R833 PolarHBondContact CD2-O 3.24Å; H809-E835 IonicContact CE1-OE1 3.15Å; H809-E835 IonicContact NE2-OE1 3.52Å; H809-E835 PolarHBondContact NE2-OE1 2.66Å; H809-E835 IonicContact NE2-OE2 2.8Å
810	L	93.3	Very high	86.5	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	124.3	175.5	179	59.9	0	0	0	110.6	L784 L797 L800 L807 L812 I831 R833 I834 E835	L784-L810 HydrophobicContact CB-CD1 4.16Å; L784-L810 HydrophobicContact CD2-CD1 4.26Å; L784-L810 HydrophobicContact CG-CD1 4.27Å; L784-L810 WeakPolarHBondContact O-CA 3.31Å; L797-L810 HydrophobicContact CD2-CD2 4.3Å; L800-L810 HydrophobicContact CD1-CD1 4Å; L800-L810 HydrophobicContact CD1-CD2 4Å; L807-L810 HydrophobicContact CD2-CB 4.29Å; L810-L812 HydrophobicContact CD1-CD2 4.32Å; L810-L812 HydrophobicContact CD1-CG 4.19Å; L810-L812 HydrophobicContact CD2-CD1 3.83Å; L810-L812 HydrophobicContact CD2-CG 4.36Å; L810-L812 HydrophobicContact CG-CD1 3.99Å; L810-L812 HydrophobicContact CG-CG 3.98Å; L810-I831 HydrophobicContact CB-CD1 4.16Å; L810-I831 HydrophobicContact CB-CG2 4.2Å; L810-I831 HydrophobicContact CD2-CD1 3.85Å; L810-R833 PolarHBondContact N-O 3.38Å; L810-I834 WeakPolarHBondContact O-CA 3.26Å; L810-E835 PolarHBondContact O-N 2.86Å
811	R	92.3	Very high	86	Confident	75 Å²	75	69.2 Å²	69.2	28%	0.283	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	126.2	174.4	-71.6	-173.5	169.6	153.6	4.6	111.2	F783 L784 D785 L786 H809 E835	F783-R811 HydrophobicContact CE2-CG 4.23Å; L784-R811 PolarHBondContact O-N 2.71Å; D785-R811 HydrophobicContact CB-CB 4.05Å; D785-R811 VanDerWaalsContact CG-CB 3.47Å; D785-R811 WeakPolarHBondContact OD1-CB 3.1Å; D785-R811 WeakPolarHBondContact OD2-CD 3.1Å; D785-R811 IonicContact OD2-NH1 3.69Å; L786-R811 PolarHBondContact N-O 3.44Å; H809-R811 WeakPolarHBondContact NE2-CG 3.26Å; R811-E835 HydrophobicContact CG-CB 4.17Å; R811-E835 IonicContact CZ-OE2 3.92Å; R811-E835 IonicContact NE-OE1 3.18Å; R811-E835 IonicContact NE-OE2 3.93Å; R811-E835 PolarHBondContact NE-OE2 3.23Å; R811-E835 IonicContact NH2-OE2 2.86Å
812	L	91.1	Very high	85.8	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.005	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	46.8	-176.5	-64.3	171.6	0	0	0	109.9	L786 L797 L810 C815 I818 L823 E835 H836 S837	L786-L812 HydrophobicContact CB-CD2 3.84Å; L786-L812 HydrophobicContact CD1-CD2 4.19Å; L797-L812 HydrophobicContact CD2-CD1 4.01Å; L810-L812 HydrophobicContact CD1-CD2 4.32Å; L810-L812 HydrophobicContact CD1-CG 4.19Å; L810-L812 HydrophobicContact CD2-CD1 3.83Å; L810-L812 HydrophobicContact CD2-CG 4.36Å; L810-L812 HydrophobicContact CG-CD1 3.99Å; L810-L812 HydrophobicContact CG-CG 3.98Å; L812-C815 HydrophobicContact CB-CB 4.35Å; L812-I818 HydrophobicContact CD1-CD1 3.94Å; L812-I818 HydrophobicContact CD2-CD1 3.86Å; L812-I818 HydrophobicContact CG-CD1 4.4Å; L812-L823 HydrophobicContact CD1-CD1 3.72Å; L812-E835 PolarHBondContact N-O 3.3Å; L812-H836 PolarHBondContact O-CD2 3.17Å; L812-H836 VanDerWaalsContact O-CD2 3.3Å; L812-S837 PolarHBondContact O-N 3.34Å
813	L	87.9	Confident	85.9	Confident	47 Å²	47	63.7 Å²	63.7	25%	0.246	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	138.6	177.1	-58.4	175.7	0	0	0	109.4	S787 G788 C815 E835	S787-L813 CarbonylContact C-O 3.37Å; S787-L813 WeakPolarHBondContact CA-O 3.29Å; S787-L813 VanDerWaalsContact CB-O 3.26Å; S787-L813 WeakPolarHBondContact CB-O 3.4Å; S787-L813 PolarHBondContact OG-N 3.2Å; G788-L813 PolarHBondContact N-O 3.12Å; L813-C815 PolarHBondContact O-N 3.2Å; L813-E835 HydrophobicContact CD2-CB 4.12Å; L813-E835 HydrophobicContact CG-CB 4.48Å
814	Y	86.3	Confident	85.7	Confident	56 Å²	56	66.6 Å²	66.6	22%	0.22	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.9	21.4	179.3	-34.5	-63.2	0	0	0	114.3	K816 S837 D839 P841 P842	Y814-K816 PolarHBondContact O-N 3.14Å; Y814-S837 WeakPolarHBondContact CA-O 3.39Å; Y814-S837 PolarHBondContact N-O 3.18Å; Y814-D839 WeakPolarHBondContact CD1-O 3.34Å; Y814-P841 HydrophobicContact CD1-CB 4.26Å; Y814-P841 HydrophobicContact CD2-CB 4.1Å; Y814-P841 HydrophobicContact CE2-CB 4.41Å; Y814-P841 HydrophobicContact CG-CB 4.01Å; Y814-P842 VanDerWaalsContact OH-CD 3.31Å; Y814-P842 WeakPolarHBondContact OH-CD 3.23Å
815	C	85.4	Confident	85.4	Confident	1 Å²	1	76.1 Å²	76.1	1%	0.007	33%	0.33	C	S	.	.			trans	-88.3	82.6	175.9	-68.1	0	0	0	0	110.8	L786 L812 L813 S817 I818 S837	L786-C815 PolarHBondContact O-SG 2.73Å; L812-C815 HydrophobicContact CB-CB 4.35Å; L813-C815 PolarHBondContact O-N 3.2Å; C815-S817 PolarHBondContact O-N 3.42Å; C815-S817 VanDerWaalsContact O-N 3.17Å; C815-I818 HydrophobicContact CB-CB 4.46Å; C815-I818 HydrophobicContact CB-CD1 4.11Å; C815-I818 HydrophobicContact CB-CG1 4.4Å; C815-I818 PolarHBondContact O-N 3.1Å; C815-I818 VanDerWaalsContact O-N 3.14Å; C815-S837 PolarHBondContact N-O 3.38Å
816	K	82.9	Confident	84.9	Confident	110 Å²	110	69.7 Å²	69.7	48%	0.478	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-31.5	-175.6	-64.8	-176.5	178	-177.3	0	113.6	Y814 I818 E840	Y814-K816 PolarHBondContact O-N 3.14Å; K816-I818 VanDerWaalsContact C-N 3.29Å; K816-I818 PolarHBondContact O-N 3.35Å; K816-E840 IonicContact NZ-OE1 2.98Å; K816-E840 PolarHBondContact NZ-OE1 3.5Å
817	S	85.7	Confident	84.3	Confident	54 Å²	54	65.2 Å²	65.2	38%	0.378	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-2.5	-177.4	-58.3	0	0	0	0	114.6	E790 I792 C815	E790-S817 PolarHBondContact O-OG 3.28Å; E790-S817 VanDerWaalsContact O-OG 3.1Å; I792-S817 WeakPolarHBondContact O-CB 3.32Å; C815-S817 PolarHBondContact O-N 3.42Å; C815-S817 VanDerWaalsContact O-N 3.17Å
818	I	85.8	Confident	83.4	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	31%	0.314	C	S	.	.	S	Bend	trans	-113.1	112.2	179.5	-60.8	175.1	0	0	0	109.9	I792 E794 L797 L812 C815 K816 L823 H836	I792-I818 HydrophobicContact CG2-CD1 4.35Å; E794-I818 HydrophobicContact CG-CB 4.49Å; E794-I818 HydrophobicContact CG-CG2 4.42Å; L797-I818 HydrophobicContact CD1-CG2 4.04Å; L812-I818 HydrophobicContact CD1-CD1 3.94Å; L812-I818 HydrophobicContact CD2-CD1 3.86Å; L812-I818 HydrophobicContact CG-CD1 4.4Å; C815-I818 HydrophobicContact CB-CB 4.46Å; C815-I818 HydrophobicContact CB-CD1 4.11Å; C815-I818 HydrophobicContact CB-CG1 4.4Å; C815-I818 PolarHBondContact O-N 3.1Å; C815-I818 VanDerWaalsContact O-N 3.14Å; K816-I818 VanDerWaalsContact C-N 3.29Å; K816-I818 PolarHBondContact O-N 3.35Å; I818-L823 HydrophobicContact CG2-CB 4.25Å; I818-H836 PolarHBondContact O-CE1 3.3Å; I818-H836 VanDerWaalsContact O-CE1 3.25Å; I818-H836 PolarHBondContact O-NE2 3.31Å
819	K	82.9	Confident	82.4	Confident	150 Å²	150	71.1 Å²	71.1	65%	0.652	34%	0.339	S	S	*	.			trans	-82.3	134.7	178.3	-57.4	176.1	178.4	175.6	0	110.8	E794 R821 K822 L823	E794-K819 WeakPolarHBondContact OE1-CB 3.41Å; E794-K819 WeakPolarHBondContact OE1-CG 3.43Å; E794-K819 PolarHBondContact OE1-N 2.79Å; K819-R821 PolarHBondContact O-N 3.21Å; K819-R821 VanDerWaalsContact O-N 3.1Å; K819-K822 PolarHBondContact O-N 2.78Å; K819-L823 PolarHBondContact O-N 3.36Å; K819-L823 VanDerWaalsContact O-N 3.07Å
820	K	80.3	Confident	81.7	Confident	141 Å²	141	76 Å²	76	61%	0.613	36%	0.36	S	S	*	.	H	α-helix	trans	-50.8	-39.3	-179.4	-171.1	172.6	-177.1	174.3	0	113.7	K822 L823 I824	K820-K822 PolarHBondContact O-N 2.63Å; K820-L823 WeakPolarHBondContact O-CB 3.21Å; K820-L823 PolarHBondContact O-N 3.13Å; K820-I824 HydrophobicContact CG-CD1 3.93Å; K820-I824 WeakPolarHBondContact O-CB 3.1Å; K820-I824 VanDerWaalsContact O-CG1 3.27Å; K820-I824 WeakPolarHBondContact O-CG1 3.4Å; K820-I824 PolarHBondContact O-N 3.25Å
821	R	79	Confident	81.2	Confident	210 Å²	210	77.2 Å²	77.2	79%	0.792	37%	0.366	S	S	*	.	H	α-helix	trans	-61.5	-43.3	178.5	-73.3	-176.8	-179.3	157.9	0.7	112.9	K819 R825	K819-R821 PolarHBondContact O-N 3.21Å; K819-R821 VanDerWaalsContact O-N 3.1Å; R821-R825 WeakPolarHBondContact O-CG 3.3Å; R821-R825 PolarHBondContact O-N 3.01Å; R821-R825 VanDerWaalsContact O-N 3.13Å
822	K	78.4	Confident	80.7	Confident	96 Å²	96	81.7 Å²	81.7	42%	0.417	39%	0.39	S	S	.	.	H	α-helix	trans	-77.4	-33.5	-178.6	-175.2	140.9	152.2	-144.9	0	111.6	E794 K819 K820 S826	E794-K822 HydrophobicContact CB-CD 4.18Å; E794-K822 HydrophobicContact CB-CG 4.23Å; E794-K822 HydrophobicContact CG-CB 4.48Å; E794-K822 HydrophobicContact CG-CD 4.42Å; E794-K822 HydrophobicContact CG-CG 4.36Å; E794-K822 WeakPolarHBondContact OE2-CD 3.47Å; E794-K822 WeakPolarHBondContact OE2-CE 3.34Å; E794-K822 IonicContact OE2-NZ 3.64Å; E794-K822 PolarHBondContact OE2-NZ 3.33Å; K819-K822 PolarHBondContact O-N 2.78Å; K820-K822 PolarHBondContact O-N 2.63Å; K822-S826 VanDerWaalsContact O-CB 3.28Å; K822-S826 WeakPolarHBondContact O-CB 3.39Å; K822-S826 PolarHBondContact O-N 3.1Å; K822-S826 PolarHBondContact O-OG 3.46Å
823	L	82.9	Confident	80.4	Confident	5 Å²	5	88.3 Å²	88.3	3%	0.026	42%	0.415	C	S	.	.	H	α-helix	trans	-54	-60	168.3	-179.8	65	0	0	0	110.7	L797 L812 I818 K819 K820 R825 S826 T827 I834 H836	L797-L823 HydrophobicContact CD1-CB 4.28Å; L797-L823 HydrophobicContact CD1-CD1 3.99Å; L797-L823 HydrophobicContact CD2-CD1 3.61Å; L797-L823 HydrophobicContact CG-CD1 4.47Å; L812-L823 HydrophobicContact CD1-CD1 3.72Å; I818-L823 HydrophobicContact CG2-CB 4.25Å; K819-L823 PolarHBondContact O-N 3.36Å; K819-L823 VanDerWaalsContact O-N 3.07Å; K820-L823 WeakPolarHBondContact O-CB 3.21Å; K820-L823 PolarHBondContact O-N 3.13Å; L823-R825 PolarHBondContact O-N 3.32Å; L823-S826 PolarHBondContact O-N 3.07Å; L823-T827 HydrophobicContact CD1-CG2 4.05Å; L823-T827 PolarHBondContact O-N 3.48Å; L823-T827 PolarHBondContact O-OG1 3.37Å; L823-I834 HydrophobicContact CD1-CG2 4.19Å; L823-I834 HydrophobicContact CD2-CG2 3.79Å; L823-I834 HydrophobicContact CG-CG2 4.22Å; L823-H836 HydrophobicContact CD2-CB 3.35Å; L823-H836 VanDerWaalsContact CD2-CG 3.46Å
824	I	76.6	Confident	80.4	Confident	77 Å²	77	88.9 Å²	88.9	40%	0.395	42%	0.418	S	S	.	.	H	α-helix	trans	-52.1	-53.6	179.1	-70.6	169.1	0	0	0	110.7	K820 S826 T827 I828	K820-I824 HydrophobicContact CG-CD1 3.93Å; K820-I824 WeakPolarHBondContact O-CB 3.1Å; K820-I824 VanDerWaalsContact O-CG1 3.27Å; K820-I824 WeakPolarHBondContact O-CG1 3.4Å; K820-I824 PolarHBondContact O-N 3.25Å; I824-S826 PolarHBondContact O-N 3.36Å; I824-S826 VanDerWaalsContact O-N 3.16Å; I824-T827 PolarHBondContact O-N 2.97Å; I824-I828 HydrophobicContact CG2-CD1 3.29Å; I824-I828 HydrophobicContact CG2-CG1 3.72Å; I824-I828 WeakPolarHBondContact O-CB 3.43Å; I824-I828 VanDerWaalsContact O-CD1 3.31Å; I824-I828 WeakPolarHBondContact O-CD1 3.44Å; I824-I828 WeakPolarHBondContact O-CG1 3.34Å; I824-I828 PolarHBondContact O-N 3.24Å
825	R	78.2	Confident	80.5	Confident	207 Å²	207	88.1 Å²	88.1	78%	0.781	42%	0.416	S	S	*	.	H	α-helix	trans	-57.8	-32.1	179.2	-76.5	-179.2	177.8	167.9	-1.4	113.9	R821 L823	R821-R825 WeakPolarHBondContact O-CG 3.3Å; R821-R825 PolarHBondContact O-N 3.01Å; R821-R825 VanDerWaalsContact O-N 3.13Å; L823-R825 PolarHBondContact O-N 3.32Å
826	S	73.9	Confident	80.6	Confident	21 Å²	21	90 Å²	90	15%	0.147	43%	0.425	C	S	.	.	H	α-helix	trans	-84.6	-25.4	-175.8	-57.5	0	0	0	0	113.2	R801 K822 L823 I824	R801-S826 WeakPolarHBondContact CD-O 3.28Å; K822-S826 VanDerWaalsContact O-CB 3.28Å; K822-S826 WeakPolarHBondContact O-CB 3.39Å; K822-S826 PolarHBondContact O-N 3.1Å; K822-S826 PolarHBondContact O-OG 3.46Å; L823-S826 PolarHBondContact O-N 3.07Å; I824-S826 PolarHBondContact O-N 3.36Å; I824-S826 VanDerWaalsContact O-N 3.16Å
827	T	73.5	Confident	80.7	Confident	11 Å²	11	85.5 Å²	85.5	7%	0.067	41%	0.408	C	S	.	.	H	α-helix	trans	-120.3	-9.9	-167.9	61.2	0	0	0	0	115.2	L823 I824 G829 K830 I831 I834	L823-T827 HydrophobicContact CD1-CG2 4.05Å; L823-T827 PolarHBondContact O-N 3.48Å; L823-T827 PolarHBondContact O-OG1 3.37Å; I824-T827 PolarHBondContact O-N 2.97Å; T827-G829 PolarHBondContact O-N 2.82Å; T827-K830 PolarHBondContact O-N 3.29Å; T827-I831 HydrophobicContact CG2-CD1 3.77Å; T827-I831 PolarHBondContact O-N 3.06Å; T827-I834 HydrophobicContact CG2-CD1 3.95Å; T827-I834 WeakPolarHBondContact OG1-CD1 3.45Å
828	I	71.3	Confident	80.6	Confident	119 Å²	119	86.3 Å²	86.3	61%	0.61	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47	127	176.3	-81.9	157.8	0	0	0	110.9	I824 K830	I824-I828 HydrophobicContact CG2-CD1 3.29Å; I824-I828 HydrophobicContact CG2-CG1 3.72Å; I824-I828 WeakPolarHBondContact O-CB 3.43Å; I824-I828 VanDerWaalsContact O-CD1 3.31Å; I824-I828 WeakPolarHBondContact O-CD1 3.44Å; I824-I828 WeakPolarHBondContact O-CG1 3.34Å; I824-I828 PolarHBondContact O-N 3.24Å; I828-K830 PolarHBondContact O-N 3.44Å
829	G	69.9	Low	80.4	Confident	85 Å²	85	91.2 Å²	91.2	88%	0.876	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.1	4.3	174.7	0	0	0	0	0	115.4	T827	T827-G829 PolarHBondContact O-N 2.82Å
830	K	77.3	Confident	80	Confident	131 Å²	131	91 Å²	91	57%	0.57	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.8	-39	-176.9	-66.1	-173.4	177.1	-172.1	0	114.2	R801 T827 I828	R801-K830 HydrophobicContact CG-CD 3.96Å; T827-K830 PolarHBondContact O-N 3.29Å; I828-K830 PolarHBondContact O-N 3.44Å
831	I	83	Confident	79.5	Confident	24 Å²	24	87.5 Å²	87.5	12%	0.123	43%	0.429	C	S	.	.			trans	-112.7	128.5	178.2	-55.3	172.9	0	0	0	107.2	L807 E808 L810 T827 R833 I834	L807-I831 HydrophobicContact CD2-CD1 3.73Å; L807-I831 HydrophobicContact CD2-CG1 4.31Å; L807-I831 HydrophobicContact CG-CD1 4.35Å; L807-I831 HydrophobicContact CG-CG1 4.46Å; E808-I831 WeakPolarHBondContact O-CG2 3.31Å; L810-I831 HydrophobicContact CB-CD1 4.16Å; L810-I831 HydrophobicContact CB-CG2 4.2Å; L810-I831 HydrophobicContact CD2-CD1 3.85Å; T827-I831 HydrophobicContact CG2-CD1 3.77Å; T827-I831 PolarHBondContact O-N 3.06Å; I831-R833 WeakPolarHBondContact CG2-O 3.33Å; I831-I834 HydrophobicContact CB-CD1 4.04Å; I831-I834 HydrophobicContact CB-CG1 4.01Å; I831-I834 HydrophobicContact CD1-CD1 4.4Å; I831-I834 HydrophobicContact CG2-CD1 4.36Å; I831-I834 HydrophobicContact CG2-CG1 3.78Å
832	E	82.5	Confident	78.7	Confident	170 Å²	170	80 Å²	80	79%	0.794	41%	0.408	S	S	*	.	S	Bend	trans	-70.1	-40.6	-173.3	-60.2	-171.6	160.8	0	0	112.5	E808	E808-E832 PolarHBondContact O-N 3.05Å; E808-E832 VanDerWaalsContact O-N 3.1Å
833	R	85.1	Confident	77.6	Confident	139 Å²	139	81.2 Å²	81.2	53%	0.525	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	124.8	-177.1	-173.3	175	174.6	160.5	-2.1	111.3	E808 H809 L810 I831 E835	E808-R833 PolarHBondContact O-N 3.41Å; H809-R833 VanDerWaalsContact CA-O 3.3Å; H809-R833 WeakPolarHBondContact CA-O 3.26Å; H809-R833 HydrophobicContact CB-CB 4.35Å; H809-R833 PolarHBondContact CD2-O 3.24Å; L810-R833 PolarHBondContact N-O 3.38Å; I831-R833 WeakPolarHBondContact CG2-O 3.33Å; R833-E835 IonicContact CZ-OE1 2.72Å; R833-E835 IonicContact NE-OE1 3.88Å; R833-E835 PolarHBondContact NE-OE1 2.85Å; R833-E835 IonicContact NH2-OE1 2.81Å; R833-E835 PolarHBondContact NH2-OE1 3.03Å
834	I	87.3	Confident	75.9	Confident	59 Å²	59	86.5 Å²	86.5	30%	0.303	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	124.7	177.2	-54.1	177	0	0	0	109.1	L810 L823 T827 I831	L810-I834 WeakPolarHBondContact O-CA 3.26Å; L823-I834 HydrophobicContact CD1-CG2 4.19Å; L823-I834 HydrophobicContact CD2-CG2 3.79Å; L823-I834 HydrophobicContact CG-CG2 4.22Å; T827-I834 HydrophobicContact CG2-CD1 3.95Å; T827-I834 WeakPolarHBondContact OG1-CD1 3.45Å; I831-I834 HydrophobicContact CB-CD1 4.04Å; I831-I834 HydrophobicContact CB-CG1 4.01Å; I831-I834 HydrophobicContact CD1-CD1 4.4Å; I831-I834 HydrophobicContact CG2-CD1 4.36Å; I831-I834 HydrophobicContact CG2-CG1 3.78Å
835	E	88.1	Confident	74.3	Confident	40 Å²	40	83.9 Å²	83.9	19%	0.187	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	119.5	174.3	-66	170	-162	0	0	107.8	H809 L810 R811 L812 L813 R833	H809-E835 IonicContact CE1-OE1 3.15Å; H809-E835 IonicContact NE2-OE1 3.52Å; H809-E835 PolarHBondContact NE2-OE1 2.66Å; H809-E835 IonicContact NE2-OE2 2.8Å; L810-E835 PolarHBondContact O-N 2.86Å; R811-E835 HydrophobicContact CG-CB 4.17Å; R811-E835 IonicContact CZ-OE2 3.92Å; R811-E835 IonicContact NE-OE1 3.18Å; R811-E835 IonicContact NE-OE2 3.93Å; R811-E835 PolarHBondContact NE-OE2 3.23Å; R811-E835 IonicContact NH2-OE2 2.86Å; L812-E835 PolarHBondContact N-O 3.3Å; L813-E835 HydrophobicContact CD2-CB 4.12Å; L813-E835 HydrophobicContact CG-CB 4.48Å; R833-E835 IonicContact CZ-OE1 2.72Å; R833-E835 IonicContact NE-OE1 3.88Å; R833-E835 PolarHBondContact NE-OE1 2.85Å; R833-E835 IonicContact NH2-OE1 2.81Å; R833-E835 PolarHBondContact NH2-OE1 3.03Å
836	H	87.9	Confident	72.6	Confident	40 Å²	40	79.3 Å²	79.3	19%	0.185	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	135.7	-177.3	172.2	-104.9	0	0	0	110.3	L812 I818 L823	L812-H836 PolarHBondContact O-CD2 3.17Å; L812-H836 VanDerWaalsContact O-CD2 3.3Å; I818-H836 PolarHBondContact O-CE1 3.3Å; I818-H836 VanDerWaalsContact O-CE1 3.25Å; I818-H836 PolarHBondContact O-NE2 3.31Å; L823-H836 HydrophobicContact CD2-CB 3.35Å; L823-H836 VanDerWaalsContact CD2-CG 3.46Å
837	S	84.9	Confident	70.9	Confident	17 Å²	17	80 Å²	80	12%	0.119	44%	0.439	C	S	.	.			trans	-147.3	147.6	172.1	161.2	0	0	0	0	108.2	L812 Y814 C815 D839	L812-S837 PolarHBondContact O-N 3.34Å; Y814-S837 WeakPolarHBondContact CA-O 3.39Å; Y814-S837 PolarHBondContact N-O 3.18Å; C815-S837 PolarHBondContact N-O 3.38Å; S837-D839 VanDerWaalsContact OG-CB 3.29Å; S837-D839 WeakPolarHBondContact OG-CB 3.37Å; S837-D839 PolarHBondContact OG-N 3.26Å; S837-D839 PolarHBondContact OG-OD2 2.87Å
838	T	83.2	Confident	69.1	Low	70 Å²	70	85.2 Å²	85.2	43%	0.429	46%	0.459	S	S	.	.			trans	-108.2	9.5	171.3	52.3	0	0	0	0	111.8
839	D	82.6	Confident	67.6	Low	103 Å²	103	81.7 Å²	81.7	55%	0.551	44%	0.44	S	S	*	.	S	Bend	trans	-67.1	165.4	-177.8	-52.5	-39.3	0	0	0	109.9	Y814 S837	Y814-D839 WeakPolarHBondContact CD1-O 3.34Å; S837-D839 VanDerWaalsContact OG-CB 3.29Å; S837-D839 WeakPolarHBondContact OG-CB 3.37Å; S837-D839 PolarHBondContact OG-N 3.26Å; S837-D839 PolarHBondContact OG-OD2 2.87Å
840	E	74.3	Confident	66	Low	147 Å²	147	80.6 Å²	80.6	69%	0.687	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-71.3	139.8	168.3	-58.5	-148.5	132.6	0	0	109.7	K816	K816-E840 IonicContact NZ-OE1 2.98Å; K816-E840 PolarHBondContact NZ-OE1 3.5Å
841	P	68.9	Low	64.1	Low	66 Å²	66	78.7 Å²	78.7	43%	0.429	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-59.1	130.8	175.1	23.9	-30.8	0	0	0	108.7	Y814	Y814-P841 HydrophobicContact CD1-CB 4.26Å; Y814-P841 HydrophobicContact CD2-CB 4.1Å; Y814-P841 HydrophobicContact CE2-CB 4.41Å; Y814-P841 HydrophobicContact CG-CB 4.01Å
842	P	63.6	Low	61.9	Low	54 Å²	54	83.5 Å²	83.5	35%	0.351	43%	0.428	S	S	.	.	P	Polyproline II helix	trans	-52.6	142.4	174.4	-19.5	23.7	0	0	0	109.6	Y814 E844 S845	Y814-P842 VanDerWaalsContact OH-CD 3.31Å; Y814-P842 WeakPolarHBondContact OH-CD 3.23Å; P842-E844 PolarHBondContact O-N 3.1Å; P842-S845 WeakPolarHBondContact O-CB 3.37Å; P842-S845 PolarHBondContact O-N 2.94Å; P842-S845 PolarHBondContact O-OG 3.2Å
843	P	54.7	Low	59.6	Low	120 Å²	120	76.6 Å²	76.6	78%	0.779	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	-35.2	174.8	-24.7	32.3	0	0	0	111.7
844	E	46.8	Very low	56.9	Low	117 Å²	117	72.7 Å²	72.7	55%	0.547	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-13.3	179.3	-59.9	179.7	177	0	0	114.8	P842 I846 G847 Y848	P842-E844 PolarHBondContact O-N 3.1Å; E844-I846 PolarHBondContact O-N 3.17Å; E844-I846 VanDerWaalsContact O-N 3.12Å; E844-G847 WeakPolarHBondContact O-CA 3.15Å; E844-G847 PolarHBondContact O-N 3.27Å; E844-Y848 HydrophobicContact CB-CD2 3.93Å; E844-Y848 HydrophobicContact CB-CE2 3.57Å; E844-Y848 WeakPolarHBondContact O-CD2 3.5Å; E844-Y848 PolarHBondContact O-N 3.38Å; E844-Y848 VanDerWaalsContact O-N 3.11Å; E844-Y848 WeakPolarHBondContact OE2-CE2 3.39Å; E844-Y848 PolarHBondContact OE2-OH 3.14Å
845	S	42.9	Very low	55.4	Low	22 Å²	22	73.4 Å²	73.4	15%	0.154	40%	0.398	C	S	.	.	H	α-helix	trans	-63.4	-18.4	176	65	0	0	0	0	112.1	P842 G847	P842-S845 WeakPolarHBondContact O-CB 3.37Å; P842-S845 PolarHBondContact O-N 2.94Å; P842-S845 PolarHBondContact O-OG 3.2Å; S845-G847 PolarHBondContact O-N 2.56Å
846	I	43.6	Very low	53.7	Low	111 Å²	111	75.1 Å²	75.1	57%	0.569	41%	0.409	S	S	*	.	H	α-helix	trans	-74.4	-9.9	168.8	-51.4	172.3	0	0	0	111.6	R710 E844	R710-I846 PolarHBondContact NH1-O 3.33Å; R710-I846 PolarHBondContact NH2-O 3.32Å; E844-I846 PolarHBondContact O-N 3.17Å; E844-I846 VanDerWaalsContact O-N 3.12Å
847	G	38	Very low	51.8	Low	36 Å²	36	77.1 Å²	77.1	37%	0.371	42%	0.421	S	S	.	.	H	α-helix	trans	-108.6	-33.5	174	0	0	0	0	0	114.8	E844 S845 L849 I850	E844-G847 WeakPolarHBondContact O-CA 3.15Å; E844-G847 PolarHBondContact O-N 3.27Å; S845-G847 PolarHBondContact O-N 2.56Å; G847-L849 VanDerWaalsContact C-N 3.33Å; G847-L849 PolarHBondContact O-N 3Å; G847-L849 VanDerWaalsContact O-N 3.16Å; G847-I850 PolarHBondContact O-N 2.7Å
848	Y	36.1	Very low	49.8	Very low	120 Å²	120	80.6 Å²	80.6	47%	0.471	44%	0.439	S	S	.	.	H	α-helix	trans	-58.7	-33.2	-166.1	-90.9	-80.2	0	0	0	115.5	E844 I850 K851	E844-Y848 HydrophobicContact CB-CD2 3.93Å; E844-Y848 HydrophobicContact CB-CE2 3.57Å; E844-Y848 WeakPolarHBondContact O-CD2 3.5Å; E844-Y848 PolarHBondContact O-N 3.38Å; E844-Y848 VanDerWaalsContact O-N 3.11Å; E844-Y848 WeakPolarHBondContact OE2-CE2 3.39Å; E844-Y848 PolarHBondContact OE2-OH 3.14Å; Y848-I850 VanDerWaalsContact C-N 3.3Å; Y848-I850 PolarHBondContact O-N 3.35Å; Y848-K851 PolarHBondContact O-N 2.98Å
849	L	38.6	Very low	47.7	Very low	44 Å²	44	81.3 Å²	81.3	23%	0.23	44%	0.44	C	S	.	.	H	α-helix	trans	-72.1	-15	-177.1	-86.2	153.3	0	0	0	115.1	F736 G847 K851	F736-L849 HydrophobicContact CE2-CD1 3.52Å; F736-L849 HydrophobicContact CZ-CD1 4.18Å; G847-L849 VanDerWaalsContact C-N 3.33Å; G847-L849 PolarHBondContact O-N 3Å; G847-L849 VanDerWaalsContact O-N 3.16Å; L849-K851 VanDerWaalsContact C-N 3.25Å; L849-K851 PolarHBondContact O-N 3.37Å
850	I	36.8	Very low	45.4	Very low	63 Å²	63	79.8 Å²	79.8	32%	0.323	43%	0.433	S	S	.	.	H	α-helix	trans	-66.1	-30.9	177.8	-62	167.5	0	0	0	110.6	G847 Y848	G847-I850 PolarHBondContact O-N 2.7Å; Y848-I850 VanDerWaalsContact C-N 3.3Å; Y848-I850 PolarHBondContact O-N 3.35Å
851	K	37.8	Very low	43.3	Very low	90 Å²	90	75 Å²	75	39%	0.391	41%	0.414	S	S	.	.	H	α-helix	trans	-88.6	-29.4	-174	-71.9	-163.9	176.8	-163	0	115	Y848 L849 N853	Y848-K851 PolarHBondContact O-N 2.98Å; L849-K851 VanDerWaalsContact C-N 3.25Å; L849-K851 PolarHBondContact O-N 3.37Å; K851-N853 VanDerWaalsContact C-N 3.27Å; K851-N853 PolarHBondContact O-N 2.98Å
852	E	36.4	Very low	41.4	Very low	125 Å²	125	75.7 Å²	75.7	58%	0.584	41%	0.413	S	S	*	.	H	α-helix	trans	-73.3	-19.3	179.6	-87.6	-172.9	167.5	0	0	113.4	F464	F464-E852 HydrophobicContact CE1-CG 4.31Å; F464-E852 HydrophobicContact CZ-CG 3.81Å
853	N	34.4	Very low	39.5	Very low	26 Å²	26	77.5 Å²	77.5	14%	0.139	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-3.5	-174.9	-82.1	-43.5	0	0	0	114.4	N683 N685 K707 K851	N683-N853 PolarHBondContact ND2-O 3.11Å; N685-N853 WeakPolarHBondContact ND2-CB 3.46Å; N685-N853 PolarHBondContact ND2-ND2 3.29Å; K707-N853 PolarHBondContact NZ-OD1 2.95Å; K851-N853 VanDerWaalsContact C-N 3.27Å; K851-N853 PolarHBondContact O-N 2.98Å
854	A	28.1	Very low	38.1	Very low	56 Å²	56	73.6 Å²	73.6	46%	0.463	39%	0.386	S	S	.	.			trans	-94.8	0	173.8	0	0	0	0	0	109.8	A634	A634-A854 HydrophobicContact CB-CB 4.29Å

Retrieved 854 of 854 residues in 266.1 ms (Link to these results)

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