A0A087Y0V1_POEFO Loading...

GRB2 associated, regulator of MAPK1

AlphaFold DB , UniProt , Accession A0A087Y0V1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 869 aa.

						>A0A087Y0V1_POEFO|A0A087Y0V1
MEANCSKMDLGTMLYNNLKDVTWSTTSLPLDQLVSTYKLPQIVKLDNGQSVEGLRDNDYLLIHSCRQWTTITAHSLEEGHYVIGPKIEIPVHYEGQFKLLEQDRDVKEPVQYFNSVEEVAKAFPERVYVMEEITFNVKMASGECNEDTEVYNITLSTGDELTLMGQAEILYAKSSKEKSRLNTIFKKIGKLNSISKIGRGKMPCLICMNHRTNESISLPFQCKGRFSTCSPLELQMQYGEHTIRNIVEKTRLPVNVVVPGTPPRNQYDLHLIREGHRYKLVNIQTKTVVVCCVLRSNKIIPTHFPFHMAMPRFIVPEELLQGELWLETMVHRWFSFCQEQFDIDDYSRAVRDVRADWNEDGSSPKKSSGNGSCGGNGGSGSSNGCPGHKQVPSSLTYARDELTQSFHRLSVCVYGSNLHGNSEVNLQGCMTLCGDWALPPSDGSHSESGENEHLFPELSDFTSQHADLSKLDVPYEELWLDHLKRQSPKPSSSEGVRVANDDCATTASLYPVTCPLSARTSLDVPLTPPPVPPKSEAVKEECRLLNAPPIPPRSMKQLPSVPIPSKPRQQDTRSPSPTLSYYSSGLHNISGATEQEGAELQEQSHVCYPCSWGNASTTEKRATSPSGGPPLEGVSSRLSWPNNFIGGDAHCTDEFVPVSCRSYFSYPRKRTPSSSKTCAISLDDYDGRELACHRGEFSLQKGPTDQICIKSSSYNSEMYRNKPIEESNTKQSLSCPILPPRTPKSNAIKKCPDFPTESVSDESQRAAVQTELGTNEICSSSATLNCPSVSPTAQWQPPLNLSGISIEEVSKCLKFIGLPNDIVSLFVSEKIDGNLLLQLTEEILSEDFHLSKLQVKKLMQFINGWRPKI
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.5	Very low	54.2	Low	246 Å²	246	129 Å²	129	100%	1.212	70%	0.7	S	S	*	*				0	91.7	0	-77.9	175.5	168.2	0	0	106.9
2	E	34	Very low	56.7	Low	192 Å²	192	122.3 Å²	122.3	90%	0.897	67%	0.667	S	S	*	*			trans	-105.9	132.9	171.9	-70.4	177	122.1	0	0	107.7	N4	E2-N4 PolarHBondContact O-N 3.43Å; E2-N4 VanDerWaalsContact O-N 3.15Å
3	A	42.8	Very low	59	Low	97 Å²	97	119.7 Å²	119.7	80%	0.802	65%	0.649	S	S	*	*			trans	-79.9	100.1	-177.1	0	0	0	0	0	109.2	C5	A3-C5 PolarHBondContact O-N 3.26Å
4	N	39.3	Very low	61	Low	161 Å²	161	111.9 Å²	111.9	86%	0.861	61%	0.606	S	S	*	*			trans	-63.4	79.8	159.6	-90.1	-19.3	0	0	0	108.7	E2 S6	E2-N4 PolarHBondContact O-N 3.43Å; E2-N4 VanDerWaalsContact O-N 3.15Å; N4-S6 PolarHBondContact O-N 3.23Å
5	C	42	Very low	62.8	Low	119 Å²	119	107.5 Å²	107.5	80%	0.804	58%	0.578	S	S	*	*			trans	-70	84.3	168.2	-168.9	0	0	0	0	107.2	A3 K7	A3-C5 PolarHBondContact O-N 3.26Å; C5-K7 PolarHBondContact O-N 3.32Å
6	S	48.4	Very low	64.3	Low	91 Å²	91	104.5 Å²	104.5	64%	0.636	56%	0.562	S	S	*	*			trans	-57.7	111.5	176.1	47.1	0	0	0	0	108.3	N4 M8	N4-S6 PolarHBondContact O-N 3.23Å; S6-M8 VanDerWaalsContact C-N 3.31Å; S6-M8 PolarHBondContact O-N 3.25Å
7	K	47.5	Very low	65.7	Low	208 Å²	208	101.4 Å²	101.4	90%	0.904	55%	0.545	S	S	*	.			trans	-60.7	93.6	179.6	-169.9	178.8	-175.4	-178	0	108.1	C5 D9	C5-K7 PolarHBondContact O-N 3.32Å; K7-D9 PolarHBondContact O-N 2.9Å
8	M	61.3	Low	66.9	Low	134 Å²	134	95.7 Å²	95.7	66%	0.66	51%	0.514	S	S	*	.			trans	-59.2	128.6	-175.7	-72.5	-168	179.3	0	0	109	S6	S6-M8 VanDerWaalsContact C-N 3.31Å; S6-M8 PolarHBondContact O-N 3.25Å
9	D	80.1	Confident	67.9	Low	83 Å²	83	97 Å²	97	44%	0.444	52%	0.515	S	S	.	.			trans	-59.6	142.8	173.1	166.6	55.7	0	0	0	110.5	K7 G11 T12 M13	K7-D9 PolarHBondContact O-N 2.9Å; D9-G11 VanDerWaalsContact C-N 3.28Å; D9-G11 PolarHBondContact O-N 3.04Å; D9-G11 VanDerWaalsContact OD2-CA 3.28Å; D9-G11 WeakPolarHBondContact OD2-CA 3.41Å; D9-G11 PolarHBondContact OD2-N 2.87Å; D9-T12 WeakPolarHBondContact O-CB 3.43Å; D9-T12 PolarHBondContact O-N 3.19Å; D9-T12 VanDerWaalsContact O-N 3.14Å; D9-T12 PolarHBondContact OD2-N 3.45Å; D9-M13 PolarHBondContact O-N 3.26Å
10	L	81.8	Confident	68.8	Low	84 Å²	84	98.1 Å²	98.1	44%	0.44	52%	0.521	S	S	.	.	H	α-helix	trans	-61.7	-39	-178.1	-178	60.7	0	0	0	111.1	M13 L14 F336	L10-M13 HydrophobicContact CD1-CE 3.79Å; L10-M13 PolarHBondContact O-N 3.21Å; L10-L14 HydrophobicContact CD1-CD1 4.49Å; L10-L14 HydrophobicContact CD1-CG 4.46Å; L10-L14 HydrophobicContact CG-CD1 4.19Å; L10-L14 WeakPolarHBondContact O-CB 3.4Å; L10-L14 VanDerWaalsContact O-CG 3.31Å; L10-L14 WeakPolarHBondContact O-CG 3.41Å; L10-L14 PolarHBondContact O-N 2.65Å; L10-F336 HydrophobicContact CB-CE2 4.29Å; L10-F336 HydrophobicContact CD2-CD2 3.96Å; L10-F336 HydrophobicContact CD2-CE2 4.37Å; L10-F336 HydrophobicContact CG-CD2 4.18Å; L10-F336 HydrophobicContact CG-CE2 4.34Å
11	G	81.7	Confident	69.9	Low	4 Å²	4	93.7 Å²	93.7	4%	0.041	50%	0.498	C	S	.	.	H	α-helix	trans	-63.8	-41.4	174.4	0	0	0	0	0	112.5	D9 L14 Y15	D9-G11 VanDerWaalsContact C-N 3.28Å; D9-G11 PolarHBondContact O-N 3.04Å; D9-G11 VanDerWaalsContact OD2-CA 3.28Å; D9-G11 WeakPolarHBondContact OD2-CA 3.41Å; D9-G11 PolarHBondContact OD2-N 2.87Å; G11-L14 PolarHBondContact O-N 3.15Å; G11-Y15 VanDerWaalsContact O-CB 3.25Å; G11-Y15 WeakPolarHBondContact O-CB 3.41Å; G11-Y15 PolarHBondContact O-N 2.9Å
12	T	84.6	Confident	72.5	Confident	49 Å²	49	85.8 Å²	85.8	30%	0.301	46%	0.463	S	S	.	.	H	α-helix	trans	-63.2	-40.9	173.2	-65.1	0	0	0	0	112.2	D9 Y15 N16 S296	D9-T12 WeakPolarHBondContact O-CB 3.43Å; D9-T12 PolarHBondContact O-N 3.19Å; D9-T12 VanDerWaalsContact O-N 3.14Å; D9-T12 PolarHBondContact OD2-N 3.45Å; T12-Y15 PolarHBondContact O-N 2.76Å; T12-N16 PolarHBondContact O-N 3.16Å; T12-N16 VanDerWaalsContact O-N 3.09Å; T12-N16 PolarHBondContact O-ND2 3.42Å; T12-S296 PolarHBondContact OG1-O 3.41Å; T12-S296 VanDerWaalsContact OG1-O 3.07Å
13	M	85.9	Confident	75.3	Confident	88 Å²	88	79.3 Å²	79.3	43%	0.433	43%	0.431	S	S	.	.	H	α-helix	trans	-62.9	-50.5	175.7	-171.2	-167.8	78.6	0	0	111.1	D9 L10 Y15 N16 N17	D9-M13 PolarHBondContact O-N 3.26Å; L10-M13 HydrophobicContact CD1-CE 3.79Å; L10-M13 PolarHBondContact O-N 3.21Å; M13-Y15 VanDerWaalsContact C-N 3.29Å; M13-Y15 PolarHBondContact O-N 3.3Å; M13-N16 PolarHBondContact O-N 3.01Å; M13-N17 PolarHBondContact O-N 3.35Å; M13-N17 PolarHBondContact O-ND2 2.88Å
14	L	86.6	Confident	77.7	Confident	10 Å²	10	75.1 Å²	75.1	5%	0.052	40%	0.395	C	S	.	.	H	α-helix	trans	-60.8	-37.3	177.4	-69.5	171.8	0	0	0	112	L10 G11 N16 N17 R332 W333 F336	L10-L14 HydrophobicContact CD1-CD1 4.49Å; L10-L14 HydrophobicContact CD1-CG 4.46Å; L10-L14 HydrophobicContact CG-CD1 4.19Å; L10-L14 WeakPolarHBondContact O-CB 3.4Å; L10-L14 VanDerWaalsContact O-CG 3.31Å; L10-L14 WeakPolarHBondContact O-CG 3.41Å; L10-L14 PolarHBondContact O-N 2.65Å; G11-L14 PolarHBondContact O-N 3.15Å; L14-N16 PolarHBondContact O-N 3.45Å; L14-N17 WeakPolarHBondContact O-CB 3.05Å; L14-N17 PolarHBondContact O-N 3.49Å; L14-R332 HydrophobicContact CD2-CB 4.09Å; L14-W333 HydrophobicContact CB-CD2 4.17Å; L14-W333 HydrophobicContact CB-CE3 4.5Å; L14-W333 HydrophobicContact CB-CH2 3.94Å; L14-W333 HydrophobicContact CB-CZ2 3.56Å; L14-W333 HydrophobicContact CB-CZ3 4.38Å; L14-W333 HydrophobicContact CD1-CD2 4.5Å; L14-W333 HydrophobicContact CD1-CE3 4.46Å; L14-W333 WeakPolarHBondContact O-CZ2 3.28Å; L14-F336 HydrophobicContact CD1-CB 3.69Å; L14-F336 HydrophobicContact CD1-CD1 3.89Å; L14-F336 HydrophobicContact CD1-CD2 4.27Å; L14-F336 HydrophobicContact CD1-CG 3.68Å
15	Y	88.3	Confident	80.2	Confident	47 Å²	47	74.2 Å²	74.2	18%	0.184	40%	0.396	C	S	.	.	H	α-helix	trans	-68.1	-30.9	176.8	-169.6	-89.3	0	0	0	113.7	G11 T12 M13 L18 Y59 L294	G11-Y15 VanDerWaalsContact O-CB 3.25Å; G11-Y15 WeakPolarHBondContact O-CB 3.41Å; G11-Y15 PolarHBondContact O-N 2.9Å; T12-Y15 PolarHBondContact O-N 2.76Å; M13-Y15 VanDerWaalsContact C-N 3.29Å; M13-Y15 PolarHBondContact O-N 3.3Å; Y15-L18 HydrophobicContact CD2-CD1 4.33Å; Y15-L18 PolarHBondContact O-N 3.12Å; Y15-Y59 AromaticContact CE2-CD2 3.85Å; Y15-Y59 HydrophobicContact CE2-CD2 3.85Å; Y15-Y59 HydrophobicContact CE2-CE2 4.19Å; Y15-L294 WeakPolarHBondContact CE2-O 3.37Å
16	N	87.2	Confident	82.7	Confident	59 Å²	59	70.9 Å²	70.9	32%	0.316	37%	0.372	S	S	.	.	H	α-helix	trans	-67.1	-39.5	172.9	-73.8	-38.9	0	0	0	111.6	T12 M13 L14 L18 K19	T12-N16 PolarHBondContact O-N 3.16Å; T12-N16 VanDerWaalsContact O-N 3.09Å; T12-N16 PolarHBondContact O-ND2 3.42Å; M13-N16 PolarHBondContact O-N 3.01Å; L14-N16 PolarHBondContact O-N 3.45Å; N16-L18 PolarHBondContact O-N 2.93Å; N16-K19 VanDerWaalsContact O-CB 3.29Å; N16-K19 WeakPolarHBondContact O-CB 3.37Å; N16-K19 PolarHBondContact O-N 2.87Å; N16-K19 PolarHBondContact OD1-NZ 3.38Å
17	N	87.3	Confident	84.8	Confident	51 Å²	51	67.7 Å²	67.7	27%	0.273	35%	0.349	S	S	.	.	H	α-helix	trans	-60.5	-26.9	177.6	-73.1	-108	0	0	0	113	M13 L14 K19 D20 M329	M13-N17 PolarHBondContact O-N 3.35Å; M13-N17 PolarHBondContact O-ND2 2.88Å; L14-N17 WeakPolarHBondContact O-CB 3.05Å; L14-N17 PolarHBondContact O-N 3.49Å; N17-K19 PolarHBondContact O-N 2.79Å; N17-D20 PolarHBondContact O-N 2.83Å; N17-M329 HydrophobicContact CB-CE 3.79Å; N17-M329 HydrophobicContact CB-SD 4.42Å
18	L	88.9	Confident	87	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-15.1	175.7	-66.5	179.5	0	0	0	114.2	Y15 N16 I42 Y59 L294 M329 W333	Y15-L18 HydrophobicContact CD2-CD1 4.33Å; Y15-L18 PolarHBondContact O-N 3.12Å; N16-L18 PolarHBondContact O-N 2.93Å; L18-I42 HydrophobicContact CD2-CD1 4.19Å; L18-I42 HydrophobicContact CD2-CG2 3.98Å; L18-Y59 HydrophobicContact CB-CD2 4.07Å; L18-Y59 HydrophobicContact CB-CE2 3.93Å; L18-Y59 HydrophobicContact CB-CG 4.45Å; L18-Y59 HydrophobicContact CD1-CD2 3.72Å; L18-Y59 HydrophobicContact CD1-CE2 4.4Å; L18-Y59 HydrophobicContact CD1-CG 3.92Å; L18-Y59 PolarHBondContact O-OH 2.78Å; L18-L294 HydrophobicContact CD1-CB 4.28Å; L18-L294 HydrophobicContact CD1-CD1 3.91Å; L18-M329 HydrophobicContact CD2-SD 4.19Å; L18-W333 HydrophobicContact CD1-CH2 4.43Å; L18-W333 HydrophobicContact CD1-CZ2 3.48Å; L18-W333 VanDerWaalsContact CD1-CZ2 3.48Å; L18-W333 HydrophobicContact CG-CZ2 3.97Å
19	K	85.3	Confident	88.6	Confident	120 Å²	120	53.2 Å²	53.2	52%	0.522	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-23.8	175.6	-58.3	169.8	-178.5	169.4	0	112.1	N16 N17	N16-K19 VanDerWaalsContact O-CB 3.29Å; N16-K19 WeakPolarHBondContact O-CB 3.37Å; N16-K19 PolarHBondContact O-N 2.87Å; N16-K19 PolarHBondContact OD1-NZ 3.38Å; N17-K19 PolarHBondContact O-N 2.79Å
20	D	86	Confident	89.2	Confident	119 Å²	119	49.3 Å²	49.3	64%	0.636	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-13.4	-178.2	-50.7	-48	0	0	0	111.9	N17	N17-D20 PolarHBondContact O-N 2.83Å
21	V	90.8	Very high	89.7	Confident	6 Å²	6	48.6 Å²	48.6	4%	0.036	26%	0.261	C	S	.	.	S	Bend	trans	-67.5	130.7	172.1	176.8	0	0	0	0	110.5	W23 P316 W325 M329	V21-W23 HydrophobicContact CB-CZ2 4.23Å; V21-W23 HydrophobicContact CG1-CD2 4.41Å; V21-W23 HydrophobicContact CG1-CH2 4.45Å; V21-W23 HydrophobicContact CG1-CZ2 3.9Å; V21-W23 PolarHBondContact O-NE1 3.49Å; V21-P316 HydrophobicContact CG1-CB 3.83Å; V21-P316 HydrophobicContact CG1-CG 4.15Å; V21-W325 HydrophobicContact CG2-CH2 4.2Å; V21-W325 HydrophobicContact CG2-CZ3 4.28Å; V21-M329 HydrophobicContact CG2-CE 4.27Å; V21-M329 HydrophobicContact CG2-SD 3.68Å
22	T	92.6	Very high	90.2	Very high	79 Å²	79	52.8 Å²	52.8	49%	0.485	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-87.2	122.8	176.1	63.8	0	0	0	0	110.8	E317 E318	T22-E317 WeakPolarHBondContact O-CB 3.24Å; T22-E317 PolarHBondContact O-N 3.14Å; T22-E318 WeakPolarHBondContact CB-OE1 3.5Å; T22-E318 PolarHBondContact N-OE1 2.86Å; T22-E318 PolarHBondContact OG1-OE1 2.92Å
23	W	93	Very high	90.7	Very high	57 Å²	57	50.4 Å²	50.4	22%	0.216	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	123.2	-174.5	-64	89	0	0	0	110.2	V21 I42 K44 Y59 I314 P316	V21-W23 HydrophobicContact CB-CZ2 4.23Å; V21-W23 HydrophobicContact CG1-CD2 4.41Å; V21-W23 HydrophobicContact CG1-CH2 4.45Å; V21-W23 HydrophobicContact CG1-CZ2 3.9Å; V21-W23 PolarHBondContact O-NE1 3.49Å; W23-I42 HydrophobicContact CH2-CG2 4.02Å; W23-K44 HydrophobicContact CD2-CB 4.06Å; W23-K44 HydrophobicContact CD2-CD 4.02Å; W23-K44 HydrophobicContact CE3-CB 3.57Å; W23-K44 HydrophobicContact CE3-CD 4.3Å; W23-K44 HydrophobicContact CG-CD 4.22Å; W23-K44 HydrophobicContact CH2-CB 3.84Å; W23-K44 HydrophobicContact CZ2-CB 4.34Å; W23-K44 HydrophobicContact CZ3-CB 3.45Å; W23-K44 VanDerWaalsContact CZ3-CB 3.45Å; W23-Y59 AromaticContact CE2-CE1 3.65Å; W23-Y59 AromaticContact CH2-CD1 3.87Å; W23-Y59 HydrophobicContact CH2-CD1 3.87Å; W23-Y59 HydrophobicContact CH2-CE1 4.23Å; W23-Y59 AromaticContact CZ2-CD1 3.42Å; W23-Y59 HydrophobicContact CZ2-CD1 3.42Å; W23-Y59 VanDerWaalsContact CZ2-CD1 3.42Å; W23-Y59 AromaticContact CZ2-CE1 3.36Å; W23-Y59 HydrophobicContact CZ2-CE1 3.36Å; W23-Y59 AromaticContact NE1-CE1 3.78Å; W23-I314 HydrophobicContact CB-CG2 4.29Å; W23-I314 HydrophobicContact CE3-CG2 4.28Å; W23-P316 HydrophobicContact CE3-CG 4.42Å; W23-P316 HydrophobicContact CH2-CG 4.21Å; W23-P316 HydrophobicContact CZ3-CG 3.86Å
24	S	93.8	Very high	91.1	Very high	8 Å²	8	47.3 Å²	47.3	6%	0.056	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	171.7	-179.1	72.4	0	0	0	0	112.4	T26 I314 V315 E317	S24-T26 WeakPolarHBondContact OG-CB 3.34Å; S24-T26 PolarHBondContact OG-N 3.49Å; S24-I314 WeakPolarHBondContact O-CG2 3.49Å; S24-V315 WeakPolarHBondContact CB-O 3.27Å; S24-V315 PolarHBondContact N-O 3.13Å; S24-V315 PolarHBondContact OG-O 3.47Å; S24-E317 WeakPolarHBondContact CB-OE2 3.37Å
25	T	91.4	Very high	91.5	Very high	143 Å²	143	51.6 Å²	51.6	88%	0.877	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	0.4	165.1	53.7	0	0	0	0	113	S27	T25-S27 PolarHBondContact O-N 2.77Å
26	T	93.6	Very high	91.7	Very high	49 Å²	49	53.3 Å²	53.3	30%	0.301	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	96.1	-173.1	-55.8	0	0	0	0	111.2	S24 L28 V315	S24-T26 WeakPolarHBondContact OG-CB 3.34Å; S24-T26 PolarHBondContact OG-N 3.49Å; T26-L28 HydrophobicContact CG2-CD1 4.5Å; T26-L28 HydrophobicContact CG2-CD2 3.83Å; T26-L28 HydrophobicContact CG2-CG 3.99Å; T26-V315 HydrophobicContact CG2-CG2 4.24Å; T26-V315 PolarHBondContact O-N 3.23Å
27	S	93.2	Very high	92	Very high	23 Å²	23	52.9 Å²	52.9	16%	0.161	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	119.9	169.1	163.2	0	0	0	0	110.5	T25 D46 R312	T25-S27 PolarHBondContact O-N 2.77Å; S27-D46 VanDerWaalsContact CB-OD2 3.23Å; S27-D46 WeakPolarHBondContact CB-OD2 3.29Å; S27-D46 PolarHBondContact OG-OD2 3.38Å; S27-R312 PolarHBondContact O-NH2 2.76Å; S27-R312 WeakPolarHBondContact OG-CB 3.44Å; S27-R312 PolarHBondContact OG-NE 2.88Å
28	L	93.9	Very high	92.3	Very high	17 Å²	17	59.6 Å²	59.6	9%	0.089	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	143.8	177.8	-59.7	-179.8	0	0	0	111	T26 L33 Y37 R312 F313 V315	T26-L28 HydrophobicContact CG2-CD1 4.5Å; T26-L28 HydrophobicContact CG2-CD2 3.83Å; T26-L28 HydrophobicContact CG2-CG 3.99Å; L28-L33 HydrophobicContact CB-CB 4.47Å; L28-Y37 HydrophobicContact CD1-CE2 3.76Å; L28-R312 CarbonylContact O-C 3.55Å; L28-R312 WeakPolarHBondContact O-CA 3.11Å; L28-F313 PolarHBondContact N-O 2.63Å; L28-F313 PolarHBondContact O-N 3.12Å; L28-V315 HydrophobicContact CD1-CG1 4.22Å
29	P	93.8	Very high	92.6	Very high	22 Å²	22	62 Å²	62	14%	0.143	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	150	167.9	35	-35.5	0	0	0	110.2	D31 Q32 L33 M310	P29-D31 VanDerWaalsContact C-N 3.28Å; P29-D31 VanDerWaalsContact CB-OD1 3.32Å; P29-D31 WeakPolarHBondContact CB-OD1 3.43Å; P29-D31 WeakPolarHBondContact CG-OD1 3.43Å; P29-D31 PolarHBondContact O-N 2.94Å; P29-Q32 HydrophobicContact CG-CB 3.79Å; P29-Q32 PolarHBondContact O-N 2.74Å; P29-Q32 VanDerWaalsContact O-N 3.17Å; P29-L33 PolarHBondContact O-N 2.92Å; P29-M310 HydrophobicContact CB-CB 4.11Å
30	L	92.9	Very high	93.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-58.7	-34.1	-170.4	-175	59.8	0	0	0	114.6	L33 V34 I62 V289 F304 M310 P311 F313	L30-L33 PolarHBondContact O-N 3.36Å; L30-V34 HydrophobicContact CD1-CG2 4.13Å; L30-V34 HydrophobicContact CG-CG2 4.42Å; L30-V34 WeakPolarHBondContact O-CB 3.43Å; L30-V34 VanDerWaalsContact O-CG2 3.26Å; L30-V34 WeakPolarHBondContact O-CG2 3.49Å; L30-V34 PolarHBondContact O-N 3.2Å; L30-I62 HydrophobicContact CD1-CD1 3.58Å; L30-I62 HydrophobicContact CD1-CG1 4.23Å; L30-V289 HydrophobicContact CD1-CG1 4.28Å; L30-V289 HydrophobicContact CD2-CB 3.94Å; L30-V289 HydrophobicContact CD2-CG1 4.27Å; L30-V289 HydrophobicContact CD2-CG2 3.86Å; L30-V289 HydrophobicContact CG-CB 4.46Å; L30-V289 HydrophobicContact CG-CG1 4.48Å; L30-V289 HydrophobicContact CG-CG2 4.04Å; L30-F304 HydrophobicContact CD2-CB 3.55Å; L30-F304 HydrophobicContact CD2-CD2 3.55Å; L30-F304 HydrophobicContact CD2-CG 3.75Å; L30-M310 HydrophobicContact CB-CB 4.31Å; L30-M310 HydrophobicContact CB-CG 4.48Å; L30-M310 HydrophobicContact CB-SD 3.96Å; L30-M310 HydrophobicContact CD2-SD 4.32Å; L30-M310 HydrophobicContact CG-SD 4.47Å; L30-P311 HydrophobicContact CD2-CG 4.45Å; L30-P311 PolarHBondContact N-O 3.37Å; L30-P311 VanDerWaalsContact N-O 3.11Å; L30-F313 HydrophobicContact CB-CD2 4.2Å; L30-F313 HydrophobicContact CB-CE2 3.99Å; L30-F313 HydrophobicContact CD1-CD2 3.97Å; L30-F313 HydrophobicContact CD1-CE2 3.8Å; L30-F313 HydrophobicContact CD2-CE2 4.15Å; L30-F313 HydrophobicContact CG-CE2 4.19Å
31	D	92.6	Very high	93.6	Very high	69 Å²	69	53.2 Å²	53.2	37%	0.369	29%	0.291	S	S	.	.	H	α-helix	trans	-67.9	-43.6	176.9	61.1	-35.6	0	0	0	112.5	P29 L33 S35 F306 M310	P29-D31 VanDerWaalsContact C-N 3.28Å; P29-D31 VanDerWaalsContact CB-OD1 3.32Å; P29-D31 WeakPolarHBondContact CB-OD1 3.43Å; P29-D31 WeakPolarHBondContact CG-OD1 3.43Å; P29-D31 PolarHBondContact O-N 2.94Å; D31-L33 VanDerWaalsContact C-N 3.31Å; D31-L33 PolarHBondContact O-N 2.8Å; D31-S35 WeakPolarHBondContact O-CB 3.38Å; D31-S35 PolarHBondContact O-N 3.44Å; D31-S35 PolarHBondContact O-OG 2.93Å; D31-F306 HydrophobicContact CB-CD1 4.05Å; D31-F306 HydrophobicContact CB-CE1 3.6Å; D31-M310 HydrophobicContact CB-CG 3.88Å; D31-M310 HydrophobicContact CB-SD 4.49Å
32	Q	93.4	Very high	93.9	Very high	92 Å²	92	53 Å²	53	43%	0.43	29%	0.289	S	S	.	.	H	α-helix	trans	-62.9	-40.6	172.8	-173.9	177.8	2.1	0	0	110.7	P29 S35 T36	P29-Q32 HydrophobicContact CG-CB 3.79Å; P29-Q32 PolarHBondContact O-N 2.74Å; P29-Q32 VanDerWaalsContact O-N 3.17Å; Q32-S35 WeakPolarHBondContact CA-OG 3.21Å; Q32-S35 PolarHBondContact O-N 3.3Å; Q32-S35 PolarHBondContact O-OG 2.76Å; Q32-S35 VanDerWaalsContact O-OG 3.12Å; Q32-T36 WeakPolarHBondContact O-CB 3.47Å; Q32-T36 PolarHBondContact O-N 3.45Å; Q32-T36 PolarHBondContact O-OG1 2.76Å
33	L	94.6	Very high	94	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.2	-49.5	-179.7	-158	164.3	0	0	0	111.4	L28 P29 L30 D31 S35 T36 Y37 Q41 V43 I62 F313 V315	L28-L33 HydrophobicContact CB-CB 4.47Å; P29-L33 PolarHBondContact O-N 2.92Å; L30-L33 PolarHBondContact O-N 3.36Å; D31-L33 VanDerWaalsContact C-N 3.31Å; D31-L33 PolarHBondContact O-N 2.8Å; L33-S35 VanDerWaalsContact C-N 3.27Å; L33-S35 PolarHBondContact O-N 3Å; L33-T36 PolarHBondContact O-N 2.92Å; L33-Y37 HydrophobicContact CD2-CD2 4.06Å; L33-Y37 HydrophobicContact CG-CD2 4.07Å; L33-Y37 WeakPolarHBondContact O-CD2 3.45Å; L33-Y37 PolarHBondContact O-N 3.41Å; L33-Q41 HydrophobicContact CD2-CB 4.5Å; L33-V43 HydrophobicContact CD1-CG1 3.65Å; L33-V43 HydrophobicContact CD2-CG1 4.32Å; L33-I62 HydrophobicContact CD1-CD1 4.05Å; L33-I62 HydrophobicContact CD2-CD1 3.68Å; L33-I62 HydrophobicContact CG-CD1 4.41Å; L33-F313 HydrophobicContact CD1-CB 4.27Å; L33-V315 HydrophobicContact CD1-CG1 3.77Å; L33-V315 HydrophobicContact CG-CG1 4.24Å
34	V	94.7	Very high	94	Very high	23 Å²	23	47.9 Å²	47.9	14%	0.139	26%	0.262	C	S	.	.	H	α-helix	trans	-65.8	-25.2	178.8	167.2	0	0	0	0	113.3	L30 L39 I62 C65 V289 F306	L30-V34 HydrophobicContact CD1-CG2 4.13Å; L30-V34 HydrophobicContact CG-CG2 4.42Å; L30-V34 WeakPolarHBondContact O-CB 3.43Å; L30-V34 VanDerWaalsContact O-CG2 3.26Å; L30-V34 WeakPolarHBondContact O-CG2 3.49Å; L30-V34 PolarHBondContact O-N 3.2Å; V34-L39 HydrophobicContact CG1-CD1 4.23Å; V34-L39 HydrophobicContact CG2-CD1 4.28Å; V34-L39 HydrophobicContact CG2-CD2 4.49Å; V34-I62 HydrophobicContact CG2-CG2 4.12Å; V34-C65 HydrophobicContact CG1-CB 3.65Å; V34-V289 HydrophobicContact CG2-CG1 3.98Å; V34-V289 HydrophobicContact CG2-CG2 3.99Å; V34-F306 HydrophobicContact CB-CZ 4.44Å; V34-F306 HydrophobicContact CG1-CZ 4.09Å
35	S	93.8	Very high	93.9	Very high	99 Å²	99	47.6 Å²	47.6	69%	0.692	26%	0.26	S	S	*	.	H	α-helix	trans	-90.1	-22	175.2	54	0	0	0	0	114.2	D31 Q32 L33	D31-S35 WeakPolarHBondContact O-CB 3.38Å; D31-S35 PolarHBondContact O-N 3.44Å; D31-S35 PolarHBondContact O-OG 2.93Å; Q32-S35 WeakPolarHBondContact CA-OG 3.21Å; Q32-S35 PolarHBondContact O-N 3.3Å; Q32-S35 PolarHBondContact O-OG 2.76Å; Q32-S35 VanDerWaalsContact O-OG 3.12Å; L33-S35 VanDerWaalsContact C-N 3.27Å; L33-S35 PolarHBondContact O-N 3Å
36	T	94	Very high	93.8	Very high	84 Å²	84	42.4 Å²	42.4	52%	0.515	23%	0.227	S	C	.	.	H	α-helix	trans	-90.8	-40.5	-179.6	-56.2	0	0	0	0	112.6	Q32 L33	Q32-T36 WeakPolarHBondContact O-CB 3.47Å; Q32-T36 PolarHBondContact O-N 3.45Å; Q32-T36 PolarHBondContact O-OG1 2.76Å; L33-T36 PolarHBondContact O-N 2.92Å
37	Y	93.6	Very high	93.2	Very high	50 Å²	50	45.1 Å²	45.1	20%	0.196	24%	0.24	C	C	.	.	S	Bend	trans	-110.7	141.2	-172.1	-58.9	-84.3	0	0	0	112.2	L28 L33 L39 L319 L320	L28-Y37 HydrophobicContact CD1-CE2 3.76Å; L33-Y37 HydrophobicContact CD2-CD2 4.06Å; L33-Y37 HydrophobicContact CG-CD2 4.07Å; L33-Y37 WeakPolarHBondContact O-CD2 3.45Å; L33-Y37 PolarHBondContact O-N 3.41Å; Y37-L39 PolarHBondContact O-N 2.86Å; Y37-L319 HydrophobicContact CD1-CD1 4.02Å; Y37-L319 HydrophobicContact CD1-CD2 3.85Å; Y37-L319 HydrophobicContact CD1-CG 3.84Å; Y37-L319 HydrophobicContact CE1-CD1 4.34Å; Y37-L319 HydrophobicContact CE1-CD2 3.96Å; Y37-L319 HydrophobicContact CE1-CG 3.75Å; Y37-L319 HydrophobicContact CG-CD2 4.17Å; Y37-L320 WeakPolarHBondContact OH-CD2 3.4Å
38	K	93.3	Very high	92.4	Very high	191 Å²	191	47.3 Å²	47.3	83%	0.83	27%	0.265	S	S	*	.	P	Polyproline II helix	trans	-64.6	131.6	170.2	-66.7	-179.6	-177.9	174.4	0	109.4	Q41	K38-Q41 VanDerWaalsContact O-CG 3.31Å; K38-Q41 WeakPolarHBondContact O-CG 3.43Å; K38-Q41 PolarHBondContact O-NE2 3.16Å
39	L	94.8	Very high	91.7	Very high	52 Å²	52	49.2 Å²	49.2	27%	0.272	27%	0.274	S	S	.	.	S	Bend	trans	-86.6	154.6	175.5	-61.7	-175.3	0	0	0	111.5	V34 Y37 Q41 I62 C65	V34-L39 HydrophobicContact CG1-CD1 4.23Å; V34-L39 HydrophobicContact CG2-CD1 4.28Å; V34-L39 HydrophobicContact CG2-CD2 4.49Å; Y37-L39 PolarHBondContact O-N 2.86Å; L39-Q41 HydrophobicContact CD2-CB 4.29Å; L39-Q41 HydrophobicContact CD2-CG 4.19Å; L39-I62 HydrophobicContact CD1-CG2 4.04Å; L39-I62 HydrophobicContact CD2-CB 4.17Å; L39-I62 HydrophobicContact CD2-CG2 3.57Å; L39-I62 HydrophobicContact CG-CG2 4.45Å; L39-C65 HydrophobicContact CD1-CB 4.27Å
40	P	96	Very high	91.1	Very high	29 Å²	29	54.3 Å²	54.3	19%	0.188	31%	0.31	C	S	.	.	S	Bend	cis	-72.4	161.6	-0.3	32	-37.7	0	0	0	113.5	L61 I62 V330 F334	P40-L61 HydrophobicContact CB-CD1 4.08Å; P40-L61 HydrophobicContact CB-CG 4.5Å; P40-I62 CarbonylContact C-O 3.49Å; P40-I62 WeakPolarHBondContact CA-O 3.46Å; P40-I62 WeakPolarHBondContact CB-O 3.31Å; P40-V330 HydrophobicContact CB-CG1 4.26Å; P40-V330 HydrophobicContact CG-CG1 3.96Å; P40-V330 WeakPolarHBondContact O-CG1 3.23Å; P40-F334 HydrophobicContact CB-CD2 3.93Å; P40-F334 HydrophobicContact CB-CE2 4.29Å; P40-F334 HydrophobicContact CB-CG 4.39Å; P40-F334 HydrophobicContact CG-CB 4.06Å; P40-F334 HydrophobicContact CG-CD1 4.18Å; P40-F334 HydrophobicContact CG-CD2 3.75Å; P40-F334 HydrophobicContact CG-CE2 4.11Å; P40-F334 HydrophobicContact CG-CG 3.77Å; P40-F334 HydrophobicContact CG-CZ 4.48Å
41	Q	96.3	Very high	90.7	Very high	24 Å²	24	55.6 Å²	55.6	11%	0.112	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	147.7	175.5	-75.1	-59	-21.8	0	0	112.3	L33 K38 L39 L61 I62	L33-Q41 HydrophobicContact CD2-CB 4.5Å; K38-Q41 VanDerWaalsContact O-CG 3.31Å; K38-Q41 WeakPolarHBondContact O-CG 3.43Å; K38-Q41 PolarHBondContact O-NE2 3.16Å; L39-Q41 HydrophobicContact CD2-CB 4.29Å; L39-Q41 HydrophobicContact CD2-CG 4.19Å; Q41-L61 CarbonylContact O-C 3.55Å; Q41-L61 WeakPolarHBondContact O-CA 3.47Å; Q41-I62 PolarHBondContact N-O 3.27Å; Q41-I62 PolarHBondContact O-N 3Å
42	I	95.9	Very high	90.2	Very high	1 Å²	1	58.8 Å²	58.8	1%	0.005	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	131.2	172.7	-71.9	170.5	0	0	0	109.4	L18 W23 L60 L61 P316 V330 W333	L18-I42 HydrophobicContact CD2-CD1 4.19Å; L18-I42 HydrophobicContact CD2-CG2 3.98Å; W23-I42 HydrophobicContact CH2-CG2 4.02Å; I42-L60 WeakPolarHBondContact CA-O 3.09Å; I42-L61 HydrophobicContact CD1-CD1 4.4Å; I42-L61 HydrophobicContact CG1-CD1 3.63Å; I42-P316 VanDerWaalsContact O-CD 3.29Å; I42-P316 WeakPolarHBondContact O-CD 3.48Å; I42-P316 WeakPolarHBondContact O-CG 3.42Å; I42-V330 HydrophobicContact CB-CG2 4.06Å; I42-V330 HydrophobicContact CD1-CB 4.31Å; I42-V330 HydrophobicContact CD1-CG2 3.83Å; I42-V330 HydrophobicContact CG1-CG2 3.87Å; I42-W333 HydrophobicContact CD1-CB 3.92Å; I42-W333 VanDerWaalsContact CD1-CD1 3.43Å; I42-W333 HydrophobicContact CD1-CG 3.85Å
43	V	95.4	Very high	89.6	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	168.8	-177.1	-51.5	0	0	0	0	110.7	L33 Y59 L60 I62 F313	L33-V43 HydrophobicContact CD1-CG1 3.65Å; L33-V43 HydrophobicContact CD2-CG1 4.32Å; V43-Y59 WeakPolarHBondContact O-CA 3.13Å; V43-L60 HydrophobicContact CG2-CB 3.96Å; V43-L60 PolarHBondContact N-O 2.88Å; V43-L60 PolarHBondContact O-N 3.33Å; V43-I62 HydrophobicContact CB-CD1 4.41Å; V43-I62 HydrophobicContact CG1-CD1 3.61Å; V43-I62 HydrophobicContact CG1-CG1 4.24Å; V43-I62 HydrophobicContact CG2-CD1 3.87Å; V43-I62 HydrophobicContact CG2-CG1 3.95Å; V43-F313 HydrophobicContact CB-CB 3.95Å; V43-F313 HydrophobicContact CB-CG 4.47Å; V43-F313 HydrophobicContact CG2-CB 3.82Å; V43-F313 HydrophobicContact CG2-CD1 3.7Å; V43-F313 HydrophobicContact CG2-CE1 4.47Å; V43-F313 HydrophobicContact CG2-CG 3.8Å
44	K	93.8	Very high	89.3	Confident	29 Å²	29	58.3 Å²	58.3	13%	0.126	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	141.9	175	-177.6	-173.9	175.8	-171	0	110.1	W23 D46 N57 Y59 F313 I314	W23-K44 HydrophobicContact CD2-CB 4.06Å; W23-K44 HydrophobicContact CD2-CD 4.02Å; W23-K44 HydrophobicContact CE3-CB 3.57Å; W23-K44 HydrophobicContact CE3-CD 4.3Å; W23-K44 HydrophobicContact CG-CD 4.22Å; W23-K44 HydrophobicContact CH2-CB 3.84Å; W23-K44 HydrophobicContact CZ2-CB 4.34Å; W23-K44 HydrophobicContact CZ3-CB 3.45Å; W23-K44 VanDerWaalsContact CZ3-CB 3.45Å; K44-D46 PolarHBondContact O-N 3.36Å; K44-N57 WeakPolarHBondContact CE-OD1 3.23Å; K44-N57 PolarHBondContact NZ-OD1 3.41Å; K44-Y59 HydrophobicContact CB-CD1 4.26Å; K44-Y59 HydrophobicContact CD-CE1 4.34Å; K44-Y59 HydrophobicContact CG-CD1 4.26Å; K44-Y59 HydrophobicContact CG-CE1 4.42Å; K44-F313 CarbonylContact O-C 3.54Å; K44-F313 VanDerWaalsContact O-CA 3.25Å; K44-F313 WeakPolarHBondContact O-CA 3.28Å; K44-F313 WeakPolarHBondContact O-CB 3.32Å; K44-I314 HydrophobicContact CB-CB 4.5Å; K44-I314 PolarHBondContact N-O 2.96Å; K44-I314 PolarHBondContact O-N 3.02Å
45	L	91.7	Very high	88.9	Confident	2 Å²	2	65 Å²	65	1%	0.01	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	134.4	174.1	-174.9	63.8	0	0	0	111	Q49 V51 L54 D58 L60 F313	L45-Q49 HydrophobicContact CD1-CB 3.82Å; L45-Q49 HydrophobicContact CG-CB 4.26Å; L45-V51 HydrophobicContact CD1-CG2 3.91Å; L45-L54 HydrophobicContact CD1-CD1 3.99Å; L45-L54 HydrophobicContact CD2-CB 3.84Å; L45-L54 HydrophobicContact CD2-CD1 3.94Å; L45-L54 HydrophobicContact CG-CD1 4.43Å; L45-D58 PolarHBondContact N-O 3.39Å; L45-L60 HydrophobicContact CB-CD1 4.5Å; L45-F313 HydrophobicContact CB-CE1 4.49Å; L45-F313 HydrophobicContact CD1-CD1 4.21Å; L45-F313 HydrophobicContact CD1-CE1 3.8Å; L45-F313 HydrophobicContact CD1-CZ 4.44Å
46	D	88.8	Confident	88.3	Confident	34 Å²	34	65.8 Å²	65.8	18%	0.182	37%	0.365	C	S	.	.			trans	-72.2	143.7	-179.5	-172	18.8	0	0	0	112.3	S27 K44 G48 Q49 R312 I314	S27-D46 VanDerWaalsContact CB-OD2 3.23Å; S27-D46 WeakPolarHBondContact CB-OD2 3.29Å; S27-D46 PolarHBondContact OG-OD2 3.38Å; K44-D46 PolarHBondContact O-N 3.36Å; D46-G48 PolarHBondContact O-N 3.08Å; D46-G48 VanDerWaalsContact O-N 3.16Å; D46-Q49 HydrophobicContact CB-CG 3.87Å; D46-Q49 WeakPolarHBondContact O-CB 3.45Å; D46-Q49 PolarHBondContact O-N 3.24Å; D46-Q49 VanDerWaalsContact O-N 3.08Å; D46-R312 HydrophobicContact CB-CB 4.04Å; D46-R312 WeakPolarHBondContact CB-O 3.5Å; D46-R312 PolarHBondContact N-O 3.46Å; D46-I314 HydrophobicContact CB-CG1 4.16Å
47	N	80.4	Confident	87.5	Confident	107 Å²	107	65.4 Å²	65.4	57%	0.572	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	112.9	-170.5	-76.1	-21.4	0	0	0	110.8
48	G	76.6	Confident	87.3	Confident	68 Å²	68	63.5 Å²	63.5	70%	0.701	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.1	1	-176.5	0	0	0	0	0	114.6	D46 S50	D46-G48 PolarHBondContact O-N 3.08Å; D46-G48 VanDerWaalsContact O-N 3.16Å; G48-S50 PolarHBondContact O-N 3.46Å
49	Q	80.1	Confident	87.3	Confident	57 Å²	57	55.7 Å²	55.7	27%	0.266	32%	0.318	S	S	.	.			trans	-78.1	104.7	165.2	-67.8	-68.7	-82.1	0	0	110.2	L45 D46 V51 R312	L45-Q49 HydrophobicContact CD1-CB 3.82Å; L45-Q49 HydrophobicContact CG-CB 4.26Å; D46-Q49 HydrophobicContact CB-CG 3.87Å; D46-Q49 WeakPolarHBondContact O-CB 3.45Å; D46-Q49 PolarHBondContact O-N 3.24Å; D46-Q49 VanDerWaalsContact O-N 3.08Å; Q49-V51 HydrophobicContact CB-CG2 4.3Å; Q49-V51 PolarHBondContact O-N 3.19Å; Q49-R312 HydrophobicContact CG-CB 4.05Å; Q49-R312 VanDerWaalsContact OE1-N 3.08Å
50	S	80.5	Confident	87.3	Confident	130 Å²	130	53.2 Å²	53.2	91%	0.909	31%	0.305	S	S	*	.			trans	-81.1	107.3	171.3	-164.2	0	0	0	0	109.9	G48	G48-S50 PolarHBondContact O-N 3.46Å
51	V	85.2	Confident	87.3	Confident	26 Å²	26	51.8 Å²	51.8	16%	0.158	30%	0.296	C	S	.	.			trans	-124	127.1	-179.1	-178.9	0	0	0	0	108.9	L45 Q49 G53 L54 F304 P311	L45-V51 HydrophobicContact CD1-CG2 3.91Å; Q49-V51 HydrophobicContact CB-CG2 4.3Å; Q49-V51 PolarHBondContact O-N 3.19Å; V51-G53 PolarHBondContact O-N 2.55Å; V51-L54 HydrophobicContact CB-CB 4.27Å; V51-L54 HydrophobicContact CB-CD1 3.9Å; V51-L54 HydrophobicContact CB-CG 4.14Å; V51-L54 HydrophobicContact CG1-CD1 3.74Å; V51-L54 HydrophobicContact CG1-CG 3.92Å; V51-L54 PolarHBondContact O-N 2.93Å; V51-F304 HydrophobicContact CG1-CE1 3.63Å; V51-F304 HydrophobicContact CG1-CZ 4.04Å; V51-P311 HydrophobicContact CG2-CB 3.76Å
52	E	81.9	Confident	87.3	Confident	136 Å²	136	50.7 Å²	50.7	64%	0.636	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	134.8	-176.1	-165.7	-170.1	-170.4	0	0	112.3	L54 R354	E52-L54 PolarHBondContact O-N 2.75Å; E52-R354 IonicContact OE2-CZ 3.97Å; E52-R354 IonicContact OE2-NH1 2.67Å; E52-R354 PolarHBondContact OE2-NH1 2.94Å; E52-R354 IonicContact OE2-NH2 3.25Å; E52-R354 PolarHBondContact OE2-NH2 3.18Å
53	G	80.6	Confident	87.3	Confident	61 Å²	61	51.4 Å²	51.4	63%	0.629	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.4	-20.3	-178.8	0	0	0	0	0	115.1	V51 R295	V51-G53 PolarHBondContact O-N 2.55Å; G53-R295 PolarHBondContact O-NH2 2.77Å
54	L	88.1	Confident	87.3	Confident	22 Å²	22	52.4 Å²	52.4	12%	0.115	30%	0.301	C	S	.	.			trans	-85.7	164.1	172.7	-55.1	-168.9	0	0	0	111.8	L45 V51 E52 D58 L60 V293 F304 F313	L45-L54 HydrophobicContact CD1-CD1 3.99Å; L45-L54 HydrophobicContact CD2-CB 3.84Å; L45-L54 HydrophobicContact CD2-CD1 3.94Å; L45-L54 HydrophobicContact CG-CD1 4.43Å; V51-L54 HydrophobicContact CB-CB 4.27Å; V51-L54 HydrophobicContact CB-CD1 3.9Å; V51-L54 HydrophobicContact CB-CG 4.14Å; V51-L54 HydrophobicContact CG1-CD1 3.74Å; V51-L54 HydrophobicContact CG1-CG 3.92Å; V51-L54 PolarHBondContact O-N 2.93Å; E52-L54 PolarHBondContact O-N 2.75Å; L54-D58 WeakPolarHBondContact CA-OD2 3.48Å; L54-L60 HydrophobicContact CD1-CD1 4.22Å; L54-L60 HydrophobicContact CD1-CD2 4.01Å; L54-L60 HydrophobicContact CD2-CD2 4.11Å; L54-V293 HydrophobicContact CD2-CB 4.49Å; L54-V293 HydrophobicContact CD2-CG1 4.25Å; L54-V293 HydrophobicContact CD2-CG2 3.38Å; L54-F304 HydrophobicContact CD1-CZ 4.19Å; L54-F313 HydrophobicContact CD1-CE1 4.37Å
55	R	86.2	Confident	87.3	Confident	164 Å²	164	53.6 Å²	53.6	62%	0.619	31%	0.312	S	S	*	.			trans	-122.6	154.1	172.1	-62.2	171	175.8	-174.9	-3.4	109	N57 D58	R55-N57 PolarHBondContact O-N 3.28Å; R55-D58 WeakPolarHBondContact CB-OD2 3.36Å; R55-D58 PolarHBondContact N-OD2 3.1Å; R55-D58 WeakPolarHBondContact O-CB 3.42Å; R55-D58 PolarHBondContact O-N 3.29Å
56	D	81.4	Confident	87.4	Confident	115 Å²	115	57.1 Å²	57.1	62%	0.615	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	130.3	169.7	-53.6	-44.6	0	0	0	109.9	D58	D56-D58 VanDerWaalsContact C-N 3.3Å; D56-D58 PolarHBondContact O-N 2.86Å
57	N	77.6	Confident	87.6	Confident	75 Å²	75	62.7 Å²	62.7	40%	0.401	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	12.2	-175.9	-47.7	-97.3	0	0	0	116.6	K44 R55 Y59	K44-N57 WeakPolarHBondContact CE-OD1 3.23Å; K44-N57 PolarHBondContact NZ-OD1 3.41Å; R55-N57 PolarHBondContact O-N 3.28Å; N57-Y59 PolarHBondContact O-N 3.36Å
58	D	89.1	Confident	88.3	Confident	10 Å²	10	58.7 Å²	58.7	5%	0.053	33%	0.327	C	S	.	.			trans	-57.3	138.5	163.9	-89.6	-29.9	0	0	0	110	L45 L54 R55 D56 L60 V293 R295	L45-D58 PolarHBondContact N-O 3.39Å; L54-D58 WeakPolarHBondContact CA-OD2 3.48Å; R55-D58 WeakPolarHBondContact CB-OD2 3.36Å; R55-D58 PolarHBondContact N-OD2 3.1Å; R55-D58 WeakPolarHBondContact O-CB 3.42Å; R55-D58 PolarHBondContact O-N 3.29Å; D56-D58 VanDerWaalsContact C-N 3.3Å; D56-D58 PolarHBondContact O-N 2.86Å; D58-L60 HydrophobicContact CB-CD1 4.42Å; D58-V293 HydrophobicContact CB-CG1 3.93Å; D58-R295 IonicContact OD1-CZ 3.65Å; D58-R295 IonicContact OD1-NE 2.85Å; D58-R295 PolarHBondContact OD1-NE 2.92Å; D58-R295 IonicContact OD1-NH2 3.61Å; D58-R295 IonicContact OD2-CZ 3.45Å; D58-R295 IonicContact OD2-NE 3.44Å; D58-R295 PolarHBondContact OD2-NE 2.78Å; D58-R295 IonicContact OD2-NH2 2.66Å; D58-R295 PolarHBondContact OD2-NH2 2.9Å
59	Y	92.9	Very high	89.1	Confident	27 Å²	27	57.3 Å²	57.3	11%	0.106	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	143	168.7	-52.9	-69.6	0	0	0	109.8	Y15 L18 W23 V43 K44 N57 L294	Y15-Y59 AromaticContact CE2-CD2 3.85Å; Y15-Y59 HydrophobicContact CE2-CD2 3.85Å; Y15-Y59 HydrophobicContact CE2-CE2 4.19Å; L18-Y59 HydrophobicContact CB-CD2 4.07Å; L18-Y59 HydrophobicContact CB-CE2 3.93Å; L18-Y59 HydrophobicContact CB-CG 4.45Å; L18-Y59 HydrophobicContact CD1-CD2 3.72Å; L18-Y59 HydrophobicContact CD1-CE2 4.4Å; L18-Y59 HydrophobicContact CD1-CG 3.92Å; L18-Y59 PolarHBondContact O-OH 2.78Å; W23-Y59 AromaticContact CE2-CE1 3.65Å; W23-Y59 AromaticContact CH2-CD1 3.87Å; W23-Y59 HydrophobicContact CH2-CD1 3.87Å; W23-Y59 HydrophobicContact CH2-CE1 4.23Å; W23-Y59 AromaticContact CZ2-CD1 3.42Å; W23-Y59 HydrophobicContact CZ2-CD1 3.42Å; W23-Y59 VanDerWaalsContact CZ2-CD1 3.42Å; W23-Y59 AromaticContact CZ2-CE1 3.36Å; W23-Y59 HydrophobicContact CZ2-CE1 3.36Å; W23-Y59 AromaticContact NE1-CE1 3.78Å; V43-Y59 WeakPolarHBondContact O-CA 3.13Å; K44-Y59 HydrophobicContact CB-CD1 4.26Å; K44-Y59 HydrophobicContact CD-CE1 4.34Å; K44-Y59 HydrophobicContact CG-CD1 4.26Å; K44-Y59 HydrophobicContact CG-CE1 4.42Å; N57-Y59 PolarHBondContact O-N 3.36Å; Y59-L294 PolarHBondContact O-N 3.01Å
60	L	95.3	Very high	89.9	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	132.6	178.5	-66.2	86.6	0	0	0	110.4	I42 V43 L45 L54 D58 C291 C292 V293 T302 F304 F313	I42-L60 WeakPolarHBondContact CA-O 3.09Å; V43-L60 HydrophobicContact CG2-CB 3.96Å; V43-L60 PolarHBondContact N-O 2.88Å; V43-L60 PolarHBondContact O-N 3.33Å; L45-L60 HydrophobicContact CB-CD1 4.5Å; L54-L60 HydrophobicContact CD1-CD1 4.22Å; L54-L60 HydrophobicContact CD1-CD2 4.01Å; L54-L60 HydrophobicContact CD2-CD2 4.11Å; D58-L60 HydrophobicContact CB-CD1 4.42Å; L60-C291 HydrophobicContact CD2-CB 4.16Å; L60-C292 WeakPolarHBondContact CA-O 3.36Å; L60-V293 HydrophobicContact CD2-CG2 4.38Å; L60-V293 HydrophobicContact CG-CG2 4.41Å; L60-T302 HydrophobicContact CD2-CG2 4.3Å; L60-F304 HydrophobicContact CD2-CE2 4.24Å; L60-F313 HydrophobicContact CD1-CD1 4.28Å; L60-F313 HydrophobicContact CD1-CE1 3.83Å; L60-F313 HydrophobicContact CD2-CE1 3.88Å; L60-F313 HydrophobicContact CD2-CZ 4.23Å; L60-F313 HydrophobicContact CG-CE1 4.42Å
61	L	95.8	Very high	90.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	107.8	159.4	-177.7	74.7	0	0	0	107.9	P40 Q41 I42 H63 C291 C292 L294 V330 F334 C337	P40-L61 HydrophobicContact CB-CD1 4.08Å; P40-L61 HydrophobicContact CB-CG 4.5Å; Q41-L61 CarbonylContact O-C 3.55Å; Q41-L61 WeakPolarHBondContact O-CA 3.47Å; I42-L61 HydrophobicContact CD1-CD1 4.4Å; I42-L61 HydrophobicContact CG1-CD1 3.63Å; L61-H63 PolarHBondContact O-N 2.99Å; L61-H63 VanDerWaalsContact O-N 3.15Å; L61-C291 CarbonylContact O-C 3.55Å; L61-C291 VanDerWaalsContact O-CA 3.24Å; L61-C291 WeakPolarHBondContact O-CA 3.19Å; L61-C292 HydrophobicContact CB-CB 4.26Å; L61-C292 PolarHBondContact N-O 2.68Å; L61-C292 PolarHBondContact O-N 3.12Å; L61-L294 HydrophobicContact CB-CD1 4.2Å; L61-L294 HydrophobicContact CB-CD2 4.05Å; L61-L294 HydrophobicContact CB-CG 4.35Å; L61-V330 HydrophobicContact CD1-CG1 4.17Å; L61-F334 HydrophobicContact CD2-CB 4.25Å; L61-F334 HydrophobicContact CD2-CD2 4.3Å; L61-C337 HydrophobicContact CD2-CB 4.16Å
62	I	96.4	Very high	91	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	106.7	165.8	-58.4	173.9	0	0	0	106.7	L30 L33 V34 L39 P40 Q41 V43 V289	L30-I62 HydrophobicContact CD1-CD1 3.58Å; L30-I62 HydrophobicContact CD1-CG1 4.23Å; L33-I62 HydrophobicContact CD1-CD1 4.05Å; L33-I62 HydrophobicContact CD2-CD1 3.68Å; L33-I62 HydrophobicContact CG-CD1 4.41Å; V34-I62 HydrophobicContact CG2-CG2 4.12Å; L39-I62 HydrophobicContact CD1-CG2 4.04Å; L39-I62 HydrophobicContact CD2-CB 4.17Å; L39-I62 HydrophobicContact CD2-CG2 3.57Å; L39-I62 HydrophobicContact CG-CG2 4.45Å; P40-I62 CarbonylContact C-O 3.49Å; P40-I62 WeakPolarHBondContact CA-O 3.46Å; P40-I62 WeakPolarHBondContact CB-O 3.31Å; Q41-I62 PolarHBondContact N-O 3.27Å; Q41-I62 PolarHBondContact O-N 3Å; V43-I62 HydrophobicContact CB-CD1 4.41Å; V43-I62 HydrophobicContact CG1-CD1 3.61Å; V43-I62 HydrophobicContact CG1-CG1 4.24Å; V43-I62 HydrophobicContact CG2-CD1 3.87Å; V43-I62 HydrophobicContact CG2-CG1 3.95Å; I62-V289 HydrophobicContact CG2-CG1 3.58Å
63	H	95.2	Very high	91.6	Very high	17 Å²	17	41.3 Å²	41.3	8%	0.079	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-54.2	-170	-179.9	-66.4	0	0	0	111.3	L61 V290 F334 I343	L61-H63 PolarHBondContact O-N 2.99Å; L61-H63 VanDerWaalsContact O-N 3.15Å; H63-V290 WeakPolarHBondContact CB-O 3.39Å; H63-V290 PolarHBondContact N-O 3.25Å; H63-F334 AromaticContact CD2-CE2 3.74Å; H63-F334 AromaticContact CE1-CE2 3.75Å; H63-F334 AromaticContact NE2-CE2 3.49Å; H63-F334 WeakPolarHBondContact NE2-CE2 3.34Å; H63-I343 VanDerWaalsContact ND1-CD1 3.28Å; H63-I343 WeakPolarHBondContact ND1-CD1 3.45Å
64	S	94.8	Very high	92.1	Very high	21 Å²	21	40.5 Å²	40.5	15%	0.147	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.3	147.1	-179.1	55.9	0	0	0	0	112.9	R66 V290 I343	S64-R66 PolarHBondContact OG-NE 3.43Å; S64-V290 PolarHBondContact N-O 2.84Å; S64-V290 PolarHBondContact O-N 2.97Å; S64-I343 WeakPolarHBondContact OG-CD1 3.45Å
65	C	94.7	Very high	92	Very high	53 Å²	53	39.7 Å²	39.7	36%	0.358	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	132.5	162.6	-173.6	0	0	0	0	109.8	V34 L39 T287	V34-C65 HydrophobicContact CG1-CB 3.65Å; L39-C65 HydrophobicContact CD1-CB 4.27Å; C65-T287 WeakPolarHBondContact SG-CG2 3.36Å
66	R	93.6	Very high	91.8	Very high	77 Å²	77	32.7 Å²	32.7	29%	0.291	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	157.2	-176.2	-70.8	178.6	164.3	-132.4	-0.7	110.9	S64 T287 V288 D344	S64-R66 PolarHBondContact OG-NE 3.43Å; R66-T287 CarbonylContact O-C 3.52Å; R66-T287 WeakPolarHBondContact O-CA 3.19Å; R66-V288 PolarHBondContact N-O 2.69Å; R66-V288 PolarHBondContact O-N 2.94Å; R66-D344 IonicContact CZ-OD1 3.7Å; R66-D344 VanDerWaalsContact CZ-OD1 3.23Å; R66-D344 IonicContact NH1-OD1 3.74Å; R66-D344 PolarHBondContact NH1-OD1 3.34Å; R66-D344 IonicContact NH2-OD1 2.82Å; R66-D344 PolarHBondContact NH2-OD1 2.88Å
67	Q	93.7	Very high	91.2	Very high	151 Å²	151	32.2 Å²	32.2	71%	0.706	16%	0.16	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.8	127.8	163.1	-72	-179.4	-18.2	0	0	108.6	T285	Q67-T285 HydrophobicContact CB-CG2 4.31Å
68	W	93.9	Very high	90.1	Very high	23 Å²	23	38.6 Å²	38.6	9%	0.087	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	133.8	171.5	-76.2	-4.1	0	0	0	109	T285 K286 V288 V290 H303 Y346 S347 R351	W68-T285 CarbonylContact O-C 3.5Å; W68-T285 WeakPolarHBondContact O-CA 3.44Å; W68-K286 PolarHBondContact N-O 3.33Å; W68-K286 PolarHBondContact O-N 2.74Å; W68-V288 HydrophobicContact CB-CG2 4.02Å; W68-V288 HydrophobicContact CD2-CB 4.02Å; W68-V288 HydrophobicContact CD2-CG1 4.11Å; W68-V288 HydrophobicContact CD2-CG2 3.89Å; W68-V288 HydrophobicContact CE3-CB 4.12Å; W68-V288 HydrophobicContact CE3-CG1 3.89Å; W68-V288 HydrophobicContact CE3-CG2 3.73Å; W68-V288 HydrophobicContact CG-CB 4.3Å; W68-V288 HydrophobicContact CG-CG2 4.05Å; W68-V288 HydrophobicContact CH2-CG1 4.05Å; W68-V288 HydrophobicContact CZ2-CG1 4.3Å; W68-V288 HydrophobicContact CZ3-CG1 3.86Å; W68-V288 HydrophobicContact CZ3-CG2 4.45Å; W68-V290 HydrophobicContact CH2-CG2 4.38Å; W68-V290 HydrophobicContact CZ2-CG2 3.65Å; W68-H303 HydrophobicContact CH2-CB 3.77Å; W68-H303 AromaticContact CH2-CD2 3.84Å; W68-H303 AromaticContact CH2-CG 3.59Å; W68-H303 HydrophobicContact CZ3-CB 4.2Å; W68-H303 AromaticContact CZ3-CD2 3.38Å; W68-H303 WeakPolarHBondContact CZ3-CD2 3.35Å; W68-H303 AromaticContact CZ3-CG 3.65Å; W68-H303 AromaticContact CZ3-NE2 3.79Å; W68-Y346 HydrophobicContact CH2-CD1 4.09Å; W68-Y346 AromaticContact CH2-CE1 3.81Å; W68-Y346 HydrophobicContact CH2-CE1 3.81Å; W68-Y346 HydrophobicContact CZ2-CD1 4.1Å; W68-Y346 HydrophobicContact CZ2-CE1 4.22Å; W68-S347 PolarHBondContact NE1-OG 3.07Å; W68-R351 VanDerWaalsContact CZ3-CZ 3.47Å
69	T	95	Very high	88.5	Confident	39 Å²	39	39.6 Å²	39.6	24%	0.239	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	121.7	174.7	-56.1	0	0	0	0	108.9	V91 I283 Q284 T285	T69-V91 HydrophobicContact CG2-CG1 3.89Å; T69-V91 HydrophobicContact CG2-CG2 3.95Å; T69-V91 WeakPolarHBondContact O-CG2 3.35Å; T69-V91 PolarHBondContact O-N 3.23Å; T69-I283 HydrophobicContact CG2-CD1 3.58Å; T69-I283 HydrophobicContact CG2-CG1 3.66Å; T69-Q284 WeakPolarHBondContact CA-O 3.5Å; T69-T285 WeakPolarHBondContact CG2-OG1 3.42Å; T69-T285 PolarHBondContact OG1-OG1 3.31Å
70	T	95.6	Very high	86.5	Confident	4 Å²	4	43.3 Å²	43.3	3%	0.025	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	150.7	-175.8	56.1	0	0	0	0	110.7	E88 I89 P90 I283 Q284	T70-E88 HydrophobicContact CG2-CB 4.22Å; T70-E88 PolarHBondContact OG1-OE2 2.85Å; T70-I89 CarbonylContact C-O 3.54Å; T70-I89 WeakPolarHBondContact CA-O 3.25Å; T70-P90 HydrophobicContact CG2-CG 4.38Å; T70-I283 WeakPolarHBondContact O-CA 3.45Å; T70-Q284 PolarHBondContact N-O 3.32Å; T70-Q284 PolarHBondContact O-N 3.43Å
71	I	95.8	Very high	84.8	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	128.2	164.4	-58.8	-171.6	0	0	0	108.5	A73 E88 I89 V91 I243 V247 L280 N282	I71-A73 PolarHBondContact O-N 3.24Å; I71-E88 WeakPolarHBondContact O-CA 3.46Å; I71-I89 PolarHBondContact N-O 3.44Å; I71-I89 PolarHBondContact O-N 3.18Å; I71-V91 HydrophobicContact CG1-CG1 4.22Å; I71-I243 HydrophobicContact CD1-CB 4.48Å; I71-I243 HydrophobicContact CD1-CD1 4.31Å; I71-I243 HydrophobicContact CD1-CG2 3.49Å; I71-I243 VanDerWaalsContact CD1-CG2 3.49Å; I71-I243 HydrophobicContact CG1-CG2 3.85Å; I71-V247 HydrophobicContact CD1-CG2 3.27Å; I71-V247 HydrophobicContact CG1-CG2 3.78Å; I71-L280 HydrophobicContact CD1-CD1 4.17Å; I71-L280 HydrophobicContact CG2-CB 3.94Å; I71-L280 HydrophobicContact CG2-CD2 4.05Å; I71-L280 HydrophobicContact CG2-CG 4.41Å; I71-N282 CarbonylContact C-O 3.51Å; I71-N282 WeakPolarHBondContact CA-O 3.19Å
72	T	94.4	Very high	83.3	Confident	9 Å²	9	54.9 Å²	54.9	6%	0.055	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	112.9	158.2	-72.7	0	0	0	0	109.1	K86 I87 V281 N282	T72-K86 HydrophobicContact CG2-CD 4.24Å; T72-K86 HydrophobicContact CG2-CG 3.98Å; T72-I87 WeakPolarHBondContact CA-O 3.47Å; T72-V281 HydrophobicContact CG2-CB 4.33Å; T72-V281 PolarHBondContact O-N 3.38Å; T72-N282 PolarHBondContact N-O 2.88Å
73	A	93.3	Very high	81.7	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	143.1	172.5	0	0	0	0	0	110.2	I71 K86 I87 I89 Y278 K279 L280	I71-A73 PolarHBondContact O-N 3.24Å; A73-K86 WeakPolarHBondContact O-CA 3.49Å; A73-I87 HydrophobicContact CB-CD1 4.43Å; A73-I87 HydrophobicContact CB-CG1 3.9Å; A73-I87 PolarHBondContact N-O 2.66Å; A73-I87 PolarHBondContact O-N 3.24Å; A73-I89 HydrophobicContact CB-CD1 3.63Å; A73-I89 HydrophobicContact CB-CG1 4.15Å; A73-Y278 HydrophobicContact CB-CD1 4.31Å; A73-K279 WeakPolarHBondContact CA-O 3.39Å; A73-L280 HydrophobicContact CB-CD2 3.6Å
74	H	90.4	Very high	80.5	Confident	43 Å²	43	60.3 Å²	60.3	20%	0.199	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.4	172.3	-71.2	-110.2	0	0	0	109.4	V82 Y278 K279	H74-V82 HydrophobicContact CB-CG1 3.65Å; H74-V82 HydrophobicContact CB-CG2 4.46Å; H74-Y278 CarbonylContact O-C 3.49Å; H74-Y278 VanDerWaalsContact O-CA 3.27Å; H74-Y278 WeakPolarHBondContact O-CA 3.48Å; H74-K279 PolarHBondContact N-O 3.19Å; H74-K279 PolarHBondContact O-N 3.26Å
75	S	87.6	Confident	79.7	Confident	5 Å²	5	62.8 Å²	62.8	4%	0.035	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	131.4	177.5	-161.1	0	0	0	0	111	G84 P85	S75-G84 PolarHBondContact O-N 3.07Å; S75-G84 VanDerWaalsContact O-N 3.12Å; S75-P85 PolarHBondContact N-O 2.86Å
76	L	81.6	Confident	79.4	Confident	18 Å²	18	64.3 Å²	64.3	9%	0.094	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	128.8	176.2	-64.7	168.6	0	0	0	109.1	V82 N255 R277 K279	L76-V82 HydrophobicContact CD2-CB 4.46Å; L76-V82 HydrophobicContact CD2-CG2 3.6Å; L76-N255 HydrophobicContact CD1-CB 4.43Å; L76-R277 HydrophobicContact CB-CB 3.94Å; L76-R277 HydrophobicContact CD1-CB 4.18Å; L76-R277 PolarHBondContact N-O 3.1Å; L76-K279 HydrophobicContact CD1-CB 4.18Å; L76-K279 HydrophobicContact CD2-CB 4.21Å; L76-K279 HydrophobicContact CG-CB 4.25Å
77	E	68.1	Low	79.4	Confident	105 Å²	105	60.7 Å²	60.7	49%	0.491	31%	0.305	S	S	.	.			trans	-112.3	142.7	173	-63.3	-167.5	158.1	0	0	109.6	G79	E77-G79 PolarHBondContact O-N 3.44Å
78	E	55.8	Low	79.5	Confident	209 Å²	209	54.5 Å²	54.5	98%	0.977	28%	0.276	S	S	*	.	S	Bend	trans	-0	70.7	-172.5	-60.4	-166.1	151.8	0	0	118
79	G	54.3	Low	79.6	Confident	30 Å²	30	53.4 Å²	53.4	31%	0.309	27%	0.272	S	S	.	.	S	Bend	trans	150.3	-157.1	175	0	0	0	0	0	112.2	E77 Y81	E77-G79 PolarHBondContact O-N 3.44Å; G79-Y81 VanDerWaalsContact C-N 3.31Å
80	H	51.7	Low	79.6	Confident	106 Å²	106	52 Å²	52	49%	0.491	26%	0.263	S	S	.	.	S	Bend	trans	-86.2	-3.3	173.6	-43	-62.2	0	0	0	112.8	D103	H80-D103 VanDerWaalsContact CE1-CG 3.45Å; H80-D103 IonicContact CE1-OD1 3.98Å; H80-D103 PolarHBondContact CE1-OD1 3.22Å; H80-D103 VanDerWaalsContact CE1-OD1 3.22Å; H80-D103 IonicContact CE1-OD2 2.61Å; H80-D103 PolarHBondContact CE1-OD2 3.02Å; H80-D103 IonicContact CG-OD2 2.84Å; H80-D103 IonicContact ND1-OD1 3.48Å; H80-D103 PolarHBondContact ND1-OD1 3.18Å; H80-D103 IonicContact ND1-OD2 3.4Å; H80-D103 PolarHBondContact ND1-OD2 3.49Å
81	Y	58.5	Low	79.6	Confident	172 Å²	172	52.5 Å²	52.5	68%	0.675	27%	0.267	S	S	*	.			trans	-81.9	128.2	-171.4	-62.7	-75.5	0	0	0	112	G79 I83	G79-Y81 VanDerWaalsContact C-N 3.31Å; Y81-I83 PolarHBondContact O-N 2.9Å
82	V	64.4	Low	79.5	Confident	70 Å²	70	57.6 Å²	57.6	42%	0.424	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	104.4	170.7	172.7	0	0	0	0	108.3	H74 L76 K279	H74-V82 HydrophobicContact CB-CG1 3.65Å; H74-V82 HydrophobicContact CB-CG2 4.46Å; L76-V82 HydrophobicContact CD2-CB 4.46Å; L76-V82 HydrophobicContact CD2-CG2 3.6Å; V82-K279 HydrophobicContact CG2-CB 4.45Å; V82-K279 HydrophobicContact CG2-CD 4.16Å
83	I	62.7	Low	79.5	Confident	117 Å²	117	57.7 Å²	57.7	60%	0.6	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.6	-29	-174.9	-63.9	177.4	0	0	0	111.9	Y81	Y81-I83 PolarHBondContact O-N 2.9Å
84	G	69.8	Low	79.4	Confident	15 Å²	15	63 Å²	63	16%	0.155	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	175.3	-176.9	0	0	0	0	0	114.9	S75	S75-G84 PolarHBondContact O-N 3.07Å; S75-G84 VanDerWaalsContact O-N 3.12Å
85	P	77.9	Confident	79.5	Confident	72 Å²	72	61 Å²	61	47%	0.468	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	153.2	-171.9	24.4	-34.6	0	0	0	113.7	S75	S75-P85 PolarHBondContact N-O 2.86Å
86	K	90.1	Very high	79.9	Confident	86 Å²	86	64.2 Å²	64.2	37%	0.374	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	123	174	-176.3	-173.3	177.6	-178.2	0	109.3	T72 A73 V353	T72-K86 HydrophobicContact CG2-CD 4.24Å; T72-K86 HydrophobicContact CG2-CG 3.98Å; A73-K86 WeakPolarHBondContact O-CA 3.49Å; K86-V353 HydrophobicContact CB-CB 4.31Å; K86-V353 HydrophobicContact CB-CG2 4.49Å; K86-V353 HydrophobicContact CD-CB 4.04Å; K86-V353 HydrophobicContact CD-CG1 3.97Å; K86-V353 HydrophobicContact CD-CG2 4.12Å; K86-V353 HydrophobicContact CG-CB 4Å; K86-V353 HydrophobicContact CG-CG1 4.48Å; K86-V353 HydrophobicContact CG-CG2 3.8Å; K86-V353 WeakPolarHBondContact O-CB 3.48Å; K86-V353 PolarHBondContact O-N 3.02Å
87	I	93.5	Very high	80.5	Confident	1 Å²	1	63.3 Å²	63.3	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	154.5	-173.4	67	176.1	0	0	0	111.3	T72 A73 I89 H270 I272 Y278 V350 R351	T72-I87 WeakPolarHBondContact CA-O 3.47Å; A73-I87 HydrophobicContact CB-CD1 4.43Å; A73-I87 HydrophobicContact CB-CG1 3.9Å; A73-I87 PolarHBondContact N-O 2.66Å; A73-I87 PolarHBondContact O-N 3.24Å; I87-I89 HydrophobicContact CD1-CD1 4.12Å; I87-I89 HydrophobicContact CD1-CG1 4.01Å; I87-I89 HydrophobicContact CG1-CD1 4.49Å; I87-I89 HydrophobicContact CG1-CG1 4.12Å; I87-H270 VanDerWaalsContact CD1-CD2 3.41Å; I87-H270 WeakPolarHBondContact CD1-CD2 3.5Å; I87-H270 HydrophobicContact CG2-CB 3.94Å; I87-I272 HydrophobicContact CD1-CG1 4.47Å; I87-Y278 HydrophobicContact CD1-CD1 4.17Å; I87-Y278 HydrophobicContact CD1-CE1 3.71Å; I87-V350 HydrophobicContact CD1-CG1 4.22Å; I87-R351 CarbonylContact C-O 3.32Å; I87-R351 WeakPolarHBondContact CA-O 3.46Å
88	E	94.4	Very high	81.7	Confident	21 Å²	21	62.2 Å²	62.2	10%	0.098	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	112.3	172.2	-89.3	176.8	-128	0	0	110.7	T70 I71 K286 R351 V353	T70-E88 HydrophobicContact CG2-CB 4.22Å; T70-E88 PolarHBondContact OG1-OE2 2.85Å; I71-E88 WeakPolarHBondContact O-CA 3.46Å; E88-K286 IonicContact OE1-NZ 2.71Å; E88-K286 PolarHBondContact OE1-NZ 3.02Å; E88-K286 IonicContact OE2-NZ 3.79Å; E88-K286 PolarHBondContact OE2-NZ 3.44Å; E88-R351 PolarHBondContact N-O 3.28Å; E88-R351 PolarHBondContact O-N 2.94Å; E88-V353 HydrophobicContact CB-CG2 4.46Å; E88-V353 HydrophobicContact CG-CG2 3.8Å
89	I	95.9	Very high	83.4	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	116.4	177.9	-46.5	175.8	0	0	0	108.3	T70 I71 A73 I87 Y93 F97 I243 I272 V350	T70-I89 CarbonylContact C-O 3.54Å; T70-I89 WeakPolarHBondContact CA-O 3.25Å; I71-I89 PolarHBondContact N-O 3.44Å; I71-I89 PolarHBondContact O-N 3.18Å; A73-I89 HydrophobicContact CB-CD1 3.63Å; A73-I89 HydrophobicContact CB-CG1 4.15Å; I87-I89 HydrophobicContact CD1-CD1 4.12Å; I87-I89 HydrophobicContact CD1-CG1 4.01Å; I87-I89 HydrophobicContact CG1-CD1 4.49Å; I87-I89 HydrophobicContact CG1-CG1 4.12Å; I89-Y93 HydrophobicContact CG2-CD1 3.89Å; I89-Y93 HydrophobicContact CG2-CG 3.89Å; I89-F97 HydrophobicContact CD1-CZ 4.44Å; I89-I243 HydrophobicContact CB-CD1 4.32Å; I89-I243 HydrophobicContact CD1-CD1 4.07Å; I89-I243 HydrophobicContact CG2-CD1 3.85Å; I89-I243 HydrophobicContact CG2-CG1 3.79Å; I89-I272 HydrophobicContact CD1-CD1 3.76Å; I89-I272 HydrophobicContact CG1-CD1 4Å; I89-I272 HydrophobicContact CG2-CD1 4.1Å; I89-V350 HydrophobicContact CG1-CG1 4.24Å; I89-V350 HydrophobicContact CG2-CG2 4.34Å
90	P	95.8	Very high	84.8	Confident	8 Å²	8	53.4 Å²	53.4	5%	0.052	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	144.8	178.6	-26.6	37.4	0	0	0	113	T70 H92 Y93 S347 R348 A349	T70-P90 HydrophobicContact CG2-CG 4.38Å; P90-H92 PolarHBondContact O-N 3.09Å; P90-Y93 VanDerWaalsContact O-CB 3.22Å; P90-Y93 WeakPolarHBondContact O-CB 3.48Å; P90-Y93 PolarHBondContact O-N 3.22Å; P90-S347 WeakPolarHBondContact CB-O 3.2Å; P90-S347 WeakPolarHBondContact CG-O 3.13Å; P90-R348 WeakPolarHBondContact CG-O 3.48Å; P90-A349 WeakPolarHBondContact CD-O 3.48Å; P90-A349 WeakPolarHBondContact CG-O 3.43Å
91	V	95.2	Very high	85.8	Confident	16 Å²	16	54.8 Å²	54.8	10%	0.097	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	12.3	175.8	-54.3	0	0	0	0	114.1	T69 I71 I243 R244 I283	T69-V91 HydrophobicContact CG2-CG1 3.89Å; T69-V91 HydrophobicContact CG2-CG2 3.95Å; T69-V91 WeakPolarHBondContact O-CG2 3.35Å; T69-V91 PolarHBondContact O-N 3.23Å; I71-V91 HydrophobicContact CG1-CG1 4.22Å; V91-I243 HydrophobicContact CB-CG2 4.33Å; V91-I243 HydrophobicContact CG1-CG2 4.15Å; V91-R244 WeakPolarHBondContact O-CB 3.25Å; V91-R244 PolarHBondContact O-NE 2.95Å; V91-I283 HydrophobicContact CG1-CD1 4.16Å
92	H	93.6	Very high	85.8	Confident	107 Å²	107	52.3 Å²	52.3	50%	0.495	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	7.9	172.3	-61.3	2.6	0	0	0	111.6	P90 R244 R348	P90-H92 PolarHBondContact O-N 3.09Å; H92-R244 PolarHBondContact CE1-NH2 3.21Å; H92-R244 VanDerWaalsContact CE1-NH2 3.29Å; H92-R244 PolarHBondContact ND1-NH2 3.49Å; H92-R244 VanDerWaalsContact ND1-NH2 3.11Å; H92-R348 HydrophobicContact CB-CG 4.08Å; H92-R348 WeakPolarHBondContact O-CD 3.49Å; H92-R348 WeakPolarHBondContact O-CG 3.36Å
93	Y	95.1	Very high	85.1	Confident	11 Å²	11	51.3 Å²	51.3	4%	0.043	26%	0.255	C	S	.	.			trans	-63.1	134.9	169.4	-175.3	-107.3	0	0	0	110.4	I89 P90 F97 I243 P262 P263 I272 V350	I89-Y93 HydrophobicContact CG2-CD1 3.89Å; I89-Y93 HydrophobicContact CG2-CG 3.89Å; P90-Y93 VanDerWaalsContact O-CB 3.22Å; P90-Y93 WeakPolarHBondContact O-CB 3.48Å; P90-Y93 PolarHBondContact O-N 3.22Å; Y93-F97 AromaticContact CD1-CE2 3.87Å; Y93-F97 HydrophobicContact CD1-CE2 3.87Å; Y93-F97 HydrophobicContact CD1-CZ 4.12Å; Y93-F97 AromaticContact CE1-CE2 3.97Å; Y93-F97 HydrophobicContact CE1-CE2 3.97Å; Y93-F97 AromaticContact CE1-CZ 3.95Å; Y93-F97 HydrophobicContact CE1-CZ 3.95Å; Y93-I243 HydrophobicContact CD1-CG1 4.43Å; Y93-P262 HydrophobicContact CE1-CB 4.4Å; Y93-P262 WeakPolarHBondContact OH-CB 3.49Å; Y93-P263 PolarHBondContact OH-O 2.91Å; Y93-P263 VanDerWaalsContact OH-O 3.13Å; Y93-I272 HydrophobicContact CD1-CD1 4.38Å; Y93-I272 HydrophobicContact CE1-CD1 3.79Å; Y93-V350 HydrophobicContact CD2-CG2 3.64Å; Y93-V350 HydrophobicContact CE2-CG2 3.54Å; Y93-V350 HydrophobicContact CG-CG2 4.3Å
94	E	91.4	Very high	84.6	Confident	111 Å²	111	50 Å²	50	52%	0.519	24%	0.242	S	C	.	.			trans	-90.6	-11.9	-166.1	-66.6	172.9	-167.8	0	0	113.6	Q96 P263 R348	E94-Q96 PolarHBondContact O-NE2 2.9Å; E94-Q96 VanDerWaalsContact O-NE2 3.08Å; E94-P263 HydrophobicContact CB-CG 3.78Å; E94-R348 VanDerWaalsContact OE1-CD 3.3Å; E94-R348 WeakPolarHBondContact OE1-CD 3.13Å; E94-R348 IonicContact OE1-CZ 3.86Å; E94-R348 IonicContact OE1-NE 3.99Å; E94-R348 PolarHBondContact OE1-NE 3.21Å; E94-R348 VanDerWaalsContact OE1-NE 3.14Å
95	G	93	Very high	83.5	Confident	1 Å²	1	54 Å²	54	1%	0.01	26%	0.26	C	S	.	.			trans	-63	146	175.5	0	0	0	0	0	113	F97	G95-F97 WeakPolarHBondContact O-CD2 3.37Å; G95-F97 WeakPolarHBondContact O-CE2 3.24Å
96	Q	95.4	Very high	82	Confident	72 Å²	72	56.7 Å²	56.7	34%	0.336	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	152.7	174.9	-55.6	-50.9	-55.3	0	0	111.2	E94 E240 P259	E94-Q96 PolarHBondContact O-NE2 2.9Å; E94-Q96 VanDerWaalsContact O-NE2 3.08Å; Q96-E240 HydrophobicContact CB-CB 4.19Å; Q96-P259 HydrophobicContact CB-CG 4.28Å; Q96-P259 WeakPolarHBondContact O-CD 3.33Å
97	F	94.8	Very high	80	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	135.1	-180	-64.8	-97	0	0	0	108.1	I89 Y93 G95 H241 I243 I246 V256 V258 I272	I89-F97 HydrophobicContact CD1-CZ 4.44Å; Y93-F97 AromaticContact CD1-CE2 3.87Å; Y93-F97 HydrophobicContact CD1-CE2 3.87Å; Y93-F97 HydrophobicContact CD1-CZ 4.12Å; Y93-F97 AromaticContact CE1-CE2 3.97Å; Y93-F97 HydrophobicContact CE1-CE2 3.97Å; Y93-F97 AromaticContact CE1-CZ 3.95Å; Y93-F97 HydrophobicContact CE1-CZ 3.95Å; G95-F97 WeakPolarHBondContact O-CD2 3.37Å; G95-F97 WeakPolarHBondContact O-CE2 3.24Å; F97-H241 PolarHBondContact N-O 3.48Å; F97-H241 PolarHBondContact O-N 2.67Å; F97-I243 HydrophobicContact CD1-CD1 4.42Å; F97-I243 HydrophobicContact CD2-CD1 3.76Å; F97-I243 HydrophobicContact CD2-CG1 3.75Å; F97-I243 HydrophobicContact CE1-CD1 4.19Å; F97-I243 HydrophobicContact CE2-CD1 3.55Å; F97-I243 HydrophobicContact CE2-CG1 3.43Å; F97-I243 VanDerWaalsContact CE2-CG1 3.43Å; F97-I243 HydrophobicContact CG-CD1 4.22Å; F97-I243 HydrophobicContact CZ-CD1 3.76Å; F97-I243 HydrophobicContact CZ-CG1 4.06Å; F97-I246 HydrophobicContact CB-CD1 3.73Å; F97-V256 HydrophobicContact CB-CB 4.15Å; F97-V256 HydrophobicContact CB-CG1 4.42Å; F97-V256 HydrophobicContact CB-CG2 4.35Å; F97-V256 HydrophobicContact CD1-CB 4.35Å; F97-V256 HydrophobicContact CD1-CG2 3.69Å; F97-V256 HydrophobicContact CG-CG2 4.4Å; F97-V258 HydrophobicContact CD1-CG2 4.09Å; F97-V258 HydrophobicContact CE1-CG2 3.83Å; F97-I272 HydrophobicContact CE1-CG2 4.3Å; F97-I272 HydrophobicContact CZ-CD1 4Å; F97-I272 HydrophobicContact CZ-CG2 4.28Å
98	K	93.2	Very high	78.2	Confident	82 Å²	82	68 Å²	68	36%	0.357	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	132.2	172.8	-179.7	166.7	-177.3	177.2	0	109	L100 Q237 V256 V257	K98-L100 PolarHBondContact O-N 2.7Å; K98-Q237 WeakPolarHBondContact CE-O 3.45Å; K98-V256 CarbonylContact O-C 3.53Å; K98-V256 VanDerWaalsContact O-CA 3.24Å; K98-V256 WeakPolarHBondContact O-CA 3.39Å; K98-V256 WeakPolarHBondContact O-CB 3.4Å; K98-V257 HydrophobicContact CB-CG1 4.03Å; K98-V257 PolarHBondContact N-O 2.94Å; K98-V257 PolarHBondContact O-N 3.31Å
99	L	90.2	Very high	76.9	Confident	9 Å²	9	70.3 Å²	70.3	5%	0.047	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	131.7	170.7	-90.7	70	0	0	0	109.1	E233 M236 Q237 I246 T250	L99-E233 HydrophobicContact CD2-CG 4.34Å; L99-M236 HydrophobicContact CD1-CB 4.46Å; L99-M236 HydrophobicContact CD1-CE 4.35Å; L99-M236 HydrophobicContact CD2-CB 4.19Å; L99-Q237 HydrophobicContact CB-CG 4.37Å; L99-Q237 HydrophobicContact CD2-CG 4.43Å; L99-I246 HydrophobicContact CD1-CD1 3.84Å; L99-I246 HydrophobicContact CD1-CG1 3.87Å; L99-I246 HydrophobicContact CD1-CG2 4.3Å; L99-T250 HydrophobicContact CD2-CG2 4.03Å
100	L	84.6	Confident	76.1	Confident	44 Å²	44	71.6 Å²	71.6	23%	0.23	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-78.9	133.7	170.2	-74	171.8	0	0	0	109.8	K98 Q102 N255 V257 R277	K98-L100 PolarHBondContact O-N 2.7Å; L100-Q102 PolarHBondContact O-N 2.86Å; L100-N255 HydrophobicContact CB-CB 4.27Å; L100-N255 HydrophobicContact CD1-CB 4.24Å; L100-N255 PolarHBondContact N-O 3.23Å; L100-V257 HydrophobicContact CD1-CB 4.25Å; L100-V257 HydrophobicContact CD2-CB 3.87Å; L100-V257 HydrophobicContact CD2-CG1 3.69Å; L100-V257 HydrophobicContact CG-CB 4.06Å; L100-V257 HydrophobicContact CG-CG1 4.15Å; L100-R277 HydrophobicContact CD1-CB 4.37Å; L100-R277 HydrophobicContact CD1-CG 3.99Å
101	E	72.3	Confident	75.7	Confident	135 Å²	135	74.5 Å²	74.5	63%	0.631	36%	0.363	S	S	*	.	S	Bend	trans	-75.8	96.1	176.7	-169	168.2	-153.5	0	0	108.8
102	Q	58.2	Low	75.6	Confident	120 Å²	120	80.1 Å²	80.1	56%	0.561	38%	0.384	S	S	*	.			trans	72.9	117	-174.5	-54.7	179.5	-10.9	0	0	114.6	L100	L100-Q102 PolarHBondContact O-N 2.86Å
103	D	50.2	Low	75.7	Confident	50 Å²	50	75.7 Å²	75.7	27%	0.267	36%	0.363	S	S	.	.				-160.7	70.5	112.6	-77.4	-42.5	0	0	0	107.9	H80 N255	H80-D103 VanDerWaalsContact CE1-CG 3.45Å; H80-D103 IonicContact CE1-OD1 3.98Å; H80-D103 PolarHBondContact CE1-OD1 3.22Å; H80-D103 VanDerWaalsContact CE1-OD1 3.22Å; H80-D103 IonicContact CE1-OD2 2.61Å; H80-D103 PolarHBondContact CE1-OD2 3.02Å; H80-D103 IonicContact CG-OD2 2.84Å; H80-D103 IonicContact ND1-OD1 3.48Å; H80-D103 PolarHBondContact ND1-OD1 3.18Å; H80-D103 IonicContact ND1-OD2 3.4Å; H80-D103 PolarHBondContact ND1-OD2 3.49Å; D103-N255 VanDerWaalsContact CB-ND2 3.27Å; D103-N255 WeakPolarHBondContact CB-ND2 3.48Å; D103-N255 PolarHBondContact O-ND2 3.44Å
104	R	51.4	Low	75.7	Confident	90 Å²	90	79.8 Å²	79.8	34%	0.34	39%	0.385	S	S	.	.	S	Bend	trans	-64.9	138.6	149.3	-67.2	-170.9	-175.9	-171.1	4.6	105.3	V106 E108 E233	R104-V106 PolarHBondContact O-N 3.37Å; R104-E108 WeakPolarHBondContact CB-O 3.48Å; R104-E233 IonicContact CZ-OE1 3.28Å; R104-E233 IonicContact NE-OE1 2.73Å; R104-E233 IonicContact NH2-OE1 2.75Å; R104-E233 PolarHBondContact NH2-OE1 3.23Å; R104-E233 IonicContact NH2-OE2 3.63Å; R104-E233 PolarHBondContact NH2-OE2 3.09Å
105	D	47.4	Very low	75.8	Confident	98 Å²	98	75.3 Å²	75.3	52%	0.524	37%	0.366	S	S	.	.			trans	-52.1	141.7	-168.3	-56.7	-54.1	0	0	0	110.5	K107 E108 K279	D105-K107 PolarHBondContact O-N 3.29Å; D105-E108 PolarHBondContact O-N 3Å; D105-K279 IonicContact OD1-NZ 3.75Å; D105-K279 PolarHBondContact OD1-NZ 3.2Å; D105-K279 IonicContact OD2-NZ 3.28Å; D105-K279 PolarHBondContact OD2-NZ 3.23Å
106	V	47.3	Very low	75.8	Confident	128 Å²	128	75.3 Å²	75.3	78%	0.776	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	-19.7	-164.6	179.2	0	0	0	0	115.1	R104	R104-V106 PolarHBondContact O-N 3.37Å
107	K	46.7	Very low	75.8	Confident	191 Å²	191	77.6 Å²	77.6	83%	0.83	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-37.7	168.9	-116.4	170	179.4	168.8	0	115.2	D105	D105-K107 PolarHBondContact O-N 3.29Å
108	E	55.6	Low	75.8	Confident	135 Å²	135	81.1 Å²	81.1	63%	0.631	39%	0.393	S	S	*	.			trans	-137.5	81.4	-171.4	-71.6	-167.7	-157.1	0	0	114	R104 D105	R104-E108 WeakPolarHBondContact CB-O 3.48Å; D105-E108 PolarHBondContact O-N 3Å
109	P	68.1	Low	75.9	Confident	68 Å²	68	77.3 Å²	77.3	44%	0.442	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-66.8	163.8	168.2	29.7	-36	0	0	0	112.1	Q111	P109-Q111 PolarHBondContact O-N 3.05Å
110	V	78.8	Confident	76.1	Confident	28 Å²	28	77 Å²	77	17%	0.17	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-64.7	118.1	170.5	-179.4	0	0	0	0	109.3	Y112 C229	V110-Y112 HydrophobicContact CG1-CE1 4.23Å; V110-Y112 HydrophobicContact CG1-CE2 3.94Å; V110-C229 HydrophobicContact CB-CB 4.31Å; V110-C229 HydrophobicContact CG1-CB 3.5Å; V110-C229 HydrophobicContact CG2-CB 3.8Å
111	Q	87.8	Confident	76.6	Confident	69 Å²	69	83.8 Å²	83.8	32%	0.322	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-103.3	135.4	179.3	-65.3	175.6	52.2	0	0	109.8	P109 F113 S227 T228	P109-Q111 PolarHBondContact O-N 3.05Å; Q111-F113 HydrophobicContact CB-CE1 3.97Å; Q111-F113 HydrophobicContact CB-CE2 4Å; Q111-F113 HydrophobicContact CB-CZ 3.47Å; Q111-F113 VanDerWaalsContact CB-CZ 3.47Å; Q111-F113 HydrophobicContact CG-CZ 4.41Å; Q111-S227 CarbonylContact O-C 3.21Å; Q111-S227 VanDerWaalsContact O-CA 3.29Å; Q111-S227 WeakPolarHBondContact O-CA 3.41Å; Q111-T228 HydrophobicContact CB-CG2 4.11Å; Q111-T228 PolarHBondContact N-OG1 3.31Å; Q111-T228 PolarHBondContact O-N 3.21Å
112	Y	92.6	Very high	77.6	Confident	134 Å²	134	79.7 Å²	79.7	53%	0.525	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	138.1	175.2	-61.4	-79.5	0	0	0	109.9	V110 F226 L234	V110-Y112 HydrophobicContact CG1-CE1 4.23Å; V110-Y112 HydrophobicContact CG1-CE2 3.94Å; Y112-F226 WeakPolarHBondContact CA-O 3.4Å; Y112-L234 HydrophobicContact CE1-CD1 3.96Å; Y112-L234 WeakPolarHBondContact OH-CD2 3.47Å
113	F	95.1	Very high	79.3	Confident	13 Å²	13	78.2 Å²	78.2	6%	0.057	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	145	-177.9	-44.8	-76.1	0	0	0	109.9	Q111 E118 V119 A122 P124 V127 R225 F226 T228	Q111-F113 HydrophobicContact CB-CE1 3.97Å; Q111-F113 HydrophobicContact CB-CE2 4Å; Q111-F113 HydrophobicContact CB-CZ 3.47Å; Q111-F113 VanDerWaalsContact CB-CZ 3.47Å; Q111-F113 HydrophobicContact CG-CZ 4.41Å; F113-E118 HydrophobicContact CB-CB 3.93Å; F113-E118 HydrophobicContact CD1-CB 4.06Å; F113-E118 HydrophobicContact CG-CB 4.44Å; F113-V119 HydrophobicContact CB-CG2 3.63Å; F113-V119 HydrophobicContact CD2-CG2 3.7Å; F113-V119 HydrophobicContact CG-CG2 3.74Å; F113-A122 HydrophobicContact CD1-CB 4.47Å; F113-A122 HydrophobicContact CE1-CB 3.47Å; F113-A122 VanDerWaalsContact CE1-CB 3.47Å; F113-A122 HydrophobicContact CZ-CB 3.81Å; F113-P124 HydrophobicContact CE2-CG 4.26Å; F113-P124 HydrophobicContact CZ-CG 4.28Å; F113-V127 HydrophobicContact CD2-CG1 4.09Å; F113-V127 HydrophobicContact CE2-CG1 3.77Å; F113-R225 CarbonylContact O-C 3.49Å; F113-R225 VanDerWaalsContact O-CA 3.3Å; F113-R225 WeakPolarHBondContact O-CA 3.33Å; F113-F226 HydrophobicContact CB-CB 4.31Å; F113-F226 HydrophobicContact CD2-CB 4.21Å; F113-F226 PolarHBondContact N-O 3.2Å; F113-F226 PolarHBondContact O-N 3.25Å; F113-T228 HydrophobicContact CE2-CG2 4.04Å; F113-T228 HydrophobicContact CZ-CG2 4.36Å
114	N	94.7	Very high	81.3	Confident	97 Å²	97	76.9 Å²	76.9	52%	0.519	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	-1.3	-175.9	-52.8	-88.8	0	0	0	112.9	E118 G224	N114-E118 PolarHBondContact N-OE2 2.81Å; N114-E118 PolarHBondContact ND2-OE2 2.87Å; N114-E118 VanDerWaalsContact ND2-OE2 3.09Å; N114-G224 CarbonylContact C-O 3.58Å; N114-G224 PolarHBondContact O-N 3.09Å
115	S	94	Very high	83.1	Confident	17 Å²	17	78.9 Å²	78.9	12%	0.119	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	157.1	-179	62.5	0	0	0	0	111.1	E117 E118 V119 G224	S115-E117 PolarHBondContact O-N 2.85Å; S115-E118 PolarHBondContact O-N 2.99Å; S115-E118 VanDerWaalsContact OG-CD 3.3Å; S115-E118 WeakPolarHBondContact OG-CG 3.4Å; S115-E118 PolarHBondContact OG-N 3.11Å; S115-E118 PolarHBondContact OG-OE1 3.02Å; S115-V119 PolarHBondContact O-N 2.82Å; S115-G224 PolarHBondContact N-O 3.19Å
116	V	94.6	Very high	85.1	Confident	1 Å²	1	77.4 Å²	77.4	1%	0.006	38%	0.379	C	S	.	.	H	α-helix	trans	-65.5	-27.5	172.8	174.8	0	0	0	0	111.5	V119 A120 L205 L218 F220 C222 F226	V116-V119 PolarHBondContact O-N 2.64Å; V116-A120 VanDerWaalsContact O-CB 3.24Å; V116-A120 WeakPolarHBondContact O-CB 3.48Å; V116-A120 PolarHBondContact O-N 2.88Å; V116-L205 HydrophobicContact CG1-CB 3.63Å; V116-L205 HydrophobicContact CG1-CD2 3.78Å; V116-L205 HydrophobicContact CG1-CG 4.39Å; V116-L218 HydrophobicContact CG1-CB 3.81Å; V116-L218 WeakPolarHBondContact CG1-O 3.49Å; V116-L218 HydrophobicContact CG2-CB 4.08Å; V116-L218 HydrophobicContact CG2-CD1 4.32Å; V116-F220 HydrophobicContact CG1-CD1 4.29Å; V116-C222 HydrophobicContact CB-CB 4.43Å; V116-C222 HydrophobicContact CG2-CB 3.82Å; V116-C222 PolarHBondContact N-O 3.3Å; V116-C222 VanDerWaalsContact N-O 3.14Å; V116-F226 HydrophobicContact CG2-CE2 3.78Å; V116-F226 HydrophobicContact CG2-CZ 3.66Å
117	E	94.4	Very high	87.4	Confident	121 Å²	121	71.4 Å²	71.4	57%	0.565	34%	0.343	S	S	*	.	H	α-helix	trans	-63.7	-40.8	172.6	-170.7	170.4	-168.4	0	0	112.6	S115 A120 K121 F220	S115-E117 PolarHBondContact O-N 2.85Å; E117-A120 PolarHBondContact O-N 3.25Å; E117-K121 VanDerWaalsContact O-CB 3.29Å; E117-K121 WeakPolarHBondContact O-CB 3.25Å; E117-K121 PolarHBondContact O-N 3.24Å; E117-F220 HydrophobicContact CB-CB 4.06Å; E117-F220 HydrophobicContact CB-CD2 4.32Å; E117-F220 HydrophobicContact CB-CG 4.38Å; E117-F220 HydrophobicContact CG-CD2 4.05Å
118	E	95.4	Very high	89.7	Confident	73 Å²	73	63.3 Å²	63.3	34%	0.341	31%	0.307	S	S	.	.	H	α-helix	trans	-64.3	-45.5	174.4	-77.5	156.9	-120	0	0	111.6	F113 N114 S115 K121 A122	F113-E118 HydrophobicContact CB-CB 3.93Å; F113-E118 HydrophobicContact CD1-CB 4.06Å; F113-E118 HydrophobicContact CG-CB 4.44Å; N114-E118 PolarHBondContact N-OE2 2.81Å; N114-E118 PolarHBondContact ND2-OE2 2.87Å; N114-E118 VanDerWaalsContact ND2-OE2 3.09Å; S115-E118 PolarHBondContact O-N 2.99Å; S115-E118 VanDerWaalsContact OG-CD 3.3Å; S115-E118 WeakPolarHBondContact OG-CG 3.4Å; S115-E118 PolarHBondContact OG-N 3.11Å; S115-E118 PolarHBondContact OG-OE1 3.02Å; E118-K121 PolarHBondContact O-N 2.85Å; E118-A122 PolarHBondContact O-N 3.4Å
119	V	95.3	Very high	91.6	Very high	3 Å²	3	56.9 Å²	56.9	2%	0.018	28%	0.277	C	S	.	.	H	α-helix	trans	-60.8	-45.8	175.1	-176.3	0	0	0	0	110.9	F113 S115 V116 K121 A122 F123 V127 L163 L205 F226	F113-V119 HydrophobicContact CB-CG2 3.63Å; F113-V119 HydrophobicContact CD2-CG2 3.7Å; F113-V119 HydrophobicContact CG-CG2 3.74Å; S115-V119 PolarHBondContact O-N 2.82Å; V116-V119 PolarHBondContact O-N 2.64Å; V119-K121 PolarHBondContact O-N 3.23Å; V119-A122 PolarHBondContact O-N 2.72Å; V119-F123 WeakPolarHBondContact O-CA 3.48Å; V119-F123 PolarHBondContact O-N 3.05Å; V119-V127 HydrophobicContact CG1-CG1 3.83Å; V119-V127 HydrophobicContact CG1-CG2 4.03Å; V119-V127 HydrophobicContact CG2-CG1 4.49Å; V119-L163 HydrophobicContact CG1-CD1 3.73Å; V119-L163 HydrophobicContact CG1-CD2 4Å; V119-L205 HydrophobicContact CB-CD2 3.96Å; V119-L205 HydrophobicContact CG1-CD2 3.78Å; V119-F226 HydrophobicContact CG2-CB 3.88Å; V119-F226 HydrophobicContact CG2-CD2 3.8Å; V119-F226 HydrophobicContact CG2-CG 3.87Å
120	A	94.3	Very high	92.9	Very high	3 Å²	3	55.1 Å²	55.1	3%	0.025	26%	0.263	C	S	.	.	H	α-helix	trans	-62.4	-30.5	179.7	0	0	0	0	0	113.1	V116 E117 Q166 L205 F220	V116-A120 VanDerWaalsContact O-CB 3.24Å; V116-A120 WeakPolarHBondContact O-CB 3.48Å; V116-A120 PolarHBondContact O-N 2.88Å; E117-A120 PolarHBondContact O-N 3.25Å; A120-Q166 PolarHBondContact O-NE2 3.29Å; A120-L205 HydrophobicContact CB-CD1 3.72Å; A120-L205 HydrophobicContact CB-CD2 3.98Å; A120-L205 HydrophobicContact CB-CG 4.31Å; A120-F220 HydrophobicContact CB-CD1 4.2Å; A120-F220 HydrophobicContact CB-CE1 3.55Å; A120-F220 HydrophobicContact CB-CE2 4.01Å; A120-F220 HydrophobicContact CB-CZ 3.46Å; A120-F220 VanDerWaalsContact CB-CZ 3.46Å
121	K	94.1	Very high	93.6	Very high	186 Å²	186	56.8 Å²	56.8	81%	0.809	27%	0.269	S	S	*	.	H	α-helix	trans	-81.8	-34.7	-179.9	-179	-175.4	173.4	-168.9	0	113.2	E117 E118 V119	E117-K121 VanDerWaalsContact O-CB 3.29Å; E117-K121 WeakPolarHBondContact O-CB 3.25Å; E117-K121 PolarHBondContact O-N 3.24Å; E118-K121 PolarHBondContact O-N 2.85Å; V119-K121 PolarHBondContact O-N 3.23Å
122	A	93.4	Very high	93.9	Very high	48 Å²	48	60.4 Å²	60.4	40%	0.397	29%	0.286	S	S	.	.	H	α-helix	trans	-80.6	-34.5	174.8	0	0	0	0	0	112.3	F113 E118 V119	F113-A122 HydrophobicContact CD1-CB 4.47Å; F113-A122 HydrophobicContact CE1-CB 3.47Å; F113-A122 VanDerWaalsContact CE1-CB 3.47Å; F113-A122 HydrophobicContact CZ-CB 3.81Å; E118-A122 PolarHBondContact O-N 3.4Å; V119-A122 PolarHBondContact O-N 2.72Å
123	F	93.4	Very high	93.9	Very high	90 Å²	90	54.4 Å²	54.4	40%	0.395	26%	0.263	S	S	.	.			trans	46.2	55.5	179.4	-149.8	-91.9	0	0	0	114.5	V119 L163 L205	V119-F123 WeakPolarHBondContact O-CA 3.48Å; V119-F123 PolarHBondContact O-N 3.05Å; F123-L163 HydrophobicContact CE2-CB 4.38Å; F123-L163 HydrophobicContact CZ-CB 4.22Å; F123-L205 HydrophobicContact CD2-CD1 4.21Å; F123-L205 HydrophobicContact CE2-CD1 3.96Å
124	P	92.4	Very high	93.7	Very high	22 Å²	22	57.7 Å²	57.7	14%	0.143	28%	0.284	C	S	.	.			trans	-64.4	168.9	169.9	31.7	-36.6	0	0	0	110.9	F113 R126 V127 L163 T228	F113-P124 HydrophobicContact CE2-CG 4.26Å; F113-P124 HydrophobicContact CZ-CG 4.28Å; P124-R126 VanDerWaalsContact C-N 3.3Å; P124-R126 PolarHBondContact O-N 3.3Å; P124-V127 HydrophobicContact CG-CG1 3.68Å; P124-L163 HydrophobicContact CG-CD1 3.79Å; P124-L163 WeakPolarHBondContact O-CD1 3.31Å; P124-T228 HydrophobicContact CB-CG2 3.83Å; P124-T228 HydrophobicContact CG-CG2 4.01Å
125	E	89.2	Confident	93.3	Very high	131 Å²	131	54.6 Å²	54.6	61%	0.612	27%	0.266	S	S	*	.	S	Bend	trans	-60.4	-42.3	174.9	-167.6	-161.4	133.4	0	0	111.5	L163	E125-L163 PolarHBondContact O-N 3.15Å
126	R	90.9	Very high	92.8	Very high	68 Å²	68	58.2 Å²	58.2	26%	0.257	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	155.1	-174.8	-44	-172.6	-168	-132.2	-12.7	112.1	P124 E160 L161 T162	P124-R126 VanDerWaalsContact C-N 3.3Å; P124-R126 PolarHBondContact O-N 3.3Å; R126-E160 WeakPolarHBondContact CD-OE1 3.45Å; R126-E160 IonicContact CZ-OE1 3.68Å; R126-E160 IonicContact NE-OE1 3.22Å; R126-E160 IonicContact NH1-OE1 3.34Å; R126-E160 PolarHBondContact NH1-OE1 2.92Å; R126-L161 CarbonylContact C-O 3.05Å; R126-L161 VanDerWaalsContact CA-O 3.23Å; R126-L161 WeakPolarHBondContact CA-O 3.31Å; R126-T162 HydrophobicContact CG-CG2 4.42Å
127	V	94.6	Very high	92	Very high	2 Å²	2	59.4 Å²	59.4	1%	0.012	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	153.4	164.8	-64.7	0	0	0	0	111.6	F113 V119 P124 L161 L163 F226 S227	F113-V127 HydrophobicContact CD2-CG1 4.09Å; F113-V127 HydrophobicContact CE2-CG1 3.77Å; V119-V127 HydrophobicContact CG1-CG1 3.83Å; V119-V127 HydrophobicContact CG1-CG2 4.03Å; V119-V127 HydrophobicContact CG2-CG1 4.49Å; P124-V127 HydrophobicContact CG-CG1 3.68Å; V127-L161 HydrophobicContact CG2-CB 4.08Å; V127-L161 HydrophobicContact CG2-CD1 4.44Å; V127-L161 PolarHBondContact N-O 3.39Å; V127-L161 PolarHBondContact O-N 2.91Å; V127-L163 HydrophobicContact CG1-CD1 4.32Å; V127-F226 HydrophobicContact CB-CB 4.21Å; V127-F226 HydrophobicContact CG2-CB 4.27Å; V127-F226 HydrophobicContact CG2-CD1 4Å; V127-F226 HydrophobicContact CG2-CG 4.46Å; V127-S227 CarbonylContact C-O 3.53Å; V127-S227 VanDerWaalsContact CA-O 3.31Å; V127-S227 WeakPolarHBondContact CA-O 3.28Å
128	Y	95.1	Very high	91	Very high	21 Å²	21	59.9 Å²	59.9	8%	0.082	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	140.5	169.3	-64.1	-84	0	0	0	110.6	D159 E160 F226 S227 R251	Y128-D159 WeakPolarHBondContact CA-O 3.48Å; Y128-E160 HydrophobicContact CD1-CB 4.04Å; Y128-E160 HydrophobicContact CD1-CG 4.4Å; Y128-E160 HydrophobicContact CE1-CB 3.6Å; Y128-E160 HydrophobicContact CE1-CG 3.72Å; Y128-E160 WeakPolarHBondContact CE1-OE2 3.32Å; Y128-E160 PolarHBondContact OH-OE2 3.03Å; Y128-F226 CarbonylContact O-C 3.47Å; Y128-F226 VanDerWaalsContact O-CA 3.25Å; Y128-F226 WeakPolarHBondContact O-CA 3.49Å; Y128-S227 PolarHBondContact N-O 3.13Å; Y128-S227 PolarHBondContact O-N 3.21Å; Y128-R251 PolarHBondContact OH-NE 3.43Å
129	V	95.8	Very high	89.8	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	124.9	174.2	173.3	0	0	0	0	109.8	E131 I133 L155 S156 G158 D159 L161 F226	V129-E131 WeakPolarHBondContact CG1-O 3.09Å; V129-I133 HydrophobicContact CG1-CD1 3.95Å; V129-I133 HydrophobicContact CG1-CG1 4.37Å; V129-L155 HydrophobicContact CG1-CB 4.1Å; V129-L155 HydrophobicContact CG2-CB 4.15Å; V129-L155 HydrophobicContact CG2-CD1 3.93Å; V129-S156 WeakPolarHBondContact CB-O 3.34Å; V129-S156 VanDerWaalsContact CG1-O 3.29Å; V129-S156 WeakPolarHBondContact CG1-O 3.39Å; V129-G158 PolarHBondContact O-N 2.94Å; V129-D159 HydrophobicContact CB-CB 4.01Å; V129-D159 HydrophobicContact CG2-CB 3.83Å; V129-D159 PolarHBondContact N-O 2.74Å; V129-L161 HydrophobicContact CG2-CD1 3.81Å; V129-L161 HydrophobicContact CG2-CG 4.13Å; V129-F226 HydrophobicContact CG2-CD1 4.02Å; V129-F226 HydrophobicContact CG2-CE1 3.9Å
130	M	94.6	Very high	88.2	Confident	31 Å²	31	60 Å²	60	15%	0.153	30%	0.299	C	S	.	.			trans	-98.9	-2.6	-171.8	-62.5	-63.8	-62.9	0	0	114.3	R225 S227 P231 L234	M130-R225 HydrophobicContact CB-CB 3.79Å; M130-R225 WeakPolarHBondContact CB-O 3.42Å; M130-R225 PolarHBondContact N-O 3.19Å; M130-R225 PolarHBondContact O-NH2 3.33Å; M130-S227 WeakPolarHBondContact SD-CB 3.48Å; M130-P231 HydrophobicContact CE-CB 4.39Å; M130-P231 HydrophobicContact CE-CG 4.32Å; M130-P231 HydrophobicContact SD-CB 4.36Å; M130-P231 HydrophobicContact SD-CG 3.68Å; M130-L234 HydrophobicContact CE-CD1 3.69Å; M130-L234 HydrophobicContact SD-CD1 4.39Å
131	E	94.3	Very high	86.2	Confident	63 Å²	63	62.2 Å²	62.2	29%	0.294	31%	0.314	S	S	.	.	S	Bend	trans	-160.9	164.1	178.2	60.8	-161.1	178.7	0	0	110.6	V129 I133 T157 G224 R225	V129-E131 WeakPolarHBondContact CG1-O 3.09Å; E131-I133 HydrophobicContact CG-CG1 4.29Å; E131-I133 PolarHBondContact O-N 3.36Å; E131-T157 VanDerWaalsContact C-OG1 3.31Å; E131-T157 VanDerWaalsContact CA-OG1 3.3Å; E131-T157 WeakPolarHBondContact CA-OG1 3.41Å; E131-G224 WeakPolarHBondContact OE1-CA 3.35Å; E131-R225 HydrophobicContact CG-CB 4.35Å; E131-R225 PolarHBondContact OE1-N 3.31Å; E131-R225 IonicContact OE1-NE 2.87Å; E131-R225 IonicContact OE2-CZ 2.93Å; E131-R225 IonicContact OE2-NE 3.23Å; E131-R225 PolarHBondContact OE2-NE 2.91Å; E131-R225 IonicContact OE2-NH2 2.97Å; E131-R225 PolarHBondContact OE2-NH2 3.05Å
132	E	94.2	Very high	84.3	Confident	144 Å²	144	55.7 Å²	55.7	67%	0.673	30%	0.299	S	S	*	.			trans	-69.4	122.7	175.4	-172.4	175.5	-176	0	0	110.8	L155 T157	E132-L155 WeakPolarHBondContact CA-O 3.47Å; E132-T157 PolarHBondContact N-OG1 3.11Å
133	I	93	Very high	82.1	Confident	9 Å²	9	60.8 Å²	60.8	5%	0.046	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	113.5	-178.3	-58.2	166.1	0	0	0	108.4	V129 E131 T154 L155 F226	V129-I133 HydrophobicContact CG1-CD1 3.95Å; V129-I133 HydrophobicContact CG1-CG1 4.37Å; E131-I133 HydrophobicContact CG-CG1 4.29Å; E131-I133 PolarHBondContact O-N 3.36Å; I133-T154 WeakPolarHBondContact O-CA 3.25Å; I133-L155 HydrophobicContact CB-CB 4.23Å; I133-L155 HydrophobicContact CB-CD1 4.44Å; I133-L155 HydrophobicContact CD1-CD1 4.25Å; I133-L155 PolarHBondContact N-O 3.29Å; I133-L155 PolarHBondContact O-N 2.96Å; I133-F226 HydrophobicContact CD1-CE1 3.84Å; I133-F226 HydrophobicContact CD1-CE2 4.09Å; I133-F226 HydrophobicContact CD1-CZ 3.51Å
134	T	91	Very high	79.9	Confident	81 Å²	81	60 Å²	60	50%	0.497	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	123.6	168.9	-64.1	0	0	0	0	109.7	I153 T154	T134-I153 CarbonylContact C-O 3.59Å; T134-I153 WeakPolarHBondContact CA-O 3.44Å; T134-T154 HydrophobicContact CG2-CG2 4.13Å
135	F	86.1	Confident	78	Confident	33 Å²	33	65 Å²	65	15%	0.145	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	122.9	-178	-177.8	-85.7	0	0	0	111.3	V137 I153 P219 C222	F135-V137 HydrophobicContact CD1-CG2 4.37Å; F135-V137 HydrophobicContact CE1-CB 3.92Å; F135-V137 HydrophobicContact CE1-CG2 3.31Å; F135-V137 HydrophobicContact CZ-CG2 3.48Å; F135-V137 VanDerWaalsContact CZ-CG2 3.48Å; F135-I153 HydrophobicContact CD1-CD1 4.2Å; F135-I153 PolarHBondContact N-O 3.14Å; F135-I153 PolarHBondContact O-N 3.04Å; F135-P219 HydrophobicContact CD1-CG 4.3Å; F135-P219 HydrophobicContact CE1-CB 4.16Å; F135-P219 HydrophobicContact CE1-CG 3.63Å; F135-P219 HydrophobicContact CZ-CB 4.2Å; F135-P219 HydrophobicContact CZ-CG 4.18Å; F135-C222 HydrophobicContact CD2-CB 3.79Å; F135-C222 HydrophobicContact CE2-CB 4.06Å; F135-C222 HydrophobicContact CG-CB 4.1Å
136	N	83.5	Confident	76.4	Confident	93 Å²	93	66.9 Å²	66.9	50%	0.497	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	118.4	-172.8	-55.9	-30.3	0	0	0	110.5	Y151 N152	N136-Y151 WeakPolarHBondContact CA-O 3.35Å; N136-N152 WeakPolarHBondContact CB-OD1 3.43Å; N136-N152 VanDerWaalsContact CG-OD1 3.25Å; N136-N152 WeakPolarHBondContact OD1-CA 3.37Å; N136-N152 WeakPolarHBondContact OD1-CB 3.5Å; N136-N152 PolarHBondContact OD1-OD1 3.21Å; N136-N152 VanDerWaalsContact OD1-OD1 3.1Å
137	V	76.8	Confident	74.6	Confident	26 Å²	26	68.8 Å²	68.8	16%	0.158	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	135.7	175.8	154.5	0	0	0	0	111.9	F135 M139 Y151 M202	F135-V137 HydrophobicContact CD1-CG2 4.37Å; F135-V137 HydrophobicContact CE1-CB 3.92Å; F135-V137 HydrophobicContact CE1-CG2 3.31Å; F135-V137 HydrophobicContact CZ-CG2 3.48Å; F135-V137 VanDerWaalsContact CZ-CG2 3.48Å; V137-M139 HydrophobicContact CG1-CG 4.38Å; V137-M139 PolarHBondContact O-N 3.25Å; V137-Y151 PolarHBondContact N-O 3.1Å; V137-Y151 PolarHBondContact O-N 3.38Å; V137-M202 HydrophobicContact CG1-CE 3.96Å
138	K	74.2	Confident	73	Confident	131 Å²	131	72.2 Å²	72.2	57%	0.57	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.7	108.3	170.2	-65.9	-171.6	173.4	-163.5	0	109.7	T148 V150	K138-T148 HydrophobicContact CB-CG2 3.74Å; K138-T148 HydrophobicContact CD-CG2 3.84Å; K138-T148 HydrophobicContact CG-CG2 4.04Å; K138-V150 HydrophobicContact CG-CG1 4.33Å; K138-V150 HydrophobicContact CG-CG2 4.3Å
139	M	68.8	Low	71.6	Confident	43 Å²	43	76.2 Å²	76.2	21%	0.212	41%	0.41	C	S	.	.	B	Isolated β-bridge	trans	-81.6	162.2	176.5	-61.3	-158.6	-55.3	0	0	110.5	V137 E149 Y151 I169	V137-M139 HydrophobicContact CG1-CG 4.38Å; V137-M139 PolarHBondContact O-N 3.25Å; M139-E149 PolarHBondContact N-O 3.3Å; M139-Y151 HydrophobicContact CE-CD2 4.07Å; M139-Y151 HydrophobicContact CE-CG 4.07Å; M139-Y151 HydrophobicContact SD-CD1 4.24Å; M139-Y151 HydrophobicContact SD-CD2 4.47Å; M139-Y151 HydrophobicContact SD-CG 3.94Å; M139-I169 HydrophobicContact SD-CG2 3.86Å
140	A	62.1	Low	70.4	Confident	36 Å²	36	79.6 Å²	79.6	30%	0.298	43%	0.43	S	S	.	.			trans	-99.9	95.8	172.5	0	0	0	0	0	108.6	A172	A140-A172 HydrophobicContact CB-CB 4.08Å
141	S	52.6	Low	69.7	Low	48 Å²	48	81.1 Å²	81.1	34%	0.336	44%	0.435	S	S	.	.			trans	-75.6	126.4	174.6	-152.3	0	0	0	0	109.8	D147 E149	S141-D147 WeakPolarHBondContact CB-O 3.44Å; S141-E149 WeakPolarHBondContact CB-OE1 3.28Å; S141-E149 PolarHBondContact OG-OE1 2.85Å
142	G	55.2	Low	69.2	Low	49 Å²	49	82.8 Å²	82.8	51%	0.505	45%	0.445	S	S	.	.	S	Bend	trans	63.7	-154	168.4	0	0	0	0	0	118.4	R199	G142-R199 PolarHBondContact O-NH2 3.04Å
143	E	46.9	Very low	68.9	Low	156 Å²	156	76.4 Å²	76.4	73%	0.729	42%	0.416	S	S	*	.	S	Bend	trans	-112.9	-10.3	-173.4	-59.4	-122.5	99.2	0	0	114.2	R199	E143-R199 IonicContact OE1-CZ 3.91Å; E143-R199 IonicContact OE1-NH1 3.14Å; E143-R199 PolarHBondContact OE1-NH1 3.22Å; E143-R199 IonicContact OE1-NH2 3.73Å; E143-R199 PolarHBondContact OE1-NH2 3.49Å
144	C	46.7	Very low	68.9	Low	72 Å²	72	80.4 Å²	80.4	49%	0.486	44%	0.441	S	S	.	.	S	Bend	trans	-85.9	149.9	162.7	55	0	0	0	0	110
145	N	53.3	Low	69	Low	128 Å²	128	76.6 Å²	76.6	68%	0.684	42%	0.418	S	S	*	.	S	Bend	trans	-104.9	40.6	-174	-68.8	-91.2	0	0	0	112.5
146	E	54.6	Low	69.4	Low	171 Å²	171	77.3 Å²	77.3	80%	0.799	43%	0.427	S	S	*	.			trans	-122.7	-44.1	-177.7	-66.5	-173.9	118.6	0	0	112.8	T148	E146-T148 PolarHBondContact O-N 3.25Å; E146-T148 PolarHBondContact O-OG1 3.08Å
147	D	53.1	Low	70	Confident	108 Å²	108	76.8 Å²	76.8	58%	0.578	43%	0.427	S	S	*	.			trans	-75.4	83	-178.9	-63.7	-50.7	0	0	0	113.1	S141 E149	S141-D147 WeakPolarHBondContact CB-O 3.44Å; D147-E149 PolarHBondContact O-N 2.93Å
148	T	61.2	Low	70.7	Confident	74 Å²	74	77.4 Å²	77.4	45%	0.454	44%	0.438	S	S	.	.			trans	-88.1	77.3	179.8	-51.8	0	0	0	0	111.4	K138 E146	K138-T148 HydrophobicContact CB-CG2 3.74Å; K138-T148 HydrophobicContact CD-CG2 3.84Å; K138-T148 HydrophobicContact CG-CG2 4.04Å; E146-T148 PolarHBondContact O-N 3.25Å; E146-T148 PolarHBondContact O-OG1 3.08Å
149	E	65.3	Low	71.6	Confident	105 Å²	105	71.3 Å²	71.3	49%	0.491	41%	0.412	S	S	.	.			trans	-59.6	135.3	173.4	-68.7	173	-129.3	0	0	111.8	M139 S141 D147	M139-E149 PolarHBondContact N-O 3.3Å; S141-E149 WeakPolarHBondContact CB-OE1 3.28Å; S141-E149 PolarHBondContact OG-OE1 2.85Å; D147-E149 PolarHBondContact O-N 2.93Å
150	V	71.3	Confident	72.9	Confident	71 Å²	71	70.5 Å²	70.5	43%	0.43	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	108.1	177.1	-159.4	0	0	0	0	109.2	K138 N152	K138-V150 HydrophobicContact CG-CG1 4.33Å; K138-V150 HydrophobicContact CG-CG2 4.3Å; V150-N152 VanDerWaalsContact CG1-OD1 3.24Å; V150-N152 WeakPolarHBondContact CG1-OD1 3.36Å; V150-N152 PolarHBondContact O-N 3.24Å
151	Y	79.5	Confident	74.5	Confident	63 Å²	63	68.9 Å²	68.9	25%	0.247	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	101.9	173.2	-168.5	-122.7	0	0	0	108.8	N136 V137 M139 I153 S217	N136-Y151 WeakPolarHBondContact CA-O 3.35Å; V137-Y151 PolarHBondContact N-O 3.1Å; V137-Y151 PolarHBondContact O-N 3.38Å; M139-Y151 HydrophobicContact CE-CD2 4.07Å; M139-Y151 HydrophobicContact CE-CG 4.07Å; M139-Y151 HydrophobicContact SD-CD1 4.24Å; M139-Y151 HydrophobicContact SD-CD2 4.47Å; M139-Y151 HydrophobicContact SD-CG 3.94Å; Y151-I153 HydrophobicContact CD1-CD1 3.95Å; Y151-I153 HydrophobicContact CD1-CG1 3.87Å; Y151-I153 HydrophobicContact CE1-CD1 3.49Å; Y151-I153 VanDerWaalsContact CE1-CD1 3.49Å; Y151-I153 HydrophobicContact CE1-CG1 3.62Å; Y151-S217 PolarHBondContact OH-N 3.17Å
152	N	83.5	Confident	76.6	Confident	97 Å²	97	67.9 Å²	67.9	52%	0.519	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	126.6	175.8	-58.3	-30.9	0	0	0	108.5	N136 V150	N136-N152 WeakPolarHBondContact CB-OD1 3.43Å; N136-N152 VanDerWaalsContact CG-OD1 3.25Å; N136-N152 WeakPolarHBondContact OD1-CA 3.37Å; N136-N152 WeakPolarHBondContact OD1-CB 3.5Å; N136-N152 PolarHBondContact OD1-OD1 3.21Å; N136-N152 VanDerWaalsContact OD1-OD1 3.1Å; V150-N152 VanDerWaalsContact CG1-OD1 3.24Å; V150-N152 WeakPolarHBondContact CG1-OD1 3.36Å; V150-N152 PolarHBondContact O-N 3.24Å
153	I	88.1	Confident	78.5	Confident	11 Å²	11	66.3 Å²	66.3	6%	0.056	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	127.6	176.2	-43.5	176.1	0	0	0	107.7	T134 F135 Y151 L155 L218	T134-I153 CarbonylContact C-O 3.59Å; T134-I153 WeakPolarHBondContact CA-O 3.44Å; F135-I153 HydrophobicContact CD1-CD1 4.2Å; F135-I153 PolarHBondContact N-O 3.14Å; F135-I153 PolarHBondContact O-N 3.04Å; Y151-I153 HydrophobicContact CD1-CD1 3.95Å; Y151-I153 HydrophobicContact CD1-CG1 3.87Å; Y151-I153 HydrophobicContact CE1-CD1 3.49Å; Y151-I153 VanDerWaalsContact CE1-CD1 3.49Å; Y151-I153 HydrophobicContact CE1-CG1 3.62Å; I153-L155 HydrophobicContact CG2-CD2 4.29Å; I153-L155 HydrophobicContact CG2-CG 4.35Å; I153-L218 HydrophobicContact CD1-CD2 3.99Å; I153-L218 HydrophobicContact CG2-CD2 3.86Å
154	T	92.3	Very high	80.8	Confident	92 Å²	92	63.9 Å²	63.9	56%	0.564	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.3	116.8	174.3	46.1	0	0	0	0	109.8	I133 T134	I133-T154 WeakPolarHBondContact O-CA 3.25Å; T134-T154 HydrophobicContact CG2-CG2 4.13Å
155	L	94.7	Very high	83	Confident	2 Å²	2	61.4 Å²	61.4	1%	0.01	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	138.8	174.9	-53.5	176.5	0	0	0	109.6	V129 E132 I133 I153 L161 I216 L218 F226	V129-L155 HydrophobicContact CG1-CB 4.1Å; V129-L155 HydrophobicContact CG2-CB 4.15Å; V129-L155 HydrophobicContact CG2-CD1 3.93Å; E132-L155 WeakPolarHBondContact CA-O 3.47Å; I133-L155 HydrophobicContact CB-CB 4.23Å; I133-L155 HydrophobicContact CB-CD1 4.44Å; I133-L155 HydrophobicContact CD1-CD1 4.25Å; I133-L155 PolarHBondContact N-O 3.29Å; I133-L155 PolarHBondContact O-N 2.96Å; I153-L155 HydrophobicContact CG2-CD2 4.29Å; I153-L155 HydrophobicContact CG2-CG 4.35Å; L155-L161 HydrophobicContact CD1-CD1 4.15Å; L155-I216 HydrophobicContact CD2-CD1 3.64Å; L155-L218 HydrophobicContact CD1-CD1 4.16Å; L155-L218 HydrophobicContact CD1-CD2 3.92Å; L155-F226 HydrophobicContact CD1-CE1 4.33Å
156	S	94.9	Very high	84.9	Confident	48 Å²	48	60.7 Å²	60.7	34%	0.336	34%	0.335	S	S	.	.			trans	-99.6	152.4	178.4	-57.6	0	0	0	0	111.1	V129 G158 D159 R211	V129-S156 WeakPolarHBondContact CB-O 3.34Å; V129-S156 VanDerWaalsContact CG1-O 3.29Å; V129-S156 WeakPolarHBondContact CG1-O 3.39Å; S156-G158 PolarHBondContact O-N 3.1Å; S156-D159 WeakPolarHBondContact CB-OD1 3.3Å; S156-D159 PolarHBondContact N-OD2 3.39Å; S156-D159 WeakPolarHBondContact O-CB 3.42Å; S156-D159 PolarHBondContact O-N 3.01Å; S156-D159 VanDerWaalsContact O-OD1 3.12Å; S156-R211 PolarHBondContact OG-NH2 2.98Å
157	T	94.3	Very high	86.5	Confident	81 Å²	81	54.5 Å²	54.5	50%	0.497	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	123.9	172.3	-49	0	0	0	0	110.1	E131 E132 P231	E131-T157 VanDerWaalsContact C-OG1 3.31Å; E131-T157 VanDerWaalsContact CA-OG1 3.3Å; E131-T157 WeakPolarHBondContact CA-OG1 3.41Å; E132-T157 PolarHBondContact N-OG1 3.11Å; T157-P231 HydrophobicContact CG2-CB 4.47Å; T157-P231 HydrophobicContact CG2-CG 4.16Å
158	G	91.8	Very high	88	Confident	39 Å²	39	54.9 Å²	54.9	40%	0.402	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.5	-5.9	-175.7	0	0	0	0	0	115.3	V129 S156 E160	V129-G158 PolarHBondContact O-N 2.94Å; S156-G158 PolarHBondContact O-N 3.1Å; G158-E160 PolarHBondContact O-N 3.04Å
159	D	94.6	Very high	88.8	Confident	4 Å²	4	53.2 Å²	53.2	2%	0.021	30%	0.299	C	S	.	.			trans	-58.4	123.7	175.5	-73.7	11.2	0	0	0	111	Y128 V129 S156 L161 N209 R211	Y128-D159 WeakPolarHBondContact CA-O 3.48Å; V129-D159 HydrophobicContact CB-CB 4.01Å; V129-D159 HydrophobicContact CG2-CB 3.83Å; V129-D159 PolarHBondContact N-O 2.74Å; S156-D159 WeakPolarHBondContact CB-OD1 3.3Å; S156-D159 PolarHBondContact N-OD2 3.39Å; S156-D159 WeakPolarHBondContact O-CB 3.42Å; S156-D159 PolarHBondContact O-N 3.01Å; S156-D159 VanDerWaalsContact O-OD1 3.12Å; D159-L161 HydrophobicContact CB-CD2 4.46Å; D159-N209 PolarHBondContact OD2-ND2 3.2Å; D159-R211 IonicContact OD1-CZ 3.83Å; D159-R211 IonicContact OD1-NE 2.74Å; D159-R211 PolarHBondContact OD1-NE 2.92Å; D159-R211 IonicContact OD1-NH2 3.17Å; D159-R211 PolarHBondContact OD1-NH2 3.14Å; D159-R211 VanDerWaalsContact OD1-NH2 3.16Å; D159-R211 IonicContact OD2-CZ 3.77Å; D159-R211 IonicContact OD2-NE 2.74Å; D159-R211 IonicContact OD2-NH2 2.64Å; D159-R211 PolarHBondContact OD2-NH2 3.39Å
160	E	94.9	Very high	89.2	Confident	26 Å²	26	52.2 Å²	52.2	12%	0.121	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	121.5	171.2	-174.8	173.6	139.1	0	0	110.1	R126 Y128 G158 H210 R251	R126-E160 WeakPolarHBondContact CD-OE1 3.45Å; R126-E160 IonicContact CZ-OE1 3.68Å; R126-E160 IonicContact NE-OE1 3.22Å; R126-E160 IonicContact NH1-OE1 3.34Å; R126-E160 PolarHBondContact NH1-OE1 2.92Å; Y128-E160 HydrophobicContact CD1-CB 4.04Å; Y128-E160 HydrophobicContact CD1-CG 4.4Å; Y128-E160 HydrophobicContact CE1-CB 3.6Å; Y128-E160 HydrophobicContact CE1-CG 3.72Å; Y128-E160 WeakPolarHBondContact CE1-OE2 3.32Å; Y128-E160 PolarHBondContact OH-OE2 3.03Å; G158-E160 PolarHBondContact O-N 3.04Å; E160-H210 HydrophobicContact CB-CB 4.31Å; E160-H210 PolarHBondContact O-CD2 2.88Å; E160-H210 PolarHBondContact O-N 3.09Å; E160-H210 IonicContact OE1-CD2 3.16Å; E160-H210 IonicContact OE1-NE2 2.68Å; E160-R251 IonicContact OE1-CZ 3.34Å; E160-R251 IonicContact OE1-NH1 3.94Å; E160-R251 IonicContact OE1-NH2 3.06Å; E160-R251 PolarHBondContact OE1-NH2 3.38Å; E160-R251 IonicContact OE2-CZ 2.72Å; E160-R251 IonicContact OE2-NE 3.22Å; E160-R251 IonicContact OE2-NH2 3.9Å; E160-R251 PolarHBondContact OE2-NH2 3.45Å
161	L	96	Very high	89.1	Confident	1 Å²	1	51 Å²	51	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	114.7	177.9	-54.8	-175.1	0	0	0	109.3	R126 V127 V129 L155 D159 C207 M208 N209 I216 L218 F226	R126-L161 CarbonylContact C-O 3.05Å; R126-L161 VanDerWaalsContact CA-O 3.23Å; R126-L161 WeakPolarHBondContact CA-O 3.31Å; V127-L161 HydrophobicContact CG2-CB 4.08Å; V127-L161 HydrophobicContact CG2-CD1 4.44Å; V127-L161 PolarHBondContact N-O 3.39Å; V127-L161 PolarHBondContact O-N 2.91Å; V129-L161 HydrophobicContact CG2-CD1 3.81Å; V129-L161 HydrophobicContact CG2-CG 4.13Å; L155-L161 HydrophobicContact CD1-CD1 4.15Å; D159-L161 HydrophobicContact CB-CD2 4.46Å; L161-C207 HydrophobicContact CB-CB 4.16Å; L161-M208 WeakPolarHBondContact CA-O 3.48Å; L161-N209 HydrophobicContact CD2-CB 3.71Å; L161-I216 HydrophobicContact CD1-CD1 4.26Å; L161-I216 HydrophobicContact CD2-CD1 3.71Å; L161-L218 HydrophobicContact CD1-CD1 3.77Å; L161-F226 HydrophobicContact CD1-CD1 4.4Å; L161-F226 HydrophobicContact CD1-CE1 3.99Å
162	T	96	Very high	88.3	Confident	28 Å²	28	49.5 Å²	49.5	17%	0.172	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	133.9	169.3	-62.1	0	0	0	0	110	R126 C207 M208 H210	R126-T162 HydrophobicContact CG-CG2 4.42Å; T162-C207 CarbonylContact O-C 3.59Å; T162-C207 VanDerWaalsContact O-CA 3.22Å; T162-C207 WeakPolarHBondContact O-CA 3.33Å; T162-M208 PolarHBondContact N-O 2.81Å; T162-M208 PolarHBondContact O-N 3.01Å; T162-H210 PolarHBondContact OG1-NE2 3.31Å
163	L	95.5	Very high	87	Confident	16 Å²	16	50.5 Å²	50.5	8%	0.084	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	118.7	-167.9	-73.9	153.8	0	0	0	110.9	V119 F123 P124 E125 V127 L205	V119-L163 HydrophobicContact CG1-CD1 3.73Å; V119-L163 HydrophobicContact CG1-CD2 4Å; F123-L163 HydrophobicContact CE2-CB 4.38Å; F123-L163 HydrophobicContact CZ-CB 4.22Å; P124-L163 HydrophobicContact CG-CD1 3.79Å; P124-L163 WeakPolarHBondContact O-CD1 3.31Å; E125-L163 PolarHBondContact O-N 3.15Å; V127-L163 HydrophobicContact CG1-CD1 4.32Å; L163-L205 HydrophobicContact CD2-CD1 3.82Å; L163-L205 HydrophobicContact CD2-CD2 3.39Å; L163-L205 HydrophobicContact CD2-CG 3.51Å
164	M	94.4	Very high	85.2	Confident	105 Å²	105	55 Å²	55	52%	0.517	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-25.2	-171.1	-65.9	169.1	54.3	0	0	113.6	I206 M208	M164-I206 HydrophobicContact CB-CB 4.29Å; M164-I206 HydrophobicContact CB-CG2 4.04Å; M164-I206 WeakPolarHBondContact CB-O 3.18Å; M164-I206 HydrophobicContact CE-CG2 4.05Å; M164-I206 PolarHBondContact N-O 3.03Å; M164-I206 HydrophobicContact SD-CG2 4.17Å; M164-M208 HydrophobicContact SD-CB 3.87Å; M164-M208 HydrophobicContact SD-CE 4.29Å
165	G	93.4	Very high	83	Confident	19 Å²	19	55.9 Å²	55.9	20%	0.196	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.8	-169.9	-179.3	0	0	0	0	0	113.5	I206	G165-I206 PolarHBondContact N-O 2.84Å; G165-I206 PolarHBondContact O-N 2.67Å
166	Q	93.1	Very high	80.5	Confident	114 Å²	114	65.2 Å²	65.2	53%	0.533	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	145.3	177.8	-59.5	-179.8	12.8	0	0	110.3	A120 C204 L205 F220	A120-Q166 PolarHBondContact O-NE2 3.29Å; Q166-C204 CarbonylContact C-O 3.54Å; Q166-C204 WeakPolarHBondContact CA-O 3.49Å; Q166-L205 HydrophobicContact CG-CD1 4Å; Q166-F220 HydrophobicContact CG-CZ 4.22Å
167	A	89.1	Confident	77.7	Confident	41 Å²	41	72 Å²	72	34%	0.339	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	164.9	179.7	0	0	0	0	0	111.5	P203 C204 I206	A167-P203 WeakPolarHBondContact O-CA 3.48Å; A167-C204 PolarHBondContact N-O 3.43Å; A167-C204 PolarHBondContact O-N 3.08Å; A167-I206 HydrophobicContact CB-CD1 3.91Å; A167-I206 HydrophobicContact CB-CG1 4.04Å
168	E	83.9	Confident	75.2	Confident	116 Å²	116	77.5 Å²	77.5	54%	0.542	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	115.7	171.3	-67.1	-176.4	130.6	0	0	110.4	K201 M202	E168-K201 IonicContact OE1-NZ 3.47Å; E168-K201 WeakPolarHBondContact OE2-CD 3.08Å; E168-K201 VanDerWaalsContact OE2-CE 3.29Å; E168-K201 WeakPolarHBondContact OE2-CE 3.45Å; E168-K201 IonicContact OE2-NZ 2.65Å; E168-K201 PolarHBondContact OE2-NZ 3.02Å; E168-M202 WeakPolarHBondContact CA-O 3.47Å
169	I	78.8	Confident	72.8	Confident	38 Å²	38	80.3 Å²	80.3	20%	0.195	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	140.2	174.8	-61.9	-172.8	0	0	0	109.8	M139 M202 C204	M139-I169 HydrophobicContact SD-CG2 3.86Å; I169-M202 PolarHBondContact N-O 3.46Å; I169-M202 PolarHBondContact O-N 3.48Å; I169-C204 HydrophobicContact CD1-CB 4.3Å; I169-C204 HydrophobicContact CG1-CB 4.38Å
170	L	72.4	Confident	70.7	Confident	84 Å²	84	91.5 Å²	91.5	44%	0.44	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	126.7	175	-64.4	179.7	0	0	0	110.8	G200 K201	L170-G200 CarbonylContact C-O 3.54Å; L170-G200 WeakPolarHBondContact CA-O 3.48Å; L170-K201 HydrophobicContact CD2-CG 3.9Å
171	Y	69.6	Low	68.5	Low	46 Å²	46	97.2 Å²	97.2	18%	0.18	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	153.2	-179.2	80.4	-80.3	0	0	0	113.1	K173 G200 M202	Y171-K173 HydrophobicContact CD2-CG 4.5Å; Y171-K173 HydrophobicContact CE2-CG 3.72Å; Y171-K173 PolarHBondContact O-N 2.91Å; Y171-K173 VanDerWaalsContact OH-CE 3.22Å; Y171-K173 WeakPolarHBondContact OH-CE 3.48Å; Y171-G200 VanDerWaalsContact CD1-C 3.48Å; Y171-G200 WeakPolarHBondContact CD1-O 3.33Å; Y171-G200 VanDerWaalsContact CE1-CA 3.5Å; Y171-G200 PolarHBondContact N-O 2.95Å; Y171-G200 PolarHBondContact O-N 3.42Å; Y171-M202 HydrophobicContact CD1-CB 3.64Å; Y171-M202 HydrophobicContact CE1-CB 3.93Å
172	A	62.8	Low	66.1	Low	31 Å²	31	103.8 Å²	103.8	26%	0.256	53%	0.532	S	S	.	.			trans	-74.7	109.7	174	0	0	0	0	0	109.1	A140 S174	A140-A172 HydrophobicContact CB-CB 4.08Å; A172-S174 VanDerWaalsContact C-N 3.28Å; A172-S174 PolarHBondContact O-N 3.3Å
173	K	57.2	Low	64	Low	119 Å²	119	108.8 Å²	108.8	52%	0.517	56%	0.563	S	S	.	*			trans	-68.9	92.4	162.8	-76.4	-172.4	179.4	175.5	0	108.6	Y171 S175 G198	Y171-K173 HydrophobicContact CD2-CG 4.5Å; Y171-K173 HydrophobicContact CE2-CG 3.72Å; Y171-K173 PolarHBondContact O-N 2.91Å; Y171-K173 VanDerWaalsContact OH-CE 3.22Å; Y171-K173 WeakPolarHBondContact OH-CE 3.48Å; K173-S175 PolarHBondContact O-N 2.87Å; K173-G198 WeakPolarHBondContact CD-O 3.45Å; K173-G198 WeakPolarHBondContact CG-O 3.41Å
174	S	49.8	Very low	62.1	Low	106 Å²	106	115.1 Å²	115.1	74%	0.741	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-51.9	123.1	161.5	51.5	0	0	0	0	108.1	A172 K176	A172-S174 VanDerWaalsContact C-N 3.28Å; A172-S174 PolarHBondContact O-N 3.3Å; S174-K176 PolarHBondContact O-N 2.76Å; S174-K176 VanDerWaalsContact O-N 3.15Å
175	S	46.1	Very low	60.1	Low	110 Å²	110	119.2 Å²	119.2	77%	0.769	61%	0.611	S	S	*	*	P	Polyproline II helix	trans	-64.6	119.6	175.5	50.4	0	0	0	0	107.3	K173 E177	K173-S175 PolarHBondContact O-N 2.87Å; S175-E177 PolarHBondContact O-N 3.11Å
176	K	41.7	Very low	58.3	Low	198 Å²	198	128 Å²	128	86%	0.861	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-47.8	129.1	176.6	-81.8	-169	173.9	-173	0	108.8	S174 K178	S174-K176 PolarHBondContact O-N 2.76Å; S174-K176 VanDerWaalsContact O-N 3.15Å; K176-K178 PolarHBondContact O-N 3.34Å; K176-K178 VanDerWaalsContact O-N 3.13Å
177	E	36.1	Very low	56.1	Low	190 Å²	190	132.1 Å²	132.1	89%	0.888	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-47.6	121.5	179.4	-171.3	-176.7	157.8	0	0	109.4	S175 S179	S175-E177 PolarHBondContact O-N 3.11Å; E177-S179 PolarHBondContact O-N 3.41Å
178	K	42	Very low	54.1	Low	196 Å²	196	138.4 Å²	138.4	85%	0.852	69%	0.686	S	S	*	*			trans	-72.3	96	-176.9	-76.7	-177.8	178.6	174.6	0	108.8	K176 R180	K176-K178 PolarHBondContact O-N 3.34Å; K176-K178 VanDerWaalsContact O-N 3.13Å; K178-R180 PolarHBondContact O-N 2.82Å
179	S	41.7	Very low	51.8	Low	99 Å²	99	136.1 Å²	136.1	69%	0.692	69%	0.694	S	S	*	*			trans	-41	133.4	160.4	179.7	0	0	0	0	109.5	E177 L181	E177-S179 PolarHBondContact O-N 3.41Å; S179-L181 PolarHBondContact O-N 3.43Å
180	R	49.9	Very low	50.5	Low	238 Å²	238	144.3 Å²	144.3	90%	0.898	73%	0.728	S	S	*	*	S	Bend	trans	-76.7	48.7	-154	-69.4	170	54.1	-169.2	-3.9	114.5	K178	K178-R180 PolarHBondContact O-N 2.82Å
181	L	49.6	Very low	48.9	Very low	147 Å²	147	147.4 Å²	147.4	77%	0.77	74%	0.744	S	S	*	*			trans	-128.4	70.3	-175.9	-65.5	176.9	0	0	0	111.6	S179	S179-L181 PolarHBondContact O-N 3.43Å
182	N	44.5	Very low	47.6	Very low	138 Å²	138	153 Å²	153	74%	0.738	78%	0.777	S	S	*	*			trans	-167.7	65.1	152.5	-107.1	-35.7	0	0	0	113.5
183	T	53.7	Low	46.4	Very low	133 Å²	133	156 Å²	156	82%	0.816	80%	0.796	S	S	*	*			trans	-93.2	4.2	173.6	-41.7	0	0	0	0	112.6
184	I	55.1	Low	45.9	Very low	149 Å²	149	157.7 Å²	157.7	76%	0.764	81%	0.809	S	S	*	*	S	Bend	trans	-122	30.7	-166.7	-32.3	-177	0	0	0	113.4
185	F	52.5	Low	45.5	Very low	192 Å²	192	157.3 Å²	157.3	84%	0.842	81%	0.807	S	S	*	*			trans	-135.1	63.9	165.7	-77.4	-69.6	0	0	0	112.2
186	K	54.5	Low	45.4	Very low	204 Å²	204	161.1 Å²	161.1	89%	0.887	81%	0.809	S	S	*	*			trans	-80.3	153.3	153.6	-75	-174.9	176.5	179.9	0	109.2
187	K	48.2	Very low	45.7	Very low	199 Å²	199	156.8 Å²	156.8	87%	0.865	79%	0.794	S	S	*	*			trans	80	76	164.7	-161.1	-176	-176	-179.2	0	117.3
188	I	46.4	Very low	46.4	Very low	174 Å²	174	149.6 Å²	149.6	89%	0.892	77%	0.771	S	S	*	*				-166.4	147.8	127.3	-104.3	160.4	0	0	0	110.4
189	G	35.5	Very low	47.1	Very low	68 Å²	68	146 Å²	146	70%	0.701	75%	0.752	S	S	*	*			trans	80.2	117.8	156.8	0	0	0	0	0	117.9	L191	G189-L191 PolarHBondContact O-N 2.86Å
190	K	51.3	Low	48.3	Very low	209 Å²	209	141.4 Å²	141.4	91%	0.909	72%	0.721	S	S	*	*			trans	-66.5	126.7	153.5	-76	178.5	174.4	178.4	0	108.5
191	L	39.4	Very low	49.8	Very low	149 Å²	149	136.3 Å²	136.3	78%	0.78	71%	0.705	S	S	*	*			trans	-144.7	130.7	151.5	-147.2	88.5	0	0	0	109.4	G189 S193	G189-L191 PolarHBondContact O-N 2.86Å; L191-S193 PolarHBondContact O-N 3.38Å
192	N	41	Very low	51.4	Low	164 Å²	164	129.5 Å²	129.5	88%	0.877	67%	0.67	S	S	*	*			trans	-79.5	63.8	175.1	-73.4	2.2	0	0	0	110.5	I194	N192-I194 VanDerWaalsContact C-N 3.34Å; N192-I194 PolarHBondContact O-N 2.81Å; N192-I194 VanDerWaalsContact O-N 3.17Å
193	S	38.8	Very low	53.6	Low	93 Å²	93	125.5 Å²	125.5	65%	0.65	65%	0.651	S	S	*	*			trans	-81.5	85.4	164.9	61.5	0	0	0	0	109	L191 S195	L191-S193 PolarHBondContact O-N 3.38Å; S193-S195 PolarHBondContact O-N 3.47Å
194	I	46.7	Very low	55.5	Low	155 Å²	155	119.2 Å²	119.2	80%	0.795	61%	0.612	S	S	*	*			trans	-55	112.3	157.5	-67.1	174.4	0	0	0	105.5	N192 K196	N192-I194 VanDerWaalsContact C-N 3.34Å; N192-I194 PolarHBondContact O-N 2.81Å; N192-I194 VanDerWaalsContact O-N 3.17Å; I194-K196 VanDerWaalsContact C-N 3.3Å; I194-K196 PolarHBondContact O-N 3.02Å
195	S	40.5	Very low	57.4	Low	99 Å²	99	112.2 Å²	112.2	69%	0.692	58%	0.577	S	S	*	*			trans	-67.2	94.2	177.5	177.5	0	0	0	0	107.5	S193 I197	S193-S195 PolarHBondContact O-N 3.47Å; S195-I197 WeakPolarHBondContact O-CD1 3.31Å; S195-I197 PolarHBondContact O-N 2.87Å
196	K	44.8	Very low	59.4	Low	190 Å²	190	104.4 Å²	104.4	83%	0.826	54%	0.544	S	S	*	.			trans	-49.9	114	172.5	-72.5	-174.9	175.1	-175.8	0	107.8	I194 G198	I194-K196 VanDerWaalsContact C-N 3.3Å; I194-K196 PolarHBondContact O-N 3.02Å; K196-G198 PolarHBondContact O-N 2.87Å
197	I	47.6	Very low	61.4	Low	106 Å²	106	94.8 Å²	94.8	54%	0.544	50%	0.502	S	S	.	.			trans	-56.4	113.1	165.2	-82.5	57.9	0	0	0	104.6	S195 R199	S195-I197 WeakPolarHBondContact O-CD1 3.31Å; S195-I197 PolarHBondContact O-N 2.87Å; I197-R199 PolarHBondContact O-N 2.75Å
198	G	51	Low	63.7	Low	39 Å²	39	88 Å²	88	40%	0.402	47%	0.474	S	S	.	.			trans	-75.4	79.6	-173.6	0	0	0	0	0	109.7	K173 K196 G200	K173-G198 WeakPolarHBondContact CD-O 3.45Å; K173-G198 WeakPolarHBondContact CG-O 3.41Å; K196-G198 PolarHBondContact O-N 2.87Å; G198-G200 PolarHBondContact O-N 3.17Å
199	R	57.2	Low	66.1	Low	120 Å²	120	79.8 Å²	79.8	45%	0.453	43%	0.432	S	S	.	.			trans	-42.5	107.5	167.9	-80.7	-178.3	169.2	162	-4.5	107	G142 E143 I197	G142-R199 PolarHBondContact O-NH2 3.04Å; E143-R199 IonicContact OE1-CZ 3.91Å; E143-R199 IonicContact OE1-NH1 3.14Å; E143-R199 PolarHBondContact OE1-NH1 3.22Å; E143-R199 IonicContact OE1-NH2 3.73Å; E143-R199 PolarHBondContact OE1-NH2 3.49Å; I197-R199 PolarHBondContact O-N 2.75Å
200	G	66.8	Low	68.8	Low	4 Å²	4	80.1 Å²	80.1	4%	0.041	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	137.7	-177.1	0	0	0	0	0	109	L170 Y171 G198	L170-G200 CarbonylContact C-O 3.54Å; L170-G200 WeakPolarHBondContact CA-O 3.48Å; Y171-G200 VanDerWaalsContact CD1-C 3.48Å; Y171-G200 WeakPolarHBondContact CD1-O 3.33Å; Y171-G200 VanDerWaalsContact CE1-CA 3.5Å; Y171-G200 PolarHBondContact N-O 2.95Å; Y171-G200 PolarHBondContact O-N 3.42Å; G198-G200 PolarHBondContact O-N 3.17Å
201	K	80.5	Confident	70.8	Confident	131 Å²	131	76.4 Å²	76.4	57%	0.57	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.7	132.3	159.8	-71.8	176.3	157.1	-148.6	0	108	E168 L170	E168-K201 IonicContact OE1-NZ 3.47Å; E168-K201 WeakPolarHBondContact OE2-CD 3.08Å; E168-K201 VanDerWaalsContact OE2-CE 3.29Å; E168-K201 WeakPolarHBondContact OE2-CE 3.45Å; E168-K201 IonicContact OE2-NZ 2.65Å; E168-K201 PolarHBondContact OE2-NZ 3.02Å; L170-K201 HydrophobicContact CD2-CG 3.9Å
202	M	84.2	Confident	73.3	Confident	4 Å²	4	71.6 Å²	71.6	2%	0.02	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	119.7	173	-174.8	164.6	66	0	0	108.4	V137 E168 I169 Y171 P219	V137-M202 HydrophobicContact CG1-CE 3.96Å; E168-M202 WeakPolarHBondContact CA-O 3.47Å; I169-M202 PolarHBondContact N-O 3.46Å; I169-M202 PolarHBondContact O-N 3.48Å; Y171-M202 HydrophobicContact CD1-CB 3.64Å; Y171-M202 HydrophobicContact CE1-CB 3.93Å; M202-P219 HydrophobicContact CE-CB 3.66Å; M202-P219 HydrophobicContact CE-CG 3.51Å; M202-P219 HydrophobicContact CG-CB 4.02Å; M202-P219 HydrophobicContact SD-CB 3.66Å; M202-P219 HydrophobicContact SD-CG 4.18Å
203	P	90.8	Very high	75.9	Confident	53 Å²	53	69.6 Å²	69.6	34%	0.344	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	134.7	174.8	28.7	-32.8	0	0	0	109.9	A167 F220	A167-P203 WeakPolarHBondContact O-CA 3.48Å; P203-F220 HydrophobicContact CB-CD1 4.19Å; P203-F220 HydrophobicContact CB-CD2 3.84Å; P203-F220 HydrophobicContact CB-CE1 4.22Å; P203-F220 HydrophobicContact CB-CE2 3.88Å; P203-F220 HydrophobicContact CB-CG 3.99Å; P203-F220 HydrophobicContact CB-CZ 4.06Å; P203-F220 HydrophobicContact CG-CB 4.14Å; P203-F220 HydrophobicContact CG-CD2 3.78Å; P203-F220 HydrophobicContact CG-CE2 4.28Å; P203-F220 HydrophobicContact CG-CG 3.93Å; P203-F220 WeakPolarHBondContact O-CD1 3.46Å; P203-F220 PolarHBondContact O-N 2.9Å
204	C	92.3	Very high	78.4	Confident	1 Å²	1	70.8 Å²	70.8	1%	0.007	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	145.3	-179.3	-61.3	0	0	0	0	110.5	Q166 A167 I169 L218	Q166-C204 CarbonylContact C-O 3.54Å; Q166-C204 WeakPolarHBondContact CA-O 3.49Å; A167-C204 PolarHBondContact N-O 3.43Å; A167-C204 PolarHBondContact O-N 3.08Å; I169-C204 HydrophobicContact CD1-CB 4.3Å; I169-C204 HydrophobicContact CG1-CB 4.38Å; C204-L218 CarbonylContact C-O 3.56Å; C204-L218 VanDerWaalsContact CA-O 3.22Å; C204-L218 WeakPolarHBondContact CA-O 3.28Å
205	L	95.3	Very high	80.6	Confident	2 Å²	2	66.5 Å²	66.5	1%	0.01	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	117.3	175	-168.3	60.9	0	0	0	108.1	V116 V119 A120 F123 L163 Q166 L218 F220	V116-L205 HydrophobicContact CG1-CB 3.63Å; V116-L205 HydrophobicContact CG1-CD2 3.78Å; V116-L205 HydrophobicContact CG1-CG 4.39Å; V119-L205 HydrophobicContact CB-CD2 3.96Å; V119-L205 HydrophobicContact CG1-CD2 3.78Å; A120-L205 HydrophobicContact CB-CD1 3.72Å; A120-L205 HydrophobicContact CB-CD2 3.98Å; A120-L205 HydrophobicContact CB-CG 4.31Å; F123-L205 HydrophobicContact CD2-CD1 4.21Å; F123-L205 HydrophobicContact CE2-CD1 3.96Å; L163-L205 HydrophobicContact CD2-CD1 3.82Å; L163-L205 HydrophobicContact CD2-CD2 3.39Å; L163-L205 HydrophobicContact CD2-CG 3.51Å; Q166-L205 HydrophobicContact CG-CD1 4Å; L205-L218 PolarHBondContact N-O 3.43Å; L205-L218 PolarHBondContact O-N 3.18Å; L205-F220 HydrophobicContact CB-CD1 4.44Å; L205-F220 HydrophobicContact CB-CE1 4.08Å
206	I	95.4	Very high	83.1	Confident	29 Å²	29	62.6 Å²	62.6	15%	0.149	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	123.7	179.8	-51.2	-56.1	0	0	0	108.1	M164 G165 A167 S217	M164-I206 HydrophobicContact CB-CB 4.29Å; M164-I206 HydrophobicContact CB-CG2 4.04Å; M164-I206 WeakPolarHBondContact CB-O 3.18Å; M164-I206 HydrophobicContact CE-CG2 4.05Å; M164-I206 PolarHBondContact N-O 3.03Å; M164-I206 HydrophobicContact SD-CG2 4.17Å; G165-I206 PolarHBondContact N-O 2.84Å; G165-I206 PolarHBondContact O-N 2.67Å; A167-I206 HydrophobicContact CB-CD1 3.91Å; A167-I206 HydrophobicContact CB-CG1 4.04Å; I206-S217 VanDerWaalsContact CD1-OG 3.29Å; I206-S217 WeakPolarHBondContact CD1-OG 3.31Å
207	C	95.9	Very high	85.4	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.007	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	146.3	-178.1	-46.6	0	0	0	0	110.9	L161 T162 S215 I216	L161-C207 HydrophobicContact CB-CB 4.16Å; T162-C207 CarbonylContact O-C 3.59Å; T162-C207 VanDerWaalsContact O-CA 3.22Å; T162-C207 WeakPolarHBondContact O-CA 3.33Å; C207-S215 CarbonylContact O-C 3.57Å; C207-S215 WeakPolarHBondContact O-CA 3.3Å; C207-I216 HydrophobicContact CB-CD1 4.26Å; C207-I216 HydrophobicContact CB-CG1 3.85Å; C207-I216 PolarHBondContact N-O 3.28Å; C207-I216 WeakPolarHBondContact O-CG1 3.37Å; C207-I216 PolarHBondContact O-N 3.16Å
208	M	96.6	Very high	87.5	Confident	56 Å²	56	49.6 Å²	49.6	28%	0.276	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	120	164.5	-177.5	58.3	63.3	0	0	109.1	L161 T162 M164 E214	L161-M208 WeakPolarHBondContact CA-O 3.48Å; T162-M208 PolarHBondContact N-O 2.81Å; T162-M208 PolarHBondContact O-N 3.01Å; M164-M208 HydrophobicContact SD-CB 3.87Å; M164-M208 HydrophobicContact SD-CE 4.29Å; M208-E214 VanDerWaalsContact SD-C 3.59Å
209	N	95.7	Very high	89.4	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.011	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	112.2	172	-174.2	-27	0	0	0	109.6	D159 L161 R211 T212 N213 E214 I216	D159-N209 PolarHBondContact OD2-ND2 3.2Å; L161-N209 HydrophobicContact CD2-CB 3.71Å; N209-R211 VanDerWaalsContact C-N 3.28Å; N209-R211 PolarHBondContact O-N 2.9Å; N209-R211 WeakPolarHBondContact OD1-CB 3.5Å; N209-R211 PolarHBondContact OD1-N 3.14Å; N209-T212 PolarHBondContact O-N 3.41Å; N209-N213 VanDerWaalsContact O-CA 3.25Å; N209-N213 WeakPolarHBondContact O-CA 3.29Å; N209-N213 PolarHBondContact O-N 3.08Å; N209-E214 PolarHBondContact N-O 3.48Å; N209-E214 PolarHBondContact O-N 2.73Å; N209-I216 HydrophobicContact CB-CD1 4.38Å
210	H	93.8	Very high	91	Very high	76 Å²	76	43.5 Å²	43.5	35%	0.352	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-15.1	-176.6	-69.7	-93	0	0	0	114.3	E160 T162	E160-H210 HydrophobicContact CB-CB 4.31Å; E160-H210 PolarHBondContact O-CD2 2.88Å; E160-H210 PolarHBondContact O-N 3.09Å; E160-H210 IonicContact OE1-CD2 3.16Å; E160-H210 IonicContact OE1-NE2 2.68Å; T162-H210 PolarHBondContact OG1-NE2 3.31Å
211	R	92.2	Very high	92	Very high	130 Å²	130	48.9 Å²	48.9	49%	0.491	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-37.6	174.1	-178.1	175.9	55.7	76.7	7.2	112	S156 D159 N209	S156-R211 PolarHBondContact OG-NH2 2.98Å; D159-R211 IonicContact OD1-CZ 3.83Å; D159-R211 IonicContact OD1-NE 2.74Å; D159-R211 PolarHBondContact OD1-NE 2.92Å; D159-R211 IonicContact OD1-NH2 3.17Å; D159-R211 PolarHBondContact OD1-NH2 3.14Å; D159-R211 VanDerWaalsContact OD1-NH2 3.16Å; D159-R211 IonicContact OD2-CZ 3.77Å; D159-R211 IonicContact OD2-NE 2.74Å; D159-R211 IonicContact OD2-NH2 2.64Å; D159-R211 PolarHBondContact OD2-NH2 3.39Å; N209-R211 VanDerWaalsContact C-N 3.28Å; N209-R211 PolarHBondContact O-N 2.9Å; N209-R211 WeakPolarHBondContact OD1-CB 3.5Å; N209-R211 PolarHBondContact OD1-N 3.14Å
212	T	92.7	Very high	92.4	Very high	49 Å²	49	42.7 Å²	42.7	30%	0.301	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	-16.9	179.1	67.2	0	0	0	0	113.5	N209 E214	N209-T212 PolarHBondContact O-N 3.41Å; T212-E214 VanDerWaalsContact C-N 3.29Å; T212-E214 WeakPolarHBondContact CB-OE2 3.46Å; T212-E214 WeakPolarHBondContact OG1-CB 3.43Å; T212-E214 PolarHBondContact OG1-N 3.49Å; T212-E214 PolarHBondContact OG1-OE2 3.36Å
213	N	94.5	Very high	92.7	Very high	122 Å²	122	51 Å²	51	65%	0.652	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	35	-168.7	-63	-70.5	0	0	0	113.4	N209	N209-N213 VanDerWaalsContact O-CA 3.25Å; N209-N213 WeakPolarHBondContact O-CA 3.29Å; N209-N213 PolarHBondContact O-N 3.08Å
214	E	92.9	Very high	92.7	Very high	117 Å²	117	48.7 Å²	48.7	55%	0.547	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	144	-178.9	-62	170.4	131	0	0	112.4	M208 N209 T212 I216	M208-E214 VanDerWaalsContact SD-C 3.59Å; N209-E214 PolarHBondContact N-O 3.48Å; N209-E214 PolarHBondContact O-N 2.73Å; T212-E214 VanDerWaalsContact C-N 3.29Å; T212-E214 WeakPolarHBondContact CB-OE2 3.46Å; T212-E214 WeakPolarHBondContact OG1-CB 3.43Å; T212-E214 PolarHBondContact OG1-N 3.49Å; T212-E214 PolarHBondContact OG1-OE2 3.36Å; E214-I216 PolarHBondContact O-N 3.16Å
215	S	92.6	Very high	92.8	Very high	66 Å²	66	54 Å²	54	46%	0.462	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	104.2	171.2	172.5	0	0	0	0	110.3	C207	C207-S215 CarbonylContact O-C 3.57Å; C207-S215 WeakPolarHBondContact O-CA 3.3Å
216	I	92.7	Very high	92.9	Very high	16 Å²	16	54 Å²	54	8%	0.082	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	147	178.5	60.6	172.4	0	0	0	111.7	L155 L161 C207 N209 E214 L218	L155-I216 HydrophobicContact CD2-CD1 3.64Å; L161-I216 HydrophobicContact CD1-CD1 4.26Å; L161-I216 HydrophobicContact CD2-CD1 3.71Å; C207-I216 HydrophobicContact CB-CD1 4.26Å; C207-I216 HydrophobicContact CB-CG1 3.85Å; C207-I216 PolarHBondContact N-O 3.28Å; C207-I216 WeakPolarHBondContact O-CG1 3.37Å; C207-I216 PolarHBondContact O-N 3.16Å; N209-I216 HydrophobicContact CB-CD1 4.38Å; E214-I216 PolarHBondContact O-N 3.16Å; I216-L218 HydrophobicContact CD1-CD1 3.84Å; I216-L218 HydrophobicContact CD1-CD2 4.02Å; I216-L218 HydrophobicContact CD1-CG 3.8Å; I216-L218 HydrophobicContact CG1-CG 4.22Å
217	S	91.9	Very high	92.8	Very high	22 Å²	22	52.6 Å²	52.6	15%	0.154	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	85.6	177.7	-64.8	0	0	0	0	110.6	Y151 I206 P219	Y151-S217 PolarHBondContact OH-N 3.17Å; I206-S217 VanDerWaalsContact CD1-OG 3.29Å; I206-S217 WeakPolarHBondContact CD1-OG 3.31Å; S217-P219 VanDerWaalsContact O-CD 3.24Å; S217-P219 WeakPolarHBondContact O-CD 3.21Å
218	L	93	Very high	92.5	Very high	2 Å²	2	53.6 Å²	53.6	1%	0.01	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	115.6	-174.4	-68.9	176.6	0	0	0	111.7	V116 I153 L155 L161 C204 L205 I216	V116-L218 HydrophobicContact CG1-CB 3.81Å; V116-L218 WeakPolarHBondContact CG1-O 3.49Å; V116-L218 HydrophobicContact CG2-CB 4.08Å; V116-L218 HydrophobicContact CG2-CD1 4.32Å; I153-L218 HydrophobicContact CD1-CD2 3.99Å; I153-L218 HydrophobicContact CG2-CD2 3.86Å; L155-L218 HydrophobicContact CD1-CD1 4.16Å; L155-L218 HydrophobicContact CD1-CD2 3.92Å; L161-L218 HydrophobicContact CD1-CD1 3.77Å; C204-L218 CarbonylContact C-O 3.56Å; C204-L218 VanDerWaalsContact CA-O 3.22Å; C204-L218 WeakPolarHBondContact CA-O 3.28Å; L205-L218 PolarHBondContact N-O 3.43Å; L205-L218 PolarHBondContact O-N 3.18Å; I216-L218 HydrophobicContact CD1-CD1 3.84Å; I216-L218 HydrophobicContact CD1-CD2 4.02Å; I216-L218 HydrophobicContact CD1-CG 3.8Å; I216-L218 HydrophobicContact CG1-CG 4.22Å
219	P	90.8	Very high	92	Very high	1 Å²	1	51 Å²	51	1%	0.006	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	144.5	178.6	-23.9	39.3	0	0	0	111.6	F135 M202 S217 Q221 C222	F135-P219 HydrophobicContact CD1-CG 4.3Å; F135-P219 HydrophobicContact CE1-CB 4.16Å; F135-P219 HydrophobicContact CE1-CG 3.63Å; F135-P219 HydrophobicContact CZ-CB 4.2Å; F135-P219 HydrophobicContact CZ-CG 4.18Å; M202-P219 HydrophobicContact CE-CB 3.66Å; M202-P219 HydrophobicContact CE-CG 3.51Å; M202-P219 HydrophobicContact CG-CB 4.02Å; M202-P219 HydrophobicContact SD-CB 3.66Å; M202-P219 HydrophobicContact SD-CG 4.18Å; S217-P219 VanDerWaalsContact O-CD 3.24Å; S217-P219 WeakPolarHBondContact O-CD 3.21Å; P219-Q221 PolarHBondContact O-N 3.23Å; P219-Q221 VanDerWaalsContact O-N 3.08Å; P219-C222 WeakPolarHBondContact O-CB 3.41Å; P219-C222 PolarHBondContact O-N 3.33Å
220	F	91.6	Very high	91.6	Very high	30 Å²	30	51.6 Å²	51.6	13%	0.132	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-25	179.8	-73.8	19.4	0	0	0	112.6	V116 E117 A120 Q166 P203 L205 C222	V116-F220 HydrophobicContact CG1-CD1 4.29Å; E117-F220 HydrophobicContact CB-CB 4.06Å; E117-F220 HydrophobicContact CB-CD2 4.32Å; E117-F220 HydrophobicContact CB-CG 4.38Å; E117-F220 HydrophobicContact CG-CD2 4.05Å; A120-F220 HydrophobicContact CB-CD1 4.2Å; A120-F220 HydrophobicContact CB-CE1 3.55Å; A120-F220 HydrophobicContact CB-CE2 4.01Å; A120-F220 HydrophobicContact CB-CZ 3.46Å; A120-F220 VanDerWaalsContact CB-CZ 3.46Å; Q166-F220 HydrophobicContact CG-CZ 4.22Å; P203-F220 HydrophobicContact CB-CD1 4.19Å; P203-F220 HydrophobicContact CB-CD2 3.84Å; P203-F220 HydrophobicContact CB-CE1 4.22Å; P203-F220 HydrophobicContact CB-CE2 3.88Å; P203-F220 HydrophobicContact CB-CG 3.99Å; P203-F220 HydrophobicContact CB-CZ 4.06Å; P203-F220 HydrophobicContact CG-CB 4.14Å; P203-F220 HydrophobicContact CG-CD2 3.78Å; P203-F220 HydrophobicContact CG-CE2 4.28Å; P203-F220 HydrophobicContact CG-CG 3.93Å; P203-F220 WeakPolarHBondContact O-CD1 3.46Å; P203-F220 PolarHBondContact O-N 2.9Å; L205-F220 HydrophobicContact CB-CD1 4.44Å; L205-F220 HydrophobicContact CB-CE1 4.08Å; F220-C222 PolarHBondContact O-N 3.39Å
221	Q	86.8	Confident	91.3	Very high	117 Å²	117	48.8 Å²	48.8	55%	0.547	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-8.9	174.7	-62.1	175.5	30.6	0	0	113.4	P219 K223	P219-Q221 PolarHBondContact O-N 3.23Å; P219-Q221 VanDerWaalsContact O-N 3.08Å; Q221-K223 PolarHBondContact O-N 3.12Å
222	C	88.3	Confident	91	Very high	1 Å²	1	46 Å²	46	1%	0.007	23%	0.233	C	C	.	.			trans	-70.9	123.3	173.2	-172.7	0	0	0	0	109.7	V116 F135 P219 F220	V116-C222 HydrophobicContact CB-CB 4.43Å; V116-C222 HydrophobicContact CG2-CB 3.82Å; V116-C222 PolarHBondContact N-O 3.3Å; V116-C222 VanDerWaalsContact N-O 3.14Å; F135-C222 HydrophobicContact CD2-CB 3.79Å; F135-C222 HydrophobicContact CE2-CB 4.06Å; F135-C222 HydrophobicContact CG-CB 4.1Å; P219-C222 WeakPolarHBondContact O-CB 3.41Å; P219-C222 PolarHBondContact O-N 3.33Å; F220-C222 PolarHBondContact O-N 3.39Å
223	K	90.6	Very high	90.6	Very high	177 Å²	177	44.2 Å²	44.2	77%	0.77	22%	0.221	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	147.1	174.8	-66.6	-168.2	175.3	-166	0	109.9	Q221	Q221-K223 PolarHBondContact O-N 3.12Å
224	G	91.3	Very high	90	Very high	5 Å²	5	39.4 Å²	39.4	5%	0.052	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.9	154.5	175.9	0	0	0	0	0	109.8	N114 S115 E131 F226	N114-G224 CarbonylContact C-O 3.58Å; N114-G224 PolarHBondContact O-N 3.09Å; S115-G224 PolarHBondContact N-O 3.19Å; E131-G224 WeakPolarHBondContact OE1-CA 3.35Å; G224-F226 WeakPolarHBondContact O-CD2 3.44Å; G224-F226 WeakPolarHBondContact O-CE2 3.37Å
225	R	95.4	Very high	89.6	Confident	112 Å²	112	40.3 Å²	40.3	42%	0.423	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	132	177.3	-68.3	-177.1	-62.6	120.4	14.6	111.4	F113 M130 E131	F113-R225 CarbonylContact O-C 3.49Å; F113-R225 VanDerWaalsContact O-CA 3.3Å; F113-R225 WeakPolarHBondContact O-CA 3.33Å; M130-R225 HydrophobicContact CB-CB 3.79Å; M130-R225 WeakPolarHBondContact CB-O 3.42Å; M130-R225 PolarHBondContact N-O 3.19Å; M130-R225 PolarHBondContact O-NH2 3.33Å; E131-R225 HydrophobicContact CG-CB 4.35Å; E131-R225 PolarHBondContact OE1-N 3.31Å; E131-R225 IonicContact OE1-NE 2.87Å; E131-R225 IonicContact OE2-CZ 2.93Å; E131-R225 IonicContact OE2-NE 3.23Å; E131-R225 PolarHBondContact OE2-NE 2.91Å; E131-R225 IonicContact OE2-NH2 2.97Å; E131-R225 PolarHBondContact OE2-NH2 3.05Å
226	F	95.7	Very high	89.3	Confident	3 Å²	3	37.5 Å²	37.5	1%	0.013	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	159.1	175.2	-53.9	-93.9	0	0	0	110.3	Y112 F113 V116 V119 V127 Y128 V129 I133 L155 L161 G224	Y112-F226 WeakPolarHBondContact CA-O 3.4Å; F113-F226 HydrophobicContact CB-CB 4.31Å; F113-F226 HydrophobicContact CD2-CB 4.21Å; F113-F226 PolarHBondContact N-O 3.2Å; F113-F226 PolarHBondContact O-N 3.25Å; V116-F226 HydrophobicContact CG2-CE2 3.78Å; V116-F226 HydrophobicContact CG2-CZ 3.66Å; V119-F226 HydrophobicContact CG2-CB 3.88Å; V119-F226 HydrophobicContact CG2-CD2 3.8Å; V119-F226 HydrophobicContact CG2-CG 3.87Å; V127-F226 HydrophobicContact CB-CB 4.21Å; V127-F226 HydrophobicContact CG2-CB 4.27Å; V127-F226 HydrophobicContact CG2-CD1 4Å; V127-F226 HydrophobicContact CG2-CG 4.46Å; Y128-F226 CarbonylContact O-C 3.47Å; Y128-F226 VanDerWaalsContact O-CA 3.25Å; Y128-F226 WeakPolarHBondContact O-CA 3.49Å; V129-F226 HydrophobicContact CG2-CD1 4.02Å; V129-F226 HydrophobicContact CG2-CE1 3.9Å; I133-F226 HydrophobicContact CD1-CE1 3.84Å; I133-F226 HydrophobicContact CD1-CE2 4.09Å; I133-F226 HydrophobicContact CD1-CZ 3.51Å; L155-F226 HydrophobicContact CD1-CE1 4.33Å; L161-F226 HydrophobicContact CD1-CD1 4.4Å; L161-F226 HydrophobicContact CD1-CE1 3.99Å; G224-F226 WeakPolarHBondContact O-CD2 3.44Å; G224-F226 WeakPolarHBondContact O-CE2 3.37Å
227	S	93.2	Very high	88.8	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	146.8	-177.7	172	0	0	0	0	111.8	Q111 V127 Y128 M130 C229	Q111-S227 CarbonylContact O-C 3.21Å; Q111-S227 VanDerWaalsContact O-CA 3.29Å; Q111-S227 WeakPolarHBondContact O-CA 3.41Å; V127-S227 CarbonylContact C-O 3.53Å; V127-S227 VanDerWaalsContact CA-O 3.31Å; V127-S227 WeakPolarHBondContact CA-O 3.28Å; Y128-S227 PolarHBondContact N-O 3.13Å; Y128-S227 PolarHBondContact O-N 3.21Å; M130-S227 WeakPolarHBondContact SD-CB 3.48Å; S227-C229 WeakPolarHBondContact CB-O 3.44Å; S227-C229 PolarHBondContact O-N 2.85Å; S227-C229 PolarHBondContact OG-N 2.96Å; S227-C229 PolarHBondContact OG-O 2.76Å
228	T	90.1	Very high	88.4	Confident	22 Å²	22	45.6 Å²	45.6	14%	0.135	21%	0.208	C	C	.	.	S	Bend	trans	-76.8	-5.1	168.8	57.7	0	0	0	0	113.6	Q111 F113 P124	Q111-T228 HydrophobicContact CB-CG2 4.11Å; Q111-T228 PolarHBondContact N-OG1 3.31Å; Q111-T228 PolarHBondContact O-N 3.21Å; F113-T228 HydrophobicContact CE2-CG2 4.04Å; F113-T228 HydrophobicContact CZ-CG2 4.36Å; P124-T228 HydrophobicContact CB-CG2 3.83Å; P124-T228 HydrophobicContact CG-CG2 4.01Å
229	C	86.8	Confident	88.2	Confident	1 Å²	1	46.7 Å²	46.7	1%	0.007	22%	0.219	C	C	.	.	S	Bend	trans	-117.8	142.4	174.4	-175.1	0	0	0	0	110.5	V110 S227 E233 L234	V110-C229 HydrophobicContact CB-CB 4.31Å; V110-C229 HydrophobicContact CG1-CB 3.5Å; V110-C229 HydrophobicContact CG2-CB 3.8Å; S227-C229 WeakPolarHBondContact CB-O 3.44Å; S227-C229 PolarHBondContact O-N 2.85Å; S227-C229 PolarHBondContact OG-N 2.96Å; S227-C229 PolarHBondContact OG-O 2.76Å; C229-E233 VanDerWaalsContact SG-CG 3.56Å; C229-L234 HydrophobicContact CB-CD1 4.47Å; C229-L234 HydrophobicContact CB-CD2 4.22Å; C229-L234 HydrophobicContact CB-CG 4.26Å
230	S	87.5	Confident	88.4	Confident	15 Å²	15	52 Å²	52	11%	0.105	24%	0.244	C	C	.	.			trans	-73.2	151.2	-175	78.5	0	0	0	0	112.6	L232 E233 L234	S230-L232 PolarHBondContact O-N 3.04Å; S230-L232 VanDerWaalsContact O-N 3.13Å; S230-E233 PolarHBondContact O-N 3.28Å; S230-E233 VanDerWaalsContact OG-CB 3.25Å; S230-E233 WeakPolarHBondContact OG-CB 3.38Å; S230-E233 PolarHBondContact OG-N 3.21Å; S230-L234 WeakPolarHBondContact O-CG 3.39Å; S230-L234 PolarHBondContact O-N 3.36Å; S230-L234 VanDerWaalsContact O-N 3.08Å
231	P	86.4	Confident	88.5	Confident	17 Å²	17	52 Å²	52	11%	0.11	24%	0.244	C	C	.	.	H	α-helix	trans	-54.6	-31.9	174.2	-22.8	28.5	0	0	0	113.5	M130 T157 Q235	M130-P231 HydrophobicContact CE-CB 4.39Å; M130-P231 HydrophobicContact CE-CG 4.32Å; M130-P231 HydrophobicContact SD-CB 4.36Å; M130-P231 HydrophobicContact SD-CG 3.68Å; T157-P231 HydrophobicContact CG2-CB 4.47Å; T157-P231 HydrophobicContact CG2-CG 4.16Å; P231-Q235 VanDerWaalsContact O-CG 3.27Å; P231-Q235 WeakPolarHBondContact O-CG 3.47Å; P231-Q235 PolarHBondContact O-N 3.34Å; P231-Q235 VanDerWaalsContact O-N 3.11Å
232	L	85.4	Confident	88.9	Confident	72 Å²	72	48.5 Å²	48.5	38%	0.377	23%	0.231	S	C	.	.	H	α-helix	trans	-76.9	-42.9	-178.3	-173.7	60.2	0	0	0	112	S230 L234 Q235 M236 K249	S230-L232 PolarHBondContact O-N 3.04Å; S230-L232 VanDerWaalsContact O-N 3.13Å; L232-L234 VanDerWaalsContact C-N 3.31Å; L232-L234 PolarHBondContact O-N 2.99Å; L232-Q235 PolarHBondContact O-N 2.96Å; L232-M236 WeakPolarHBondContact O-CG 3.42Å; L232-M236 PolarHBondContact O-N 2.92Å; L232-M236 VanDerWaalsContact O-N 3.08Å; L232-K249 HydrophobicContact CD1-CD 4.37Å; L232-K249 HydrophobicContact CD2-CB 3.78Å; L232-K249 HydrophobicContact CD2-CD 3.94Å; L232-K249 HydrophobicContact CD2-CG 3.72Å; L232-K249 HydrophobicContact CG-CB 4.12Å; L232-K249 HydrophobicContact CG-CD 4.23Å; L232-K249 HydrophobicContact CG-CG 4.36Å
233	E	84.4	Confident	89.2	Confident	11 Å²	11	48.5 Å²	48.5	5%	0.051	23%	0.231	C	C	.	.	H	α-helix	trans	-60.8	-41.2	174.4	-175.4	179.5	160.4	0	0	111	L99 R104 C229 S230 M236 T250	L99-E233 HydrophobicContact CD2-CG 4.34Å; R104-E233 IonicContact CZ-OE1 3.28Å; R104-E233 IonicContact NE-OE1 2.73Å; R104-E233 IonicContact NH2-OE1 2.75Å; R104-E233 PolarHBondContact NH2-OE1 3.23Å; R104-E233 IonicContact NH2-OE2 3.63Å; R104-E233 PolarHBondContact NH2-OE2 3.09Å; C229-E233 VanDerWaalsContact SG-CG 3.56Å; S230-E233 PolarHBondContact O-N 3.28Å; S230-E233 VanDerWaalsContact OG-CB 3.25Å; S230-E233 WeakPolarHBondContact OG-CB 3.38Å; S230-E233 PolarHBondContact OG-N 3.21Å; E233-M236 PolarHBondContact O-N 2.89Å; E233-T250 HydrophobicContact CB-CG2 4.46Å; E233-T250 HydrophobicContact CG-CG2 4.12Å
234	L	83.2	Confident	89.4	Confident	20 Å²	20	45.1 Å²	45.1	11%	0.105	21%	0.214	C	C	.	.	H	α-helix	trans	-65	-40.9	174	-66.7	169.7	0	0	0	112.8	Y112 M130 C229 S230 L232 M236 Q237 Y238	Y112-L234 HydrophobicContact CE1-CD1 3.96Å; Y112-L234 WeakPolarHBondContact OH-CD2 3.47Å; M130-L234 HydrophobicContact CE-CD1 3.69Å; M130-L234 HydrophobicContact SD-CD1 4.39Å; C229-L234 HydrophobicContact CB-CD1 4.47Å; C229-L234 HydrophobicContact CB-CD2 4.22Å; C229-L234 HydrophobicContact CB-CG 4.26Å; S230-L234 WeakPolarHBondContact O-CG 3.39Å; S230-L234 PolarHBondContact O-N 3.36Å; S230-L234 VanDerWaalsContact O-N 3.08Å; L232-L234 VanDerWaalsContact C-N 3.31Å; L232-L234 PolarHBondContact O-N 2.99Å; L234-M236 PolarHBondContact O-N 2.61Å; L234-Q237 PolarHBondContact O-N 3.13Å; L234-Q237 PolarHBondContact O-OE1 3.26Å; L234-Y238 WeakPolarHBondContact O-CE2 3.25Å
235	Q	83.8	Confident	89.5	Confident	136 Å²	136	46.5 Å²	46.5	64%	0.636	22%	0.22	S	C	*	.	H	α-helix	trans	-62.6	-30	173.9	-77.1	171.8	10.8	0	0	112.5	P231 L232	P231-Q235 VanDerWaalsContact O-CG 3.27Å; P231-Q235 WeakPolarHBondContact O-CG 3.47Å; P231-Q235 PolarHBondContact O-N 3.34Å; P231-Q235 VanDerWaalsContact O-N 3.11Å; L232-Q235 PolarHBondContact O-N 2.96Å
236	M	85.8	Confident	89.4	Confident	7 Å²	7	41.2 Å²	41.2	3%	0.034	20%	0.2	C	C	.	.	H	α-helix	trans	-74.4	-23	-178	-73.4	179.2	64.5	0	0	114.2	L99 L232 E233 L234 Y238 G239 H241 N245 I246 K249 T250	L99-M236 HydrophobicContact CD1-CB 4.46Å; L99-M236 HydrophobicContact CD1-CE 4.35Å; L99-M236 HydrophobicContact CD2-CB 4.19Å; L232-M236 WeakPolarHBondContact O-CG 3.42Å; L232-M236 PolarHBondContact O-N 2.92Å; L232-M236 VanDerWaalsContact O-N 3.08Å; E233-M236 PolarHBondContact O-N 2.89Å; L234-M236 PolarHBondContact O-N 2.61Å; M236-Y238 PolarHBondContact O-N 2.83Å; M236-Y238 VanDerWaalsContact O-N 3.11Å; M236-G239 PolarHBondContact O-N 2.82Å; M236-H241 HydrophobicContact CE-CB 4.09Å; M236-H241 PolarHBondContact O-NE2 3.47Å; M236-N245 WeakPolarHBondContact CE-O 3.46Å; M236-I246 HydrophobicContact CE-CG1 4.03Å; M236-K249 HydrophobicContact CE-CB 4.37Å; M236-K249 HydrophobicContact SD-CB 3.44Å; M236-K249 WeakPolarHBondContact SD-CB 3.33Å; M236-K249 HydrophobicContact SD-CD 3.69Å; M236-K249 HydrophobicContact SD-CG 4.19Å; M236-T250 HydrophobicContact CE-CG2 4.05Å; M236-T250 HydrophobicContact SD-CG2 3.91Å
237	Q	83.6	Confident	89.1	Confident	29 Å²	29	42.9 Å²	42.9	14%	0.136	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-27.9	178.9	-66.5	172.6	-41.3	0	0	113.5	K98 L99 L234	K98-Q237 WeakPolarHBondContact CE-O 3.45Å; L99-Q237 HydrophobicContact CB-CG 4.37Å; L99-Q237 HydrophobicContact CD2-CG 4.43Å; L234-Q237 PolarHBondContact O-N 3.13Å; L234-Q237 PolarHBondContact O-OE1 3.26Å
238	Y	83.1	Confident	89	Confident	180 Å²	180	48.8 Å²	48.8	71%	0.706	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-10	-178.7	-61.1	-87.6	0	0	0	114.2	L234 M236	L234-Y238 WeakPolarHBondContact O-CE2 3.25Å; M236-Y238 PolarHBondContact O-N 2.83Å; M236-Y238 VanDerWaalsContact O-N 3.11Å
239	G	89.6	Confident	88.8	Confident	25 Å²	25	51.5 Å²	51.5	26%	0.258	25%	0.247	S	C	.	.	S	Bend	trans	-125.6	171.3	-171.6	0	0	0	0	0	114.7	M236 H241	M236-G239 PolarHBondContact O-N 2.82Å; G239-H241 VanDerWaalsContact C-NE2 3.33Å; G239-H241 PolarHBondContact O-CD2 2.89Å; G239-H241 VanDerWaalsContact O-CD2 3.26Å; G239-H241 PolarHBondContact O-NE2 3.35Å
240	E	94.4	Very high	88.7	Confident	113 Å²	113	52 Å²	52	53%	0.528	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	139.5	171	-62.6	-178.2	-161.4	0	0	109.7	Q96 P259	Q96-E240 HydrophobicContact CB-CB 4.19Å; E240-P259 VanDerWaalsContact CD-CG 3.44Å; E240-P259 HydrophobicContact CG-CB 4.14Å; E240-P259 HydrophobicContact CG-CG 3.84Å; E240-P259 WeakPolarHBondContact OE2-CG 3.4Å
241	H	94.4	Very high	88.4	Confident	28 Å²	28	56.2 Å²	56.2	13%	0.13	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	148.8	-169.6	-53.2	-79.6	0	0	0	111.7	F97 M236 G239 N245 I246	F97-H241 PolarHBondContact N-O 3.48Å; F97-H241 PolarHBondContact O-N 2.67Å; M236-H241 HydrophobicContact CE-CB 4.09Å; M236-H241 PolarHBondContact O-NE2 3.47Å; G239-H241 VanDerWaalsContact C-NE2 3.33Å; G239-H241 PolarHBondContact O-CD2 2.89Å; G239-H241 VanDerWaalsContact O-CD2 3.26Å; G239-H241 PolarHBondContact O-NE2 3.35Å; H241-N245 HydrophobicContact CB-CB 4.34Å; H241-N245 PolarHBondContact ND1-ND2 3.32Å; H241-I246 HydrophobicContact CB-CD1 4.16Å; H241-I246 HydrophobicContact CB-CG1 3.73Å
242	T	95.1	Very high	88.3	Confident	45 Å²	45	57.5 Å²	57.5	28%	0.276	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	153.4	168.2	57.2	0	0	0	0	111.2	R244 N245 I246	T242-R244 PolarHBondContact O-N 2.71Å; T242-N245 PolarHBondContact O-N 3.07Å; T242-N245 PolarHBondContact OG1-N 3.05Å; T242-I246 PolarHBondContact O-N 3.07Å; T242-I246 VanDerWaalsContact O-N 3.1Å
243	I	94.6	Very high	88.4	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-39.2	-44.5	168.5	-71.3	-69.7	0	0	0	112.4	I71 I89 V91 Y93 F97 V247	I71-I243 HydrophobicContact CD1-CB 4.48Å; I71-I243 HydrophobicContact CD1-CD1 4.31Å; I71-I243 HydrophobicContact CD1-CG2 3.49Å; I71-I243 VanDerWaalsContact CD1-CG2 3.49Å; I71-I243 HydrophobicContact CG1-CG2 3.85Å; I89-I243 HydrophobicContact CB-CD1 4.32Å; I89-I243 HydrophobicContact CD1-CD1 4.07Å; I89-I243 HydrophobicContact CG2-CD1 3.85Å; I89-I243 HydrophobicContact CG2-CG1 3.79Å; V91-I243 HydrophobicContact CB-CG2 4.33Å; V91-I243 HydrophobicContact CG1-CG2 4.15Å; Y93-I243 HydrophobicContact CD1-CG1 4.43Å; F97-I243 HydrophobicContact CD1-CD1 4.42Å; F97-I243 HydrophobicContact CD2-CD1 3.76Å; F97-I243 HydrophobicContact CD2-CG1 3.75Å; F97-I243 HydrophobicContact CE1-CD1 4.19Å; F97-I243 HydrophobicContact CE2-CD1 3.55Å; F97-I243 HydrophobicContact CE2-CG1 3.43Å; F97-I243 VanDerWaalsContact CE2-CG1 3.43Å; F97-I243 HydrophobicContact CG-CD1 4.22Å; F97-I243 HydrophobicContact CZ-CD1 3.76Å; F97-I243 HydrophobicContact CZ-CG1 4.06Å; I243-V247 PolarHBondContact O-N 3.46Å
244	R	94.6	Very high	88.5	Confident	107 Å²	107	57.2 Å²	57.2	40%	0.404	27%	0.273	S	S	.	.	H	α-helix	trans	-63.2	-51.8	178.1	-162.4	-165.6	-63.7	-163.4	-0.2	112.7	V91 H92 T242 I246 V247 E248	V91-R244 WeakPolarHBondContact O-CB 3.25Å; V91-R244 PolarHBondContact O-NE 2.95Å; H92-R244 PolarHBondContact CE1-NH2 3.21Å; H92-R244 VanDerWaalsContact CE1-NH2 3.29Å; H92-R244 PolarHBondContact ND1-NH2 3.49Å; H92-R244 VanDerWaalsContact ND1-NH2 3.11Å; T242-R244 PolarHBondContact O-N 2.71Å; R244-I246 PolarHBondContact O-N 3.32Å; R244-V247 PolarHBondContact O-N 3.17Å; R244-V247 VanDerWaalsContact O-N 3.16Å; R244-E248 WeakPolarHBondContact CD-OE1 3.35Å; R244-E248 HydrophobicContact CG-CG 4.35Å; R244-E248 VanDerWaalsContact CG-OE1 3.28Å; R244-E248 WeakPolarHBondContact CG-OE1 3.46Å; R244-E248 WeakPolarHBondContact O-CG 3.38Å; R244-E248 PolarHBondContact O-N 3.07Å
245	N	93.4	Very high	88.7	Confident	34 Å²	34	57.1 Å²	57.1	18%	0.182	27%	0.273	C	S	.	.	H	α-helix	trans	-64.7	-28.8	-176.1	-173.5	64.8	0	0	0	111.8	M236 H241 T242 K249	M236-N245 WeakPolarHBondContact CE-O 3.46Å; H241-N245 HydrophobicContact CB-CB 4.34Å; H241-N245 PolarHBondContact ND1-ND2 3.32Å; T242-N245 PolarHBondContact O-N 3.07Å; T242-N245 PolarHBondContact OG1-N 3.05Å; N245-K249 WeakPolarHBondContact O-CB 3.43Å; N245-K249 WeakPolarHBondContact O-CG 3.42Å; N245-K249 VanDerWaalsContact OD1-CE 3.26Å; N245-K249 WeakPolarHBondContact OD1-CE 3.38Å; N245-K249 PolarHBondContact OD1-NZ 2.94Å
246	I	92.6	Very high	89.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-68.5	-51.2	171.9	-62.9	178.5	0	0	0	110.7	F97 L99 M236 H241 T242 R244 E248 K249 T250 V254 V256 L280	F97-I246 HydrophobicContact CB-CD1 3.73Å; L99-I246 HydrophobicContact CD1-CD1 3.84Å; L99-I246 HydrophobicContact CD1-CG1 3.87Å; L99-I246 HydrophobicContact CD1-CG2 4.3Å; M236-I246 HydrophobicContact CE-CG1 4.03Å; H241-I246 HydrophobicContact CB-CD1 4.16Å; H241-I246 HydrophobicContact CB-CG1 3.73Å; T242-I246 PolarHBondContact O-N 3.07Å; T242-I246 VanDerWaalsContact O-N 3.1Å; R244-I246 PolarHBondContact O-N 3.32Å; I246-E248 VanDerWaalsContact C-N 3.34Å; I246-E248 PolarHBondContact O-N 2.83Å; I246-K249 PolarHBondContact O-N 3.12Å; I246-T250 HydrophobicContact CG2-CG2 4.25Å; I246-T250 VanDerWaalsContact CG2-OG1 3.31Å; I246-T250 WeakPolarHBondContact CG2-OG1 3.45Å; I246-T250 WeakPolarHBondContact O-CB 3.42Å; I246-T250 WeakPolarHBondContact O-CG2 3.2Å; I246-T250 PolarHBondContact O-N 2.81Å; I246-T250 PolarHBondContact O-OG1 3.45Å; I246-V254 HydrophobicContact CG2-CG2 3.99Å; I246-V256 HydrophobicContact CD1-CG1 3.98Å; I246-L280 HydrophobicContact CG2-CD1 4.16Å
247	V	90.4	Very high	89.4	Confident	38 Å²	38	51.6 Å²	51.6	23%	0.23	25%	0.249	C	C	.	.	H	α-helix	trans	-57.6	-43	176.6	154.9	0	0	0	0	113.1	I71 I243 R244 K249 I283	I71-V247 HydrophobicContact CD1-CG2 3.27Å; I71-V247 HydrophobicContact CG1-CG2 3.78Å; I243-V247 PolarHBondContact O-N 3.46Å; R244-V247 PolarHBondContact O-N 3.17Å; R244-V247 VanDerWaalsContact O-N 3.16Å; V247-K249 PolarHBondContact O-N 2.81Å; V247-K249 VanDerWaalsContact O-N 3.16Å; V247-I283 HydrophobicContact CB-CD1 4.33Å; V247-I283 HydrophobicContact CG1-CD1 3.4Å; V247-I283 VanDerWaalsContact CG1-CD1 3.4Å; V247-I283 HydrophobicContact CG2-CD1 3.99Å
248	E	90.1	Very high	89.9	Confident	125 Å²	125	50.2 Å²	50.2	58%	0.584	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-10.6	-175.7	-72.7	171.8	175	0	0	113.4	R244 I246	R244-E248 WeakPolarHBondContact CD-OE1 3.35Å; R244-E248 HydrophobicContact CG-CG 4.35Å; R244-E248 VanDerWaalsContact CG-OE1 3.28Å; R244-E248 WeakPolarHBondContact CG-OE1 3.46Å; R244-E248 WeakPolarHBondContact O-CG 3.38Å; R244-E248 PolarHBondContact O-N 3.07Å; I246-E248 VanDerWaalsContact C-N 3.34Å; I246-E248 PolarHBondContact O-N 2.83Å
249	K	86.6	Confident	90.3	Very high	78 Å²	78	43.8 Å²	43.8	34%	0.339	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-141	-9	-164.4	-62.3	-177.3	175.1	168.8	0	116.1	L232 M236 N245 I246 V247	L232-K249 HydrophobicContact CD1-CD 4.37Å; L232-K249 HydrophobicContact CD2-CB 3.78Å; L232-K249 HydrophobicContact CD2-CD 3.94Å; L232-K249 HydrophobicContact CD2-CG 3.72Å; L232-K249 HydrophobicContact CG-CB 4.12Å; L232-K249 HydrophobicContact CG-CD 4.23Å; L232-K249 HydrophobicContact CG-CG 4.36Å; M236-K249 HydrophobicContact CE-CB 4.37Å; M236-K249 HydrophobicContact SD-CB 3.44Å; M236-K249 WeakPolarHBondContact SD-CB 3.33Å; M236-K249 HydrophobicContact SD-CD 3.69Å; M236-K249 HydrophobicContact SD-CG 4.19Å; N245-K249 WeakPolarHBondContact O-CB 3.43Å; N245-K249 WeakPolarHBondContact O-CG 3.42Å; N245-K249 VanDerWaalsContact OD1-CE 3.26Å; N245-K249 WeakPolarHBondContact OD1-CE 3.38Å; N245-K249 PolarHBondContact OD1-NZ 2.94Å; I246-K249 PolarHBondContact O-N 3.12Å; V247-K249 PolarHBondContact O-N 2.81Å; V247-K249 VanDerWaalsContact O-N 3.16Å
250	T	83.9	Confident	90.3	Very high	12 Å²	12	44.1 Å²	44.1	7%	0.074	23%	0.226	C	C	.	.	S	Bend	trans	-130.7	153.4	-175.4	73.6	0	0	0	0	109.9	L99 E233 M236 I246	L99-T250 HydrophobicContact CD2-CG2 4.03Å; E233-T250 HydrophobicContact CB-CG2 4.46Å; E233-T250 HydrophobicContact CG-CG2 4.12Å; M236-T250 HydrophobicContact CE-CG2 4.05Å; M236-T250 HydrophobicContact SD-CG2 3.91Å; I246-T250 HydrophobicContact CG2-CG2 4.25Å; I246-T250 VanDerWaalsContact CG2-OG1 3.31Å; I246-T250 WeakPolarHBondContact CG2-OG1 3.45Å; I246-T250 WeakPolarHBondContact O-CB 3.42Å; I246-T250 WeakPolarHBondContact O-CG2 3.2Å; I246-T250 PolarHBondContact O-N 2.81Å; I246-T250 PolarHBondContact O-OG1 3.45Å
251	R	80.9	Confident	90.1	Very high	103 Å²	103	44 Å²	44	39%	0.389	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-95.9	118.1	177.4	-72.9	-171.5	165.4	-145.2	-1.6	110.8	Y128 E160 V254	Y128-R251 PolarHBondContact OH-NE 3.43Å; E160-R251 IonicContact OE1-CZ 3.34Å; E160-R251 IonicContact OE1-NH1 3.94Å; E160-R251 IonicContact OE1-NH2 3.06Å; E160-R251 PolarHBondContact OE1-NH2 3.38Å; E160-R251 IonicContact OE2-CZ 2.72Å; E160-R251 IonicContact OE2-NE 3.22Å; E160-R251 IonicContact OE2-NH2 3.9Å; E160-R251 PolarHBondContact OE2-NH2 3.45Å; R251-V254 WeakPolarHBondContact O-CG1 3.21Å
252	L	85.6	Confident	89.7	Confident	44 Å²	44	43.4 Å²	43.4	23%	0.23	23%	0.232	C	C	.	.	S	Bend	trans	-64	144.7	170.6	-54.4	-176	0	0	0	110.2	V254 L280 V281 I283	L252-V254 HydrophobicContact CD2-CG2 3.91Å; L252-L280 HydrophobicContact CD2-CB 3.91Å; L252-V281 WeakPolarHBondContact CB-O 3.5Å; L252-I283 HydrophobicContact CD1-CB 4.36Å; L252-I283 HydrophobicContact CD1-CG2 4.46Å
253	P	86.4	Confident	89.3	Confident	67 Å²	67	44.1 Å²	44.1	44%	0.435	24%	0.237	S	C	.	.	S	Bend	cis	-80.1	141.5	3	32.4	-35.2	0	0	0	113.9	K279 L280	P253-K279 HydrophobicContact CB-CG 4.46Å; P253-L280 CarbonylContact C-O 3.56Å; P253-L280 WeakPolarHBondContact CA-O 3.03Å
254	V	85.6	Confident	88.9	Confident	11 Å²	11	53.7 Å²	53.7	7%	0.067	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	147	172.7	-58.7	0	0	0	0	111.4	I246 R251 L252 V256 L280	I246-V254 HydrophobicContact CG2-CG2 3.99Å; R251-V254 WeakPolarHBondContact O-CG1 3.21Å; L252-V254 HydrophobicContact CD2-CG2 3.91Å; V254-V256 HydrophobicContact CG2-CG1 4.3Å; V254-L280 HydrophobicContact CG2-CB 3.98Å; V254-L280 HydrophobicContact CG2-CD1 3.99Å; V254-L280 HydrophobicContact CG2-CG 4.24Å; V254-L280 PolarHBondContact N-O 2.62Å; V254-L280 PolarHBondContact O-N 3.06Å
255	N	88.6	Confident	88.7	Confident	17 Å²	17	49.5 Å²	49.5	9%	0.091	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	134.8	172.3	-58.2	-32.7	0	0	0	110.2	L76 L100 D103 Y278 K279	L76-N255 HydrophobicContact CD1-CB 4.43Å; L100-N255 HydrophobicContact CB-CB 4.27Å; L100-N255 HydrophobicContact CD1-CB 4.24Å; L100-N255 PolarHBondContact N-O 3.23Å; D103-N255 VanDerWaalsContact CB-ND2 3.27Å; D103-N255 WeakPolarHBondContact CB-ND2 3.48Å; D103-N255 PolarHBondContact O-ND2 3.44Å; N255-Y278 WeakPolarHBondContact CA-O 3.24Å; N255-K279 WeakPolarHBondContact OD1-CB 3.39Å; N255-K279 WeakPolarHBondContact OD1-CD 3.25Å; N255-K279 WeakPolarHBondContact OD1-CG 3.46Å
256	V	91.1	Very high	88.6	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	153.8	177.4	-61.2	0	0	0	0	110.7	F97 K98 I246 V254 R277 Y278 L280	F97-V256 HydrophobicContact CB-CB 4.15Å; F97-V256 HydrophobicContact CB-CG1 4.42Å; F97-V256 HydrophobicContact CB-CG2 4.35Å; F97-V256 HydrophobicContact CD1-CB 4.35Å; F97-V256 HydrophobicContact CD1-CG2 3.69Å; F97-V256 HydrophobicContact CG-CG2 4.4Å; K98-V256 CarbonylContact O-C 3.53Å; K98-V256 VanDerWaalsContact O-CA 3.24Å; K98-V256 WeakPolarHBondContact O-CA 3.39Å; K98-V256 WeakPolarHBondContact O-CB 3.4Å; I246-V256 HydrophobicContact CD1-CG1 3.98Å; V254-V256 HydrophobicContact CG2-CG1 4.3Å; V256-R277 CarbonylContact O-C 3.55Å; V256-R277 VanDerWaalsContact O-CA 3.28Å; V256-R277 WeakPolarHBondContact O-CA 3.43Å; V256-Y278 PolarHBondContact N-O 2.86Å; V256-Y278 PolarHBondContact O-N 3.29Å; V256-L280 HydrophobicContact CG1-CD1 3.85Å; V256-L280 HydrophobicContact CG1-CG 4.26Å; V256-L280 HydrophobicContact CG2-CD1 4.07Å; V256-L280 HydrophobicContact CG2-CD2 4Å; V256-L280 HydrophobicContact CG2-CG 3.89Å
257	V	92.3	Very high	88.6	Confident	27 Å²	27	56.7 Å²	56.7	16%	0.164	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	146.3	166.2	64.7	0	0	0	0	109.5	K98 L100 P259 H276 R277	K98-V257 HydrophobicContact CB-CG1 4.03Å; K98-V257 PolarHBondContact N-O 2.94Å; K98-V257 PolarHBondContact O-N 3.31Å; L100-V257 HydrophobicContact CD1-CB 4.25Å; L100-V257 HydrophobicContact CD2-CB 3.87Å; L100-V257 HydrophobicContact CD2-CG1 3.69Å; L100-V257 HydrophobicContact CG-CB 4.06Å; L100-V257 HydrophobicContact CG-CG1 4.15Å; V257-P259 WeakPolarHBondContact O-CD 3.4Å; V257-H276 WeakPolarHBondContact CA-O 3.25Å; V257-R277 HydrophobicContact CB-CG 4.38Å; V257-R277 HydrophobicContact CG2-CG 4.22Å
258	V	94.3	Very high	88.7	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.006	29%	0.285	C	S	.	.			trans	-82.7	110.4	172.9	-178.8	0	0	0	0	108.4	F97 G260 P262 I272 R273 G275 H276 Y278	F97-V258 HydrophobicContact CD1-CG2 4.09Å; F97-V258 HydrophobicContact CE1-CG2 3.83Å; V258-G260 WeakPolarHBondContact CG1-O 3.18Å; V258-P262 HydrophobicContact CG1-CG 3.46Å; V258-P262 VanDerWaalsContact CG1-CG 3.46Å; V258-I272 HydrophobicContact CG1-CG2 4.41Å; V258-I272 HydrophobicContact CG2-CG2 3.59Å; V258-R273 VanDerWaalsContact CB-O 3.23Å; V258-R273 WeakPolarHBondContact CB-O 3.19Å; V258-R273 WeakPolarHBondContact CG1-O 3.27Å; V258-R273 WeakPolarHBondContact CG2-O 3.41Å; V258-G275 PolarHBondContact O-N 2.84Å; V258-H276 PolarHBondContact N-O 3.33Å; V258-Y278 HydrophobicContact CG2-CD2 4.08Å; V258-Y278 HydrophobicContact CG2-CE2 3.88Å
259	P	92.7	Very high	88.7	Confident	45 Å²	45	55.2 Å²	55.2	29%	0.292	28%	0.284	S	S	.	.			trans	-80.2	-21.8	-167.9	32.8	-34.8	0	0	0	113.8	Q96 E240 V257	Q96-P259 HydrophobicContact CB-CG 4.28Å; Q96-P259 WeakPolarHBondContact O-CD 3.33Å; E240-P259 VanDerWaalsContact CD-CG 3.44Å; E240-P259 HydrophobicContact CG-CB 4.14Å; E240-P259 HydrophobicContact CG-CG 3.84Å; E240-P259 WeakPolarHBondContact OE2-CG 3.4Å; V257-P259 WeakPolarHBondContact O-CD 3.4Å
260	G	89.4	Confident	88.9	Confident	31 Å²	31	52.7 Å²	52.7	32%	0.32	27%	0.273	S	S	.	.	S	Bend	trans	-157	162.4	179.8	0	0	0	0	0	110.7	V258 P262	V258-G260 WeakPolarHBondContact CG1-O 3.18Å; G260-P262 VanDerWaalsContact O-CD 3.24Å; G260-P262 WeakPolarHBondContact O-CD 3.26Å; G260-P262 VanDerWaalsContact O-N 3.13Å
261	T	88.6	Confident	89.1	Confident	111 Å²	111	56 Å²	56	68%	0.681	29%	0.29	S	S	*	.			trans	-50.9	114.4	-176.3	-72	0	0	0	0	111.5	E274	T261-E274 WeakPolarHBondContact CA-OE2 3.39Å; T261-E274 WeakPolarHBondContact CB-OE2 3.25Å; T261-E274 PolarHBondContact N-OE2 3.05Å; T261-E274 PolarHBondContact OG1-OE2 3.02Å
262	P	87.7	Confident	89.6	Confident	16 Å²	16	51.4 Å²	51.4	10%	0.104	27%	0.273	C	S	.	.	P	Polyproline II helix	trans	-68.4	157.1	-178	-23.1	35.1	0	0	0	113.4	Y93 V258 G260 R264 I272	Y93-P262 HydrophobicContact CE1-CB 4.4Å; Y93-P262 WeakPolarHBondContact OH-CB 3.49Å; V258-P262 HydrophobicContact CG1-CG 3.46Å; V258-P262 VanDerWaalsContact CG1-CG 3.46Å; G260-P262 VanDerWaalsContact O-CD 3.24Å; G260-P262 WeakPolarHBondContact O-CD 3.26Å; G260-P262 VanDerWaalsContact O-N 3.13Å; P262-R264 PolarHBondContact O-N 3.15Å; P262-I272 HydrophobicContact CG-CB 4.27Å; P262-I272 HydrophobicContact CG-CG2 3.89Å
263	P	86.8	Confident	89.7	Confident	59 Å²	59	54.6 Å²	54.6	38%	0.383	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-61.6	129.1	165.4	27.8	-32	0	0	0	109.3	Y93 E94	Y93-P263 PolarHBondContact OH-O 2.91Å; Y93-P263 VanDerWaalsContact OH-O 3.13Å; E94-P263 HydrophobicContact CB-CG 3.78Å
264	R	84.9	Confident	90	Very high	201 Å²	201	56.6 Å²	56.6	76%	0.758	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-94.3	125.6	179	179.7	178.7	179.4	-176.1	1	110.1	P262 L271	P262-R264 PolarHBondContact O-N 3.15Å; R264-L271 HydrophobicContact CG-CD1 4.29Å
265	N	91	Very high	90.2	Very high	19 Å²	19	58.3 Å²	58.3	10%	0.102	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-82.7	149.8	170	-155	-82.3	0	0	0	111.1	Y267 D268 D345 A349	N265-Y267 PolarHBondContact O-N 2.75Å; N265-Y267 WeakPolarHBondContact OD1-CB 3.43Å; N265-Y267 VanDerWaalsContact OD1-CD2 3.25Å; N265-Y267 WeakPolarHBondContact OD1-CD2 3.31Å; N265-Y267 PolarHBondContact OD1-N 3.3Å; N265-D268 HydrophobicContact CB-CB 4.29Å; N265-D268 VanDerWaalsContact CB-OD1 3.25Å; N265-D268 WeakPolarHBondContact CB-OD1 3.28Å; N265-D268 WeakPolarHBondContact CB-OD2 3.38Å; N265-D268 PolarHBondContact N-OD2 3.45Å; N265-D345 VanDerWaalsContact ND2-CG 3.33Å; N265-D345 PolarHBondContact ND2-O 3Å; N265-D345 PolarHBondContact ND2-OD1 3.31Å; N265-A349 HydrophobicContact CB-CB 4.11Å
266	Q	90.9	Very high	90.3	Very high	141 Å²	141	59.9 Å²	59.9	66%	0.659	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-21.5	172.2	65	-174.2	-44.2	0	0	112.9	D345	Q266-D345 PolarHBondContact NE2-OD2 3.46Å
267	Y	92.2	Very high	90.2	Very high	44 Å²	44	65.4 Å²	65.4	17%	0.173	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	6	-179.3	-49.1	-65.6	0	0	0	113.7	N265 L269 P301 D345 Y346	N265-Y267 PolarHBondContact O-N 2.75Å; N265-Y267 WeakPolarHBondContact OD1-CB 3.43Å; N265-Y267 VanDerWaalsContact OD1-CD2 3.25Å; N265-Y267 WeakPolarHBondContact OD1-CD2 3.31Å; N265-Y267 PolarHBondContact OD1-N 3.3Å; Y267-L269 PolarHBondContact O-N 2.89Å; Y267-P301 HydrophobicContact CD1-CG 4.07Å; Y267-P301 HydrophobicContact CE1-CG 3.73Å; Y267-D345 HydrophobicContact CE2-CB 4.43Å; Y267-D345 WeakPolarHBondContact CE2-OD2 3.39Å; Y267-Y346 AromaticContact CD1-CD2 3.95Å; Y267-Y346 HydrophobicContact CD1-CD2 3.95Å; Y267-Y346 HydrophobicContact CD1-CE2 4.48Å; Y267-Y346 AromaticContact CD2-CD2 3.84Å; Y267-Y346 HydrophobicContact CD2-CD2 3.84Å; Y267-Y346 HydrophobicContact CD2-CG 4.37Å; Y267-Y346 HydrophobicContact CE1-CD2 4.48Å; Y267-Y346 HydrophobicContact CE2-CD2 4.35Å; Y267-Y346 AromaticContact CG-CD2 3.6Å; Y267-Y346 HydrophobicContact CG-CD2 3.6Å; Y267-Y346 HydrophobicContact CG-CE2 4.38Å
268	D	92.3	Very high	90.2	Very high	27 Å²	27	64.1 Å²	64.1	14%	0.144	33%	0.325	C	S	.	.			trans	-61.9	123.3	174.9	-76.6	-23.5	0	0	0	110.3	N265 A349 V350	N265-D268 HydrophobicContact CB-CB 4.29Å; N265-D268 VanDerWaalsContact CB-OD1 3.25Å; N265-D268 WeakPolarHBondContact CB-OD1 3.28Å; N265-D268 WeakPolarHBondContact CB-OD2 3.38Å; N265-D268 PolarHBondContact N-OD2 3.45Å; D268-A349 WeakPolarHBondContact OD1-CA 3.36Å; D268-V350 PolarHBondContact OD1-N 3.16Å
269	L	90.9	Very high	90	Very high	105 Å²	105	65.3 Å²	65.3	55%	0.55	33%	0.33	S	S	.	.	S	Bend	trans	-83.2	-40.1	171.1	-57.8	-179.5	0	0	0	110.8	Y267 V350 R351	Y267-L269 PolarHBondContact O-N 2.89Å; L269-V350 PolarHBondContact N-O 3.42Å; L269-R351 HydrophobicContact CD1-CB 4.48Å; L269-R351 HydrophobicContact CD1-CG 4.38Å
270	H	90.1	Very high	89.9	Confident	26 Å²	26	63.2 Å²	63.2	12%	0.12	32%	0.317	C	S	.	.	S	Bend	trans	-108.1	131	173.4	174	79	0	0	0	111.2	I87 Y278 V350	I87-H270 VanDerWaalsContact CD1-CD2 3.41Å; I87-H270 WeakPolarHBondContact CD1-CD2 3.5Å; I87-H270 HydrophobicContact CG2-CB 3.94Å; H270-Y278 PolarHBondContact NE2-OH 2.83Å; H270-V350 HydrophobicContact CB-CG1 4.3Å
271	L	88.6	Confident	89.9	Confident	82 Å²	82	64.5 Å²	64.5	43%	0.429	32%	0.318	S	S	.	.			trans	-87.6	110.4	176.3	-178.2	68.8	0	0	0	110.7	R264 R273	R264-L271 HydrophobicContact CG-CD1 4.29Å; L271-R273 HydrophobicContact CD2-CG 4.46Å; L271-R273 HydrophobicContact CG-CG 4.39Å
272	I	91.3	Very high	90	Very high	5 Å²	5	63.2 Å²	63.2	3%	0.026	31%	0.307	C	S	.	.			trans	-69.8	129.1	166.7	-56.3	-172.5	0	0	0	108.5	I87 I89 Y93 F97 V258 P262 Y278 V350	I87-I272 HydrophobicContact CD1-CG1 4.47Å; I89-I272 HydrophobicContact CD1-CD1 3.76Å; I89-I272 HydrophobicContact CG1-CD1 4Å; I89-I272 HydrophobicContact CG2-CD1 4.1Å; Y93-I272 HydrophobicContact CD1-CD1 4.38Å; Y93-I272 HydrophobicContact CE1-CD1 3.79Å; F97-I272 HydrophobicContact CE1-CG2 4.3Å; F97-I272 HydrophobicContact CZ-CD1 4Å; F97-I272 HydrophobicContact CZ-CG2 4.28Å; V258-I272 HydrophobicContact CG1-CG2 4.41Å; V258-I272 HydrophobicContact CG2-CG2 3.59Å; P262-I272 HydrophobicContact CG-CB 4.27Å; P262-I272 HydrophobicContact CG-CG2 3.89Å; I272-Y278 HydrophobicContact CG2-CE2 3.94Å; I272-V350 HydrophobicContact CD1-CG1 4.14Å; I272-V350 HydrophobicContact CD1-CG2 3.77Å; I272-V350 HydrophobicContact CG1-CG1 4.2Å; I272-V350 HydrophobicContact CG1-CG2 4.18Å
273	R	89.1	Confident	90.3	Very high	111 Å²	111	65.7 Å²	65.7	42%	0.419	32%	0.319	S	S	.	.			trans	-112.4	148	-172.5	-58.6	177.2	-172.2	155.7	-4.5	111.4	V258 L271 H276	V258-R273 VanDerWaalsContact CB-O 3.23Å; V258-R273 WeakPolarHBondContact CB-O 3.19Å; V258-R273 WeakPolarHBondContact CG1-O 3.27Å; V258-R273 WeakPolarHBondContact CG2-O 3.41Å; L271-R273 HydrophobicContact CD2-CG 4.46Å; L271-R273 HydrophobicContact CG-CG 4.39Å; R273-H276 HydrophobicContact CB-CB 4.31Å; R273-H276 PolarHBondContact NH1-NE2 2.97Å; R273-H276 VanDerWaalsContact NH1-NE2 3.14Å; R273-H276 PolarHBondContact O-N 2.88Å
274	E	92.8	Very high	90.5	Very high	109 Å²	109	66.8 Å²	66.8	51%	0.509	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	141.4	167.8	-170.1	170.8	134.3	0	0	111.1	T261 H276	T261-E274 WeakPolarHBondContact CA-OE2 3.39Å; T261-E274 WeakPolarHBondContact CB-OE2 3.25Å; T261-E274 PolarHBondContact N-OE2 3.05Å; T261-E274 PolarHBondContact OG1-OE2 3.02Å; E274-H276 PolarHBondContact O-N 3.47Å
275	G	89.8	Confident	90.9	Very high	47 Å²	47	61.1 Å²	61.1	49%	0.485	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	-12.5	-179.8	0	0	0	0	0	115.9	V258	V258-G275 PolarHBondContact O-N 2.84Å
276	H	89.4	Confident	90.9	Very high	50 Å²	50	62.5 Å²	62.5	23%	0.231	31%	0.312	C	S	.	.			trans	-66.3	147.8	175.3	-86.8	33.4	0	0	0	111.7	V257 V258 R273 E274 Y278	V257-H276 WeakPolarHBondContact CA-O 3.25Å; V258-H276 PolarHBondContact N-O 3.33Å; R273-H276 HydrophobicContact CB-CB 4.31Å; R273-H276 PolarHBondContact NH1-NE2 2.97Å; R273-H276 VanDerWaalsContact NH1-NE2 3.14Å; R273-H276 PolarHBondContact O-N 2.88Å; E274-H276 PolarHBondContact O-N 3.47Å; H276-Y278 HydrophobicContact CB-CE2 3.78Å
277	R	89.7	Confident	91	Very high	116 Å²	116	58.3 Å²	58.3	44%	0.438	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	140.3	-179.8	-60.7	-176.8	-176.5	-168.9	2.2	110	L76 L100 V256 V257	L76-R277 HydrophobicContact CB-CB 3.94Å; L76-R277 HydrophobicContact CD1-CB 4.18Å; L76-R277 PolarHBondContact N-O 3.1Å; L100-R277 HydrophobicContact CD1-CB 4.37Å; L100-R277 HydrophobicContact CD1-CG 3.99Å; V256-R277 CarbonylContact O-C 3.55Å; V256-R277 VanDerWaalsContact O-CA 3.28Å; V256-R277 WeakPolarHBondContact O-CA 3.43Å; V257-R277 HydrophobicContact CB-CG 4.38Å; V257-R277 HydrophobicContact CG2-CG 4.22Å
278	Y	90.9	Very high	91.1	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	132.7	180	-66.4	-81.3	0	0	0	111	A73 H74 I87 N255 V256 V258 H270 I272 H276	A73-Y278 HydrophobicContact CB-CD1 4.31Å; H74-Y278 CarbonylContact O-C 3.49Å; H74-Y278 VanDerWaalsContact O-CA 3.27Å; H74-Y278 WeakPolarHBondContact O-CA 3.48Å; I87-Y278 HydrophobicContact CD1-CD1 4.17Å; I87-Y278 HydrophobicContact CD1-CE1 3.71Å; N255-Y278 WeakPolarHBondContact CA-O 3.24Å; V256-Y278 PolarHBondContact N-O 2.86Å; V256-Y278 PolarHBondContact O-N 3.29Å; V258-Y278 HydrophobicContact CG2-CD2 4.08Å; V258-Y278 HydrophobicContact CG2-CE2 3.88Å; H270-Y278 PolarHBondContact NE2-OH 2.83Å; I272-Y278 HydrophobicContact CG2-CE2 3.94Å; H276-Y278 HydrophobicContact CB-CE2 3.78Å
279	K	90.5	Very high	91.2	Very high	27 Å²	27	55 Å²	55	12%	0.117	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	105.9	164.1	-169	157	-175	176.5	0	106.9	A73 H74 L76 V82 D105 P253 N255 V281	A73-K279 WeakPolarHBondContact CA-O 3.39Å; H74-K279 PolarHBondContact N-O 3.19Å; H74-K279 PolarHBondContact O-N 3.26Å; L76-K279 HydrophobicContact CD1-CB 4.18Å; L76-K279 HydrophobicContact CD2-CB 4.21Å; L76-K279 HydrophobicContact CG-CB 4.25Å; V82-K279 HydrophobicContact CG2-CB 4.45Å; V82-K279 HydrophobicContact CG2-CD 4.16Å; D105-K279 IonicContact OD1-NZ 3.75Å; D105-K279 PolarHBondContact OD1-NZ 3.2Å; D105-K279 IonicContact OD2-NZ 3.28Å; D105-K279 PolarHBondContact OD2-NZ 3.23Å; P253-K279 HydrophobicContact CB-CG 4.46Å; N255-K279 WeakPolarHBondContact OD1-CB 3.39Å; N255-K279 WeakPolarHBondContact OD1-CD 3.25Å; N255-K279 WeakPolarHBondContact OD1-CG 3.46Å; K279-V281 HydrophobicContact CG-CG2 4.05Å
280	L	92.1	Very high	91.4	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	117	172.8	-54.1	-172.5	0	0	0	107.2	I71 A73 I246 L252 P253 V254 V256	I71-L280 HydrophobicContact CD1-CD1 4.17Å; I71-L280 HydrophobicContact CG2-CB 3.94Å; I71-L280 HydrophobicContact CG2-CD2 4.05Å; I71-L280 HydrophobicContact CG2-CG 4.41Å; A73-L280 HydrophobicContact CB-CD2 3.6Å; I246-L280 HydrophobicContact CG2-CD1 4.16Å; L252-L280 HydrophobicContact CD2-CB 3.91Å; P253-L280 CarbonylContact C-O 3.56Å; P253-L280 WeakPolarHBondContact CA-O 3.03Å; V254-L280 HydrophobicContact CG2-CB 3.98Å; V254-L280 HydrophobicContact CG2-CD1 3.99Å; V254-L280 HydrophobicContact CG2-CG 4.24Å; V254-L280 PolarHBondContact N-O 2.62Å; V254-L280 PolarHBondContact O-N 3.06Å; V256-L280 HydrophobicContact CG1-CD1 3.85Å; V256-L280 HydrophobicContact CG1-CG 4.26Å; V256-L280 HydrophobicContact CG2-CD1 4.07Å; V256-L280 HydrophobicContact CG2-CD2 4Å; V256-L280 HydrophobicContact CG2-CG 3.89Å
281	V	89.1	Confident	91.6	Very high	59 Å²	59	48.8 Å²	48.8	36%	0.358	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	-44.9	-167.3	175.6	0	0	0	0	113.3	T72 L252 K279	T72-V281 HydrophobicContact CG2-CB 4.33Å; T72-V281 PolarHBondContact O-N 3.38Å; L252-V281 WeakPolarHBondContact CB-O 3.5Å; K279-V281 HydrophobicContact CG-CG2 4.05Å
282	N	90.4	Very high	91.9	Very high	84 Å²	84	44.9 Å²	44.9	45%	0.449	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	153.2	-175	-171.3	27.5	0	0	0	111.5	I71 T72	I71-N282 CarbonylContact C-O 3.51Å; I71-N282 WeakPolarHBondContact CA-O 3.19Å; T72-N282 PolarHBondContact N-O 2.88Å
283	I	93.3	Very high	92	Very high	67 Å²	67	44.8 Å²	44.8	34%	0.344	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	134.1	169	178.8	160.5	0	0	0	109.6	T69 T70 V91 V247 L252	T69-I283 HydrophobicContact CG2-CD1 3.58Å; T69-I283 HydrophobicContact CG2-CG1 3.66Å; T70-I283 WeakPolarHBondContact O-CA 3.45Å; V91-I283 HydrophobicContact CG1-CD1 4.16Å; V247-I283 HydrophobicContact CB-CD1 4.33Å; V247-I283 HydrophobicContact CG1-CD1 3.4Å; V247-I283 VanDerWaalsContact CG1-CD1 3.4Å; V247-I283 HydrophobicContact CG2-CD1 3.99Å; L252-I283 HydrophobicContact CD1-CB 4.36Å; L252-I283 HydrophobicContact CD1-CG2 4.46Å
284	Q	91.6	Very high	92.2	Very high	83 Å²	83	39.5 Å²	39.5	39%	0.388	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	125.4	178.4	-163.8	176.3	10.9	0	0	110.7	T69 T70 K286	T69-Q284 WeakPolarHBondContact CA-O 3.5Å; T70-Q284 PolarHBondContact N-O 3.32Å; T70-Q284 PolarHBondContact O-N 3.43Å; Q284-K286 HydrophobicContact CG-CG 4.02Å
285	T	93.6	Very high	91.9	Very high	82 Å²	82	36.3 Å²	36.3	50%	0.503	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	122.7	165	-60.3	0	0	0	0	108.6	Q67 W68 T69	Q67-T285 HydrophobicContact CB-CG2 4.31Å; W68-T285 CarbonylContact O-C 3.5Å; W68-T285 WeakPolarHBondContact O-CA 3.44Å; T69-T285 WeakPolarHBondContact CG2-OG1 3.42Å; T69-T285 PolarHBondContact OG1-OG1 3.31Å
286	K	91.2	Very high	91.4	Very high	48 Å²	48	36.5 Å²	36.5	21%	0.209	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	138.5	175.6	-59.3	174.9	-174.1	169.1	0	108.5	W68 E88 Q284 V288 P305	W68-K286 PolarHBondContact N-O 3.33Å; W68-K286 PolarHBondContact O-N 2.74Å; E88-K286 IonicContact OE1-NZ 2.71Å; E88-K286 PolarHBondContact OE1-NZ 3.02Å; E88-K286 IonicContact OE2-NZ 3.79Å; E88-K286 PolarHBondContact OE2-NZ 3.44Å; Q284-K286 HydrophobicContact CG-CG 4.02Å; K286-V288 HydrophobicContact CB-CG2 4.03Å; K286-P305 HydrophobicContact CD-CB 4.29Å
287	T	92.9	Very high	90.9	Very high	53 Å²	53	40.7 Å²	40.7	33%	0.325	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	136.5	159.6	-48.6	0	0	0	0	107.6	C65 R66 P305 F306	C65-T287 WeakPolarHBondContact SG-CG2 3.36Å; R66-T287 CarbonylContact O-C 3.52Å; R66-T287 WeakPolarHBondContact O-CA 3.19Å; T287-P305 WeakPolarHBondContact O-CA 3.46Å; T287-F306 HydrophobicContact CG2-CD2 3.51Å; T287-F306 HydrophobicContact CG2-CE2 3.6Å; T287-F306 HydrophobicContact CG2-CG 4.32Å; T287-F306 HydrophobicContact CG2-CZ 4.49Å; T287-F306 PolarHBondContact O-N 2.9Å
288	V	93.1	Very high	90.7	Very high	2 Å²	2	41.5 Å²	41.5	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	130	-174.9	-177.9	0	0	0	0	109.4	R66 W68 K286 H303 F304 P305	R66-V288 PolarHBondContact N-O 2.69Å; R66-V288 PolarHBondContact O-N 2.94Å; W68-V288 HydrophobicContact CB-CG2 4.02Å; W68-V288 HydrophobicContact CD2-CB 4.02Å; W68-V288 HydrophobicContact CD2-CG1 4.11Å; W68-V288 HydrophobicContact CD2-CG2 3.89Å; W68-V288 HydrophobicContact CE3-CB 4.12Å; W68-V288 HydrophobicContact CE3-CG1 3.89Å; W68-V288 HydrophobicContact CE3-CG2 3.73Å; W68-V288 HydrophobicContact CG-CB 4.3Å; W68-V288 HydrophobicContact CG-CG2 4.05Å; W68-V288 HydrophobicContact CH2-CG1 4.05Å; W68-V288 HydrophobicContact CZ2-CG1 4.3Å; W68-V288 HydrophobicContact CZ3-CG1 3.86Å; W68-V288 HydrophobicContact CZ3-CG2 4.45Å; K286-V288 HydrophobicContact CB-CG2 4.03Å; V288-H303 HydrophobicContact CG1-CB 3.68Å; V288-F304 WeakPolarHBondContact CA-O 3.48Å; V288-P305 HydrophobicContact CG2-CB 4.24Å
289	V	94.3	Very high	90.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	124.3	167.3	-167.1	0	0	0	0	108.3	L30 V34 I62 H303 F304 F306	L30-V289 HydrophobicContact CD1-CG1 4.28Å; L30-V289 HydrophobicContact CD2-CB 3.94Å; L30-V289 HydrophobicContact CD2-CG1 4.27Å; L30-V289 HydrophobicContact CD2-CG2 3.86Å; L30-V289 HydrophobicContact CG-CB 4.46Å; L30-V289 HydrophobicContact CG-CG1 4.48Å; L30-V289 HydrophobicContact CG-CG2 4.04Å; V34-V289 HydrophobicContact CG2-CG1 3.98Å; V34-V289 HydrophobicContact CG2-CG2 3.99Å; I62-V289 HydrophobicContact CG2-CG1 3.58Å; V289-H303 CarbonylContact O-C 3.57Å; V289-H303 WeakPolarHBondContact O-CA 3.41Å; V289-F304 PolarHBondContact N-O 2.71Å; V289-F304 PolarHBondContact O-N 2.76Å; V289-F306 HydrophobicContact CG2-CD2 4.04Å; V289-F306 HydrophobicContact CG2-CE2 3.25Å; V289-F306 HydrophobicContact CG2-CZ 3.69Å
290	V	94.8	Very high	90.7	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	131.6	172.7	-175.4	0	0	0	0	108.7	H63 S64 W68 F341 I343 Y346	H63-V290 WeakPolarHBondContact CB-O 3.39Å; H63-V290 PolarHBondContact N-O 3.25Å; S64-V290 PolarHBondContact N-O 2.84Å; S64-V290 PolarHBondContact O-N 2.97Å; W68-V290 HydrophobicContact CH2-CG2 4.38Å; W68-V290 HydrophobicContact CZ2-CG2 3.65Å; V290-F341 HydrophobicContact CG1-CE1 4.21Å; V290-F341 HydrophobicContact CG1-CZ 3.85Å; V290-I343 HydrophobicContact CB-CD1 3.77Å; V290-I343 HydrophobicContact CB-CG1 4.48Å; V290-I343 HydrophobicContact CG1-CD1 3.73Å; V290-I343 HydrophobicContact CG1-CG1 4.09Å; V290-I343 HydrophobicContact CG2-CD1 4.07Å; V290-I343 HydrophobicContact CG2-CG1 4.47Å; V290-Y346 HydrophobicContact CG1-CD1 4.12Å; V290-Y346 HydrophobicContact CG1-CE1 4.18Å
291	C	94.8	Very high	90.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	150.1	-178.1	-55.8	0	0	0	0	111.2	L60 L61 T302 F304	L60-C291 HydrophobicContact CD2-CB 4.16Å; L61-C291 CarbonylContact O-C 3.55Å; L61-C291 VanDerWaalsContact O-CA 3.24Å; L61-C291 WeakPolarHBondContact O-CA 3.19Å; C291-T302 HydrophobicContact CB-CG2 3.87Å; C291-T302 PolarHBondContact N-O 3.1Å; C291-T302 PolarHBondContact O-N 3.03Å; C291-F304 HydrophobicContact CB-CE2 4.48Å
292	C	94.8	Very high	90.9	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	116.1	170.6	-71.5	0	0	0	0	109	L60 L61 L294 I299 F341	L60-C292 WeakPolarHBondContact CA-O 3.36Å; L61-C292 HydrophobicContact CB-CB 4.26Å; L61-C292 PolarHBondContact N-O 2.68Å; L61-C292 PolarHBondContact O-N 3.12Å; C292-L294 HydrophobicContact CB-CD2 4.22Å; C292-L294 PolarHBondContact O-N 2.93Å; C292-I299 HydrophobicContact CB-CG2 3.7Å; C292-F341 VanDerWaalsContact SG-CD1 3.52Å
293	V	93.8	Very high	91	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.018	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	122.2	170.5	-169.1	0	0	0	0	107.9	L54 D58 L60 R295 I299 I300 T302	L54-V293 HydrophobicContact CD2-CB 4.49Å; L54-V293 HydrophobicContact CD2-CG1 4.25Å; L54-V293 HydrophobicContact CD2-CG2 3.38Å; D58-V293 HydrophobicContact CB-CG1 3.93Å; L60-V293 HydrophobicContact CD2-CG2 4.38Å; L60-V293 HydrophobicContact CG-CG2 4.41Å; V293-R295 HydrophobicContact CG1-CG 4.33Å; V293-I299 WeakPolarHBondContact O-CA 3.49Å; V293-I300 HydrophobicContact CB-CB 4.27Å; V293-I300 PolarHBondContact N-O 2.79Å; V293-I300 PolarHBondContact O-N 3.19Å; V293-T302 HydrophobicContact CG2-CG2 3.76Å
294	L	92.4	Very high	90.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	111.7	-175.2	-48.9	-179.5	0	0	0	108.5	Y15 L18 Y59 L61 C292 W333	Y15-L294 WeakPolarHBondContact CE2-O 3.37Å; L18-L294 HydrophobicContact CD1-CB 4.28Å; L18-L294 HydrophobicContact CD1-CD1 3.91Å; Y59-L294 PolarHBondContact O-N 3.01Å; L61-L294 HydrophobicContact CB-CD1 4.2Å; L61-L294 HydrophobicContact CB-CD2 4.05Å; L61-L294 HydrophobicContact CB-CG 4.35Å; C292-L294 HydrophobicContact CB-CD2 4.22Å; C292-L294 PolarHBondContact O-N 2.93Å; L294-W333 HydrophobicContact CB-CH2 4.12Å; L294-W333 HydrophobicContact CB-CZ2 4.49Å; L294-W333 HydrophobicContact CB-CZ3 4.24Å; L294-W333 HydrophobicContact CD1-CD2 3.8Å; L294-W333 HydrophobicContact CD1-CE3 3.96Å; L294-W333 HydrophobicContact CD1-CG 4.23Å; L294-W333 HydrophobicContact CD1-CH2 4.39Å; L294-W333 HydrophobicContact CD1-CZ2 4.22Å; L294-W333 HydrophobicContact CD1-CZ3 4.27Å; L294-W333 HydrophobicContact CD2-CD2 4.46Å; L294-W333 HydrophobicContact CD2-CE3 3.78Å; L294-W333 HydrophobicContact CD2-CZ3 3.85Å; L294-W333 HydrophobicContact CG-CE3 4.36Å; L294-W333 HydrophobicContact CG-CZ3 4.34Å
295	R	87	Confident	90.8	Very high	41 Å²	41	36.9 Å²	36.9	16%	0.155	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	152.5	172.5	-61.3	-177.6	179.8	148.8	8	109.3	G53 D58 V293 N297 K298	G53-R295 PolarHBondContact O-NH2 2.77Å; D58-R295 IonicContact OD1-CZ 3.65Å; D58-R295 IonicContact OD1-NE 2.85Å; D58-R295 PolarHBondContact OD1-NE 2.92Å; D58-R295 IonicContact OD1-NH2 3.61Å; D58-R295 IonicContact OD2-CZ 3.45Å; D58-R295 IonicContact OD2-NE 3.44Å; D58-R295 PolarHBondContact OD2-NE 2.78Å; D58-R295 IonicContact OD2-NH2 2.66Å; D58-R295 PolarHBondContact OD2-NH2 2.9Å; V293-R295 HydrophobicContact CG1-CG 4.33Å; R295-N297 PolarHBondContact O-N 2.91Å; R295-K298 WeakPolarHBondContact CB-O 3.47Å; R295-K298 PolarHBondContact N-O 3.13Å; R295-K298 PolarHBondContact O-N 3.37Å; R295-K298 VanDerWaalsContact O-N 3.1Å; R295-K298 VanDerWaalsContact O-O 3.13Å
296	S	80.8	Confident	90.4	Very high	52 Å²	52	36.5 Å²	36.5	36%	0.364	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-18.8	-165.4	58.8	0	0	0	0	116.8	T12	T12-S296 PolarHBondContact OG1-O 3.41Å; T12-S296 VanDerWaalsContact OG1-O 3.07Å
297	N	77.4	Confident	89.7	Confident	137 Å²	137	37.6 Å²	37.6	73%	0.733	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-131.8	5	179.7	69.2	-23.3	0	0	0	114	R295	R295-N297 PolarHBondContact O-N 2.91Å
298	K	85.6	Confident	88	Confident	134 Å²	134	44.5 Å²	44.5	58%	0.583	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-163.2	136	-178.6	-178.9	164.2	-175.8	175	0	112.2	R295 I300	R295-K298 WeakPolarHBondContact CB-O 3.47Å; R295-K298 PolarHBondContact N-O 3.13Å; R295-K298 PolarHBondContact O-N 3.37Å; R295-K298 VanDerWaalsContact O-N 3.1Å; R295-K298 VanDerWaalsContact O-O 3.13Å; K298-I300 HydrophobicContact CD-CG1 4.15Å; K298-I300 HydrophobicContact CG-CG1 3.98Å
299	I	89.3	Confident	87.4	Confident	22 Å²	22	47.5 Å²	47.5	11%	0.113	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	137.2	161.7	-64.4	157.1	0	0	0	109.2	C292 V293 F336 C337 Q340	C292-I299 HydrophobicContact CB-CG2 3.7Å; V293-I299 WeakPolarHBondContact O-CA 3.49Å; I299-F336 HydrophobicContact CD1-CD1 3.82Å; I299-F336 HydrophobicContact CD1-CE1 3.75Å; I299-F336 HydrophobicContact CG1-CE1 4.39Å; I299-C337 HydrophobicContact CD1-CB 4.36Å; I299-Q340 HydrophobicContact CD1-CB 4.13Å; I299-Q340 HydrophobicContact CD1-CG 4.41Å
300	I	91.7	Very high	87.1	Confident	55 Å²	55	48.8 Å²	48.8	28%	0.282	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	116.2	175.7	-56.6	172.1	0	0	0	108.7	V293 K298	V293-I300 HydrophobicContact CB-CB 4.27Å; V293-I300 PolarHBondContact N-O 2.79Å; V293-I300 PolarHBondContact O-N 3.19Å; K298-I300 HydrophobicContact CD-CG1 4.15Å; K298-I300 HydrophobicContact CG-CG1 3.98Å
301	P	93.4	Very high	86.8	Confident	25 Å²	25	49.5 Å²	49.5	16%	0.162	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	135.6	178.3	31.2	-34.4	0	0	0	111.5	Y267 F341 Y346	Y267-P301 HydrophobicContact CD1-CG 4.07Å; Y267-P301 HydrophobicContact CE1-CG 3.73Å; P301-F341 HydrophobicContact CB-CD2 3.66Å; P301-F341 HydrophobicContact CB-CE2 3.19Å; P301-F341 HydrophobicContact CB-CZ 3.76Å; P301-F341 HydrophobicContact CG-CD2 3.95Å; P301-F341 HydrophobicContact CG-CE2 3.8Å; P301-Y346 HydrophobicContact CB-CD2 3.92Å; P301-Y346 HydrophobicContact CB-CE1 4.44Å; P301-Y346 HydrophobicContact CB-CE2 3.74Å; P301-Y346 HydrophobicContact CB-CG 4.35Å; P301-Y346 HydrophobicContact CG-CD2 3.85Å; P301-Y346 HydrophobicContact CG-CE2 3.73Å; P301-Y346 PolarHBondContact O-OH 2.99Å
302	T	92.5	Very high	86.7	Confident	25 Å²	25	54 Å²	54	15%	0.153	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	166.8	177.2	-167.5	0	0	0	0	110	L60 C291 V293 F304 Y346	L60-T302 HydrophobicContact CD2-CG2 4.3Å; C291-T302 HydrophobicContact CB-CG2 3.87Å; C291-T302 PolarHBondContact N-O 3.1Å; C291-T302 PolarHBondContact O-N 3.03Å; V293-T302 HydrophobicContact CG2-CG2 3.76Å; T302-F304 HydrophobicContact CG2-CE2 3.97Å; T302-F304 HydrophobicContact CG2-CZ 4.12Å; T302-Y346 WeakPolarHBondContact CA-OH 3.4Å
303	H	93.1	Very high	86.7	Confident	43 Å²	43	54 Å²	54	20%	0.199	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	149.5	178.8	66.9	-76.8	0	0	0	112.6	W68 V288 V289 Y346 R351	W68-H303 HydrophobicContact CH2-CB 3.77Å; W68-H303 AromaticContact CH2-CD2 3.84Å; W68-H303 AromaticContact CH2-CG 3.59Å; W68-H303 HydrophobicContact CZ3-CB 4.2Å; W68-H303 AromaticContact CZ3-CD2 3.38Å; W68-H303 WeakPolarHBondContact CZ3-CD2 3.35Å; W68-H303 AromaticContact CZ3-CG 3.65Å; W68-H303 AromaticContact CZ3-NE2 3.79Å; V288-H303 HydrophobicContact CG1-CB 3.68Å; V289-H303 CarbonylContact O-C 3.57Å; V289-H303 WeakPolarHBondContact O-CA 3.41Å; H303-Y346 HydrophobicContact CB-CE1 4.17Å; H303-Y346 AromaticContact ND1-CE1 4Å; H303-Y346 AromaticContact ND1-CZ 3.8Å; H303-Y346 PolarHBondContact ND1-OH 2.92Å; H303-R351 PolarHBondContact CE1-NE 2.85Å; H303-R351 VanDerWaalsContact CE1-NE 3.34Å
304	F	91.6	Very high	86.7	Confident	21 Å²	21	54.6 Å²	54.6	9%	0.092	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	106.9	179.7	-58.9	-68.3	0	0	0	109.1	L30 V51 L54 L60 V288 V289 C291 T302 P311 F313	L30-F304 HydrophobicContact CD2-CB 3.55Å; L30-F304 HydrophobicContact CD2-CD2 3.55Å; L30-F304 HydrophobicContact CD2-CG 3.75Å; V51-F304 HydrophobicContact CG1-CE1 3.63Å; V51-F304 HydrophobicContact CG1-CZ 4.04Å; L54-F304 HydrophobicContact CD1-CZ 4.19Å; L60-F304 HydrophobicContact CD2-CE2 4.24Å; V288-F304 WeakPolarHBondContact CA-O 3.48Å; V289-F304 PolarHBondContact N-O 2.71Å; V289-F304 PolarHBondContact O-N 2.76Å; C291-F304 HydrophobicContact CB-CE2 4.48Å; T302-F304 HydrophobicContact CG2-CE2 3.97Å; T302-F304 HydrophobicContact CG2-CZ 4.12Å; F304-P311 HydrophobicContact CD1-CG 3.9Å; F304-P311 HydrophobicContact CE1-CG 4.08Å; F304-P311 HydrophobicContact CG-CG 4.21Å; F304-F313 HydrophobicContact CE2-CZ 4.1Å; F304-F313 HydrophobicContact CZ-CZ 4.37Å
305	P	89.9	Confident	86.9	Confident	32 Å²	32	54.6 Å²	54.6	21%	0.208	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	136.8	172.2	28.1	-31.4	0	0	0	109.5	K286 T287 V288 H307 M310	K286-P305 HydrophobicContact CD-CB 4.29Å; T287-P305 WeakPolarHBondContact O-CA 3.46Å; V288-P305 HydrophobicContact CG2-CB 4.24Å; P305-H307 PolarHBondContact O-N 2.88Å; P305-H307 PolarHBondContact O-ND1 2.94Å; P305-M310 WeakPolarHBondContact O-CE 3.45Å
306	F	84.6	Confident	87.3	Confident	74 Å²	74	52.7 Å²	52.7	33%	0.325	27%	0.273	S	S	.	.			trans	-66.5	104.2	176.6	-81	-102.7	0	0	0	110.5	D31 V34 T287 V289	D31-F306 HydrophobicContact CB-CD1 4.05Å; D31-F306 HydrophobicContact CB-CE1 3.6Å; V34-F306 HydrophobicContact CB-CZ 4.44Å; V34-F306 HydrophobicContact CG1-CZ 4.09Å; T287-F306 HydrophobicContact CG2-CD2 3.51Å; T287-F306 HydrophobicContact CG2-CE2 3.6Å; T287-F306 HydrophobicContact CG2-CG 4.32Å; T287-F306 HydrophobicContact CG2-CZ 4.49Å; T287-F306 PolarHBondContact O-N 2.9Å; V289-F306 HydrophobicContact CG2-CD2 4.04Å; V289-F306 HydrophobicContact CG2-CE2 3.25Å; V289-F306 HydrophobicContact CG2-CZ 3.69Å
307	H	75.2	Confident	87.9	Confident	71 Å²	71	53 Å²	53	33%	0.329	27%	0.269	S	S	.	.	S	Bend	trans	-142.7	177	172.9	66.3	-82.5	0	0	0	109.4	P305 A309 M310 W357	P305-H307 PolarHBondContact O-N 2.88Å; P305-H307 PolarHBondContact O-ND1 2.94Å; H307-A309 PolarHBondContact O-N 2.75Å; H307-M310 VanDerWaalsContact O-CE 3.3Å; H307-M310 WeakPolarHBondContact O-CE 3.36Å; H307-W357 HydrophobicContact CB-CH2 4.47Å; H307-W357 AromaticContact CD2-CH2 3.31Å; H307-W357 WeakPolarHBondContact CD2-CH2 3.44Å; H307-W357 AromaticContact CD2-CZ2 3.18Å; H307-W357 WeakPolarHBondContact CD2-CZ2 3.37Å; H307-W357 AromaticContact NE2-CZ2 3.49Å; H307-W357 WeakPolarHBondContact NE2-CZ2 3.46Å
308	M	58.4	Low	88.5	Confident	197 Å²	197	47 Å²	47	97%	0.97	24%	0.236	S	C	*	.	S	Bend	trans	-70.2	8.7	-160.8	-62.9	-178.8	67.8	0	0	117.1
309	A	79.5	Confident	88.8	Confident	66 Å²	66	42 Å²	42	55%	0.545	22%	0.216	S	C	.	.			trans	-135.7	85.8	174.1	0	0	0	0	0	110.5	H307	H307-A309 PolarHBondContact O-N 2.75Å
310	M	87.8	Confident	88.8	Confident	27 Å²	27	44.3 Å²	44.3	13%	0.133	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-76.8	130.3	174.8	-75.9	-64.5	99.8	0	0	111.7	P29 L30 D31 P305 H307	P29-M310 HydrophobicContact CB-CB 4.11Å; L30-M310 HydrophobicContact CB-CB 4.31Å; L30-M310 HydrophobicContact CB-CG 4.48Å; L30-M310 HydrophobicContact CB-SD 3.96Å; L30-M310 HydrophobicContact CD2-SD 4.32Å; L30-M310 HydrophobicContact CG-SD 4.47Å; D31-M310 HydrophobicContact CB-CG 3.88Å; D31-M310 HydrophobicContact CB-SD 4.49Å; P305-M310 WeakPolarHBondContact O-CE 3.45Å; H307-M310 VanDerWaalsContact O-CE 3.3Å; H307-M310 WeakPolarHBondContact O-CE 3.36Å
311	P	90.4	Very high	88.7	Confident	14 Å²	14	47.6 Å²	47.6	9%	0.091	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-63.2	146.1	170	25.6	-31.2	0	0	0	110.5	L30 V51 F304 F313	L30-P311 HydrophobicContact CD2-CG 4.45Å; L30-P311 PolarHBondContact N-O 3.37Å; L30-P311 VanDerWaalsContact N-O 3.11Å; V51-P311 HydrophobicContact CG2-CB 3.76Å; F304-P311 HydrophobicContact CD1-CG 3.9Å; F304-P311 HydrophobicContact CE1-CG 4.08Å; F304-P311 HydrophobicContact CG-CG 4.21Å; P311-F313 HydrophobicContact CB-CE2 4.06Å; P311-F313 HydrophobicContact CB-CZ 4.14Å; P311-F313 HydrophobicContact CG-CE2 3.83Å; P311-F313 HydrophobicContact CG-CZ 4.04Å
312	R	92.1	Very high	88.4	Confident	94 Å²	94	49.3 Å²	49.3	36%	0.355	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	143	178.6	-53.4	-173.4	73.5	93.3	-0.8	112.2	S27 L28 D46 Q49	S27-R312 PolarHBondContact O-NH2 2.76Å; S27-R312 WeakPolarHBondContact OG-CB 3.44Å; S27-R312 PolarHBondContact OG-NE 2.88Å; L28-R312 CarbonylContact O-C 3.55Å; L28-R312 WeakPolarHBondContact O-CA 3.11Å; D46-R312 HydrophobicContact CB-CB 4.04Å; D46-R312 WeakPolarHBondContact CB-O 3.5Å; D46-R312 PolarHBondContact N-O 3.46Å; Q49-R312 HydrophobicContact CG-CB 4.05Å; Q49-R312 VanDerWaalsContact OE1-N 3.08Å
313	F	94	Very high	88.2	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	141.5	178.5	-60.4	-82.1	0	0	0	110.8	L28 L30 L33 V43 K44 L45 L54 L60 F304 P311	L28-F313 PolarHBondContact N-O 2.63Å; L28-F313 PolarHBondContact O-N 3.12Å; L30-F313 HydrophobicContact CB-CD2 4.2Å; L30-F313 HydrophobicContact CB-CE2 3.99Å; L30-F313 HydrophobicContact CD1-CD2 3.97Å; L30-F313 HydrophobicContact CD1-CE2 3.8Å; L30-F313 HydrophobicContact CD2-CE2 4.15Å; L30-F313 HydrophobicContact CG-CE2 4.19Å; L33-F313 HydrophobicContact CD1-CB 4.27Å; V43-F313 HydrophobicContact CB-CB 3.95Å; V43-F313 HydrophobicContact CB-CG 4.47Å; V43-F313 HydrophobicContact CG2-CB 3.82Å; V43-F313 HydrophobicContact CG2-CD1 3.7Å; V43-F313 HydrophobicContact CG2-CE1 4.47Å; V43-F313 HydrophobicContact CG2-CG 3.8Å; K44-F313 CarbonylContact O-C 3.54Å; K44-F313 VanDerWaalsContact O-CA 3.25Å; K44-F313 WeakPolarHBondContact O-CA 3.28Å; K44-F313 WeakPolarHBondContact O-CB 3.32Å; L45-F313 HydrophobicContact CB-CE1 4.49Å; L45-F313 HydrophobicContact CD1-CD1 4.21Å; L45-F313 HydrophobicContact CD1-CE1 3.8Å; L45-F313 HydrophobicContact CD1-CZ 4.44Å; L54-F313 HydrophobicContact CD1-CE1 4.37Å; L60-F313 HydrophobicContact CD1-CD1 4.28Å; L60-F313 HydrophobicContact CD1-CE1 3.83Å; L60-F313 HydrophobicContact CD2-CE1 3.88Å; L60-F313 HydrophobicContact CD2-CZ 4.23Å; L60-F313 HydrophobicContact CG-CE1 4.42Å; F304-F313 HydrophobicContact CE2-CZ 4.1Å; F304-F313 HydrophobicContact CZ-CZ 4.37Å; P311-F313 HydrophobicContact CB-CE2 4.06Å; P311-F313 HydrophobicContact CB-CZ 4.14Å; P311-F313 HydrophobicContact CG-CE2 3.83Å; P311-F313 HydrophobicContact CG-CZ 4.04Å
314	I	94.9	Very high	88	Confident	17 Å²	17	56.6 Å²	56.6	9%	0.087	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	130.7	171.7	-61.4	167.2	0	0	0	108	W23 S24 K44 D46	W23-I314 HydrophobicContact CB-CG2 4.29Å; W23-I314 HydrophobicContact CE3-CG2 4.28Å; S24-I314 WeakPolarHBondContact O-CG2 3.49Å; K44-I314 HydrophobicContact CB-CB 4.5Å; K44-I314 PolarHBondContact N-O 2.96Å; K44-I314 PolarHBondContact O-N 3.02Å; D46-I314 HydrophobicContact CB-CG1 4.16Å
315	V	95.1	Very high	87.8	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	150.9	173.3	-67.1	0	0	0	0	111.7	S24 T26 L28 L33 L319 L320	S24-V315 WeakPolarHBondContact CB-O 3.27Å; S24-V315 PolarHBondContact N-O 3.13Å; S24-V315 PolarHBondContact OG-O 3.47Å; T26-V315 HydrophobicContact CG2-CG2 4.24Å; T26-V315 PolarHBondContact O-N 3.23Å; L28-V315 HydrophobicContact CD1-CG1 4.22Å; L33-V315 HydrophobicContact CD1-CG1 3.77Å; L33-V315 HydrophobicContact CG-CG1 4.24Å; V315-L319 HydrophobicContact CB-CD2 4.17Å; V315-L319 HydrophobicContact CG1-CD2 4.15Å; V315-L320 HydrophobicContact CG2-CD1 4.34Å; V315-L320 HydrophobicContact CG2-CD2 3.86Å; V315-L320 HydrophobicContact CG2-CG 4.13Å
316	P	95.3	Very high	87.9	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	143	166.6	-23.3	34.8	0	0	0	111	V21 W23 I42 E318 L319 L326	V21-P316 HydrophobicContact CG1-CB 3.83Å; V21-P316 HydrophobicContact CG1-CG 4.15Å; W23-P316 HydrophobicContact CE3-CG 4.42Å; W23-P316 HydrophobicContact CH2-CG 4.21Å; W23-P316 HydrophobicContact CZ3-CG 3.86Å; I42-P316 VanDerWaalsContact O-CD 3.29Å; I42-P316 WeakPolarHBondContact O-CD 3.48Å; I42-P316 WeakPolarHBondContact O-CG 3.42Å; P316-E318 VanDerWaalsContact CB-OE2 3.31Å; P316-E318 WeakPolarHBondContact CB-OE2 3.4Å; P316-E318 PolarHBondContact O-N 3.45Å; P316-L319 HydrophobicContact CB-CB 4.25Å; P316-L319 WeakPolarHBondContact O-CB 3.32Å; P316-L319 PolarHBondContact O-N 2.87Å; P316-L326 HydrophobicContact CB-CD1 4.35Å; P316-L326 HydrophobicContact CB-CD2 3.78Å; P316-L326 HydrophobicContact CG-CD1 4.26Å; P316-L326 HydrophobicContact CG-CD2 4.01Å
317	E	93.6	Very high	88.1	Confident	60 Å²	60	62 Å²	62	28%	0.28	32%	0.32	S	S	.	.	H	α-helix	trans	-63.2	-33.9	175	-179	59.4	-146.4	0	0	110.5	T22 S24 L319 L320 Q321	T22-E317 WeakPolarHBondContact O-CB 3.24Å; T22-E317 PolarHBondContact O-N 3.14Å; S24-E317 WeakPolarHBondContact CB-OE2 3.37Å; E317-L319 PolarHBondContact O-N 2.98Å; E317-L320 WeakPolarHBondContact O-CB 3.34Å; E317-L320 PolarHBondContact O-N 3.27Å; E317-Q321 WeakPolarHBondContact O-CG 3.43Å; E317-Q321 PolarHBondContact O-N 3.3Å; E317-Q321 VanDerWaalsContact O-N 3.15Å; E317-Q321 PolarHBondContact OE1-NE2 3.25Å
318	E	91.4	Very high	88.9	Confident	11 Å²	11	62.1 Å²	62.1	5%	0.051	33%	0.326	C	S	.	.	H	α-helix	trans	-73.4	-17.7	-179.1	-45.9	93.9	160.3	0	0	112.5	T22 P316 G322 E323 W325 L326	T22-E318 WeakPolarHBondContact CB-OE1 3.5Å; T22-E318 PolarHBondContact N-OE1 2.86Å; T22-E318 PolarHBondContact OG1-OE1 2.92Å; P316-E318 VanDerWaalsContact CB-OE2 3.31Å; P316-E318 WeakPolarHBondContact CB-OE2 3.4Å; P316-E318 PolarHBondContact O-N 3.45Å; E318-G322 PolarHBondContact O-N 3.1Å; E318-E323 HydrophobicContact CB-CB 3.91Å; E318-E323 HydrophobicContact CB-CG 4.07Å; E318-E323 PolarHBondContact O-N 3Å; E318-W325 HydrophobicContact CB-CZ2 4.14Å; E318-W325 HydrophobicContact CG-CH2 4.3Å; E318-W325 HydrophobicContact CG-CZ2 3.54Å; E318-W325 WeakPolarHBondContact OE1-CZ2 3.45Å; E318-L326 HydrophobicContact CB-CD2 4.41Å
319	L	91.3	Very high	90.5	Very high	29 Å²	29	53.8 Å²	53.8	15%	0.152	29%	0.285	C	S	.	.	H	α-helix	trans	-73.7	-29.3	169	-171.3	60.9	0	0	0	111.9	Y37 V315 P316 E317 L326	Y37-L319 HydrophobicContact CD1-CD1 4.02Å; Y37-L319 HydrophobicContact CD1-CD2 3.85Å; Y37-L319 HydrophobicContact CD1-CG 3.84Å; Y37-L319 HydrophobicContact CE1-CD1 4.34Å; Y37-L319 HydrophobicContact CE1-CD2 3.96Å; Y37-L319 HydrophobicContact CE1-CG 3.75Å; Y37-L319 HydrophobicContact CG-CD2 4.17Å; V315-L319 HydrophobicContact CB-CD2 4.17Å; V315-L319 HydrophobicContact CG1-CD2 4.15Å; P316-L319 HydrophobicContact CB-CB 4.25Å; P316-L319 WeakPolarHBondContact O-CB 3.32Å; P316-L319 PolarHBondContact O-N 2.87Å; E317-L319 PolarHBondContact O-N 2.98Å; L319-L326 HydrophobicContact CB-CD2 3.63Å; L319-L326 HydrophobicContact CD1-CD2 4.22Å; L319-L326 HydrophobicContact CG-CD2 4.47Å
320	L	90	Very high	91.2	Very high	70 Å²	70	51 Å²	51	37%	0.366	26%	0.261	S	S	.	.	H	α-helix	trans	-77	-32.4	174.4	-55.8	178.2	0	0	0	111.2	Y37 V315 E317	Y37-L320 WeakPolarHBondContact OH-CD2 3.4Å; V315-L320 HydrophobicContact CG2-CD1 4.34Å; V315-L320 HydrophobicContact CG2-CD2 3.86Å; V315-L320 HydrophobicContact CG2-CG 4.13Å; E317-L320 WeakPolarHBondContact O-CB 3.34Å; E317-L320 PolarHBondContact O-N 3.27Å
321	Q	89.5	Confident	91.5	Very high	123 Å²	123	55.3 Å²	55.3	58%	0.575	28%	0.28	S	S	*	.	H	α-helix	trans	-84.7	-21.5	180	-62.1	176.6	13.4	0	0	113	E317	E317-Q321 WeakPolarHBondContact O-CG 3.43Å; E317-Q321 PolarHBondContact O-N 3.3Å; E317-Q321 VanDerWaalsContact O-N 3.15Å; E317-Q321 PolarHBondContact OE1-NE2 3.25Å
322	G	85.8	Confident	91.6	Very high	62 Å²	62	61.6 Å²	61.6	64%	0.639	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.5	29.9	174.6	0	0	0	0	0	114.6	E318	E318-G322 PolarHBondContact O-N 3.1Å
323	E	89.5	Confident	91.6	Very high	90 Å²	90	57.2 Å²	57.2	42%	0.421	29%	0.285	S	S	.	.			trans	-74.1	125.7	-173.1	-78.6	-65.1	153	0	0	114.3	E318 W325 L326	E318-E323 HydrophobicContact CB-CB 3.91Å; E318-E323 HydrophobicContact CB-CG 4.07Å; E318-E323 PolarHBondContact O-N 3Å; E323-W325 PolarHBondContact O-N 3.48Å; E323-L326 PolarHBondContact O-N 2.98Å
324	L	87.8	Confident	91.6	Very high	130 Å²	130	59 Å²	59	68%	0.681	29%	0.294	S	S	*	.	H	α-helix	trans	-64.7	-23.3	-178.4	-72.9	160.4	0	0	0	114	L326 T328	L324-L326 VanDerWaalsContact C-N 3.33Å; L324-T328 PolarHBondContact O-N 3.28Å; L324-T328 PolarHBondContact O-OG1 3.37Å; L324-T328 VanDerWaalsContact O-OG1 3.1Å
325	W	88.6	Confident	91.4	Very high	101 Å²	101	60.5 Å²	60.5	38%	0.383	31%	0.305	S	S	.	.	H	α-helix	trans	-71.4	-31.2	178.1	73.9	-102.1	0	0	0	112	V21 E318 E323 T328 M329	V21-W325 HydrophobicContact CG2-CH2 4.2Å; V21-W325 HydrophobicContact CG2-CZ3 4.28Å; E318-W325 HydrophobicContact CB-CZ2 4.14Å; E318-W325 HydrophobicContact CG-CH2 4.3Å; E318-W325 HydrophobicContact CG-CZ2 3.54Å; E318-W325 WeakPolarHBondContact OE1-CZ2 3.45Å; E323-W325 PolarHBondContact O-N 3.48Å; W325-T328 WeakPolarHBondContact O-CB 3.48Å; W325-T328 PolarHBondContact O-N 3.02Å; W325-M329 HydrophobicContact CE3-CE 4.13Å; W325-M329 HydrophobicContact CZ3-CE 3.6Å; W325-M329 HydrophobicContact CZ3-SD 4.26Å; W325-M329 PolarHBondContact O-N 3.46Å
326	L	90.5	Very high	91.2	Very high	4 Å²	4	61.8 Å²	61.8	2%	0.021	31%	0.311	C	S	.	.	H	α-helix	trans	-67.7	-43.4	177	-179	65.2	0	0	0	110.7	P316 E318 L319 E323 L324 T328 M329 V330	P316-L326 HydrophobicContact CB-CD1 4.35Å; P316-L326 HydrophobicContact CB-CD2 3.78Å; P316-L326 HydrophobicContact CG-CD1 4.26Å; P316-L326 HydrophobicContact CG-CD2 4.01Å; E318-L326 HydrophobicContact CB-CD2 4.41Å; L319-L326 HydrophobicContact CB-CD2 3.63Å; L319-L326 HydrophobicContact CD1-CD2 4.22Å; L319-L326 HydrophobicContact CG-CD2 4.47Å; E323-L326 PolarHBondContact O-N 2.98Å; L324-L326 VanDerWaalsContact C-N 3.33Å; L326-T328 VanDerWaalsContact C-N 3.25Å; L326-T328 PolarHBondContact O-N 3.08Å; L326-M329 WeakPolarHBondContact O-CB 3.5Å; L326-M329 PolarHBondContact O-N 2.97Å; L326-V330 HydrophobicContact CD1-CG2 4.36Å; L326-V330 HydrophobicContact CG-CG2 4.32Å; L326-V330 VanDerWaalsContact O-CG2 3.28Å; L326-V330 WeakPolarHBondContact O-CG2 3.37Å; L326-V330 PolarHBondContact O-N 2.89Å
327	E	90.1	Very high	91	Very high	137 Å²	137	61.8 Å²	61.8	64%	0.64	31%	0.311	S	S	*	.	H	α-helix	trans	-57.4	-40.7	173.5	-175	172.3	-154.9	0	0	111.2	M329 V330 H331	E327-M329 PolarHBondContact O-N 2.8Å; E327-V330 PolarHBondContact O-N 3.2Å; E327-H331 WeakPolarHBondContact O-CB 3.24Å; E327-H331 PolarHBondContact O-N 2.88Å
328	T	92.1	Very high	90.9	Very high	73 Å²	73	64.3 Å²	64.3	45%	0.448	32%	0.323	S	S	.	.	H	α-helix	trans	-63.1	-39.1	174.4	-57	0	0	0	0	112.4	L324 W325 L326 R332	L324-T328 PolarHBondContact O-N 3.28Å; L324-T328 PolarHBondContact O-OG1 3.37Å; L324-T328 VanDerWaalsContact O-OG1 3.1Å; W325-T328 WeakPolarHBondContact O-CB 3.48Å; W325-T328 PolarHBondContact O-N 3.02Å; L326-T328 VanDerWaalsContact C-N 3.25Å; L326-T328 PolarHBondContact O-N 3.08Å; T328-R332 WeakPolarHBondContact O-CG 3.06Å; T328-R332 PolarHBondContact O-N 3.28Å; T328-R332 VanDerWaalsContact O-N 3.16Å
329	M	91.8	Very high	90.7	Very high	22 Å²	22	70.3 Å²	70.3	11%	0.108	35%	0.351	C	S	.	.	H	α-helix	trans	-69.2	-45	176.1	-177.3	176.1	-64.7	0	0	112.1	N17 L18 V21 W325 L326 E327 H331 R332 W333	N17-M329 HydrophobicContact CB-CE 3.79Å; N17-M329 HydrophobicContact CB-SD 4.42Å; L18-M329 HydrophobicContact CD2-SD 4.19Å; V21-M329 HydrophobicContact CG2-CE 4.27Å; V21-M329 HydrophobicContact CG2-SD 3.68Å; W325-M329 HydrophobicContact CE3-CE 4.13Å; W325-M329 HydrophobicContact CZ3-CE 3.6Å; W325-M329 HydrophobicContact CZ3-SD 4.26Å; W325-M329 PolarHBondContact O-N 3.46Å; L326-M329 WeakPolarHBondContact O-CB 3.5Å; L326-M329 PolarHBondContact O-N 2.97Å; E327-M329 PolarHBondContact O-N 2.8Å; M329-H331 VanDerWaalsContact C-N 3.31Å; M329-H331 PolarHBondContact O-N 3.13Å; M329-R332 PolarHBondContact O-N 2.87Å; M329-W333 PolarHBondContact O-N 2.88Å
330	V	94.4	Very high	90.5	Very high	7 Å²	7	75 Å²	75	4%	0.042	37%	0.372	C	S	.	.	H	α-helix	trans	-58.5	-43.8	175.5	172	0	0	0	0	110.4	P40 I42 L61 L326 E327 W333 F334	P40-V330 HydrophobicContact CB-CG1 4.26Å; P40-V330 HydrophobicContact CG-CG1 3.96Å; P40-V330 WeakPolarHBondContact O-CG1 3.23Å; I42-V330 HydrophobicContact CB-CG2 4.06Å; I42-V330 HydrophobicContact CD1-CB 4.31Å; I42-V330 HydrophobicContact CD1-CG2 3.83Å; I42-V330 HydrophobicContact CG1-CG2 3.87Å; L61-V330 HydrophobicContact CD1-CG1 4.17Å; L326-V330 HydrophobicContact CD1-CG2 4.36Å; L326-V330 HydrophobicContact CG-CG2 4.32Å; L326-V330 VanDerWaalsContact O-CG2 3.28Å; L326-V330 WeakPolarHBondContact O-CG2 3.37Å; L326-V330 PolarHBondContact O-N 2.89Å; E327-V330 PolarHBondContact O-N 3.2Å; V330-W333 PolarHBondContact O-N 2.8Å; V330-F334 WeakPolarHBondContact O-CB 3.35Å; V330-F334 PolarHBondContact O-N 2.94Å
331	H	93.4	Very high	90.5	Very high	117 Å²	117	72 Å²	72	54%	0.542	36%	0.356	S	S	.	.	H	α-helix	trans	-64.7	-41.9	178.2	-167.8	75	0	0	0	112.7	E327 M329 W333 F334 S335	E327-H331 WeakPolarHBondContact O-CB 3.24Å; E327-H331 PolarHBondContact O-N 2.88Å; M329-H331 VanDerWaalsContact C-N 3.31Å; M329-H331 PolarHBondContact O-N 3.13Å; H331-W333 PolarHBondContact O-N 2.83Å; H331-F334 PolarHBondContact O-N 2.67Å; H331-S335 PolarHBondContact O-N 2.98Å; H331-S335 PolarHBondContact O-OG 3.18Å
332	R	92.4	Very high	90.6	Very high	146 Å²	146	69.8 Å²	69.8	55%	0.551	35%	0.348	S	S	*	.	H	α-helix	trans	-59.9	-44.4	174.3	-72.9	171.7	-177.1	-177.9	2.4	112.2	L14 T328 M329 F336	L14-R332 HydrophobicContact CD2-CB 4.09Å; T328-R332 WeakPolarHBondContact O-CG 3.06Å; T328-R332 PolarHBondContact O-N 3.28Å; T328-R332 VanDerWaalsContact O-N 3.16Å; M329-R332 PolarHBondContact O-N 2.87Å; R332-F336 WeakPolarHBondContact O-CB 3.34Å; R332-F336 PolarHBondContact O-N 3.37Å
333	W	92.1	Very high	90.9	Very high	2 Å²	2	67.6 Å²	67.6	1%	0.008	32%	0.321	C	S	.	.	H	α-helix	trans	-64.8	-38.8	175.8	-93	113.4	0	0	0	113.1	L14 L18 I42 L294 M329 V330 H331 F336 C337	L14-W333 HydrophobicContact CB-CD2 4.17Å; L14-W333 HydrophobicContact CB-CE3 4.5Å; L14-W333 HydrophobicContact CB-CH2 3.94Å; L14-W333 HydrophobicContact CB-CZ2 3.56Å; L14-W333 HydrophobicContact CB-CZ3 4.38Å; L14-W333 HydrophobicContact CD1-CD2 4.5Å; L14-W333 HydrophobicContact CD1-CE3 4.46Å; L14-W333 WeakPolarHBondContact O-CZ2 3.28Å; L18-W333 HydrophobicContact CD1-CH2 4.43Å; L18-W333 HydrophobicContact CD1-CZ2 3.48Å; L18-W333 VanDerWaalsContact CD1-CZ2 3.48Å; L18-W333 HydrophobicContact CG-CZ2 3.97Å; I42-W333 HydrophobicContact CD1-CB 3.92Å; I42-W333 VanDerWaalsContact CD1-CD1 3.43Å; I42-W333 HydrophobicContact CD1-CG 3.85Å; L294-W333 HydrophobicContact CB-CH2 4.12Å; L294-W333 HydrophobicContact CB-CZ2 4.49Å; L294-W333 HydrophobicContact CB-CZ3 4.24Å; L294-W333 HydrophobicContact CD1-CD2 3.8Å; L294-W333 HydrophobicContact CD1-CE3 3.96Å; L294-W333 HydrophobicContact CD1-CG 4.23Å; L294-W333 HydrophobicContact CD1-CH2 4.39Å; L294-W333 HydrophobicContact CD1-CZ2 4.22Å; L294-W333 HydrophobicContact CD1-CZ3 4.27Å; L294-W333 HydrophobicContact CD2-CD2 4.46Å; L294-W333 HydrophobicContact CD2-CE3 3.78Å; L294-W333 HydrophobicContact CD2-CZ3 3.85Å; L294-W333 HydrophobicContact CG-CE3 4.36Å; L294-W333 HydrophobicContact CG-CZ3 4.34Å; M329-W333 PolarHBondContact O-N 2.88Å; V330-W333 PolarHBondContact O-N 2.8Å; H331-W333 PolarHBondContact O-N 2.83Å; W333-F336 AromaticContact CE3-CD1 3.92Å; W333-F336 HydrophobicContact CE3-CD1 3.92Å; W333-F336 AromaticContact CZ3-CD1 3.73Å; W333-F336 HydrophobicContact CZ3-CD1 3.73Å; W333-F336 HydrophobicContact CZ3-CE1 4.01Å; W333-F336 PolarHBondContact O-N 2.73Å; W333-C337 WeakPolarHBondContact O-CB 3.27Å; W333-C337 PolarHBondContact O-N 3.01Å; W333-C337 PolarHBondContact O-SG 2.89Å
334	F	93.3	Very high	91.1	Very high	39 Å²	39	67 Å²	67	17%	0.171	32%	0.321	C	S	.	.	H	α-helix	trans	-64	-45.3	176.8	-179.9	-118.9	0	0	0	111.9	P40 L61 H63 V330 H331 C337 Q338	P40-F334 HydrophobicContact CB-CD2 3.93Å; P40-F334 HydrophobicContact CB-CE2 4.29Å; P40-F334 HydrophobicContact CB-CG 4.39Å; P40-F334 HydrophobicContact CG-CB 4.06Å; P40-F334 HydrophobicContact CG-CD1 4.18Å; P40-F334 HydrophobicContact CG-CD2 3.75Å; P40-F334 HydrophobicContact CG-CE2 4.11Å; P40-F334 HydrophobicContact CG-CG 3.77Å; P40-F334 HydrophobicContact CG-CZ 4.48Å; L61-F334 HydrophobicContact CD2-CB 4.25Å; L61-F334 HydrophobicContact CD2-CD2 4.3Å; H63-F334 AromaticContact CD2-CE2 3.74Å; H63-F334 AromaticContact CE1-CE2 3.75Å; H63-F334 AromaticContact NE2-CE2 3.49Å; H63-F334 WeakPolarHBondContact NE2-CE2 3.34Å; V330-F334 WeakPolarHBondContact O-CB 3.35Å; V330-F334 PolarHBondContact O-N 2.94Å; H331-F334 PolarHBondContact O-N 2.67Å; F334-C337 WeakPolarHBondContact O-CB 3.42Å; F334-C337 PolarHBondContact O-N 2.87Å; F334-Q338 PolarHBondContact O-N 2.63Å
335	S	91.9	Very high	91.3	Very high	47 Å²	47	62 Å²	62	33%	0.329	30%	0.295	S	S	.	.	H	α-helix	trans	-62.1	-46.8	174.2	-57.2	0	0	0	0	112.1	H331 C337 Q338 E339	H331-S335 PolarHBondContact O-N 2.98Å; H331-S335 PolarHBondContact O-OG 3.18Å; S335-C337 PolarHBondContact O-N 3.4Å; S335-Q338 PolarHBondContact O-N 2.71Å; S335-Q338 VanDerWaalsContact O-N 3.1Å; S335-E339 PolarHBondContact O-N 3.01Å
336	F	90.8	Very high	91.6	Very high	27 Å²	27	58 Å²	58	12%	0.118	28%	0.28	C	S	.	.	H	α-helix	trans	-61.7	-30.1	175.3	-179.5	-110.3	0	0	0	112.8	L10 L14 I299 R332 W333	L10-F336 HydrophobicContact CB-CE2 4.29Å; L10-F336 HydrophobicContact CD2-CD2 3.96Å; L10-F336 HydrophobicContact CD2-CE2 4.37Å; L10-F336 HydrophobicContact CG-CD2 4.18Å; L10-F336 HydrophobicContact CG-CE2 4.34Å; L14-F336 HydrophobicContact CD1-CB 3.69Å; L14-F336 HydrophobicContact CD1-CD1 3.89Å; L14-F336 HydrophobicContact CD1-CD2 4.27Å; L14-F336 HydrophobicContact CD1-CG 3.68Å; I299-F336 HydrophobicContact CD1-CD1 3.82Å; I299-F336 HydrophobicContact CD1-CE1 3.75Å; I299-F336 HydrophobicContact CG1-CE1 4.39Å; R332-F336 WeakPolarHBondContact O-CB 3.34Å; R332-F336 PolarHBondContact O-N 3.37Å; W333-F336 AromaticContact CE3-CD1 3.92Å; W333-F336 HydrophobicContact CE3-CD1 3.92Å; W333-F336 AromaticContact CZ3-CD1 3.73Å; W333-F336 HydrophobicContact CZ3-CD1 3.73Å; W333-F336 HydrophobicContact CZ3-CE1 4.01Å; W333-F336 PolarHBondContact O-N 2.73Å
337	C	91.3	Very high	91.7	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-69.6	-44.6	171.2	-70.2	0	0	0	0	112.4	L61 I299 W333 F334 S335 E339 Q340 F341	L61-C337 HydrophobicContact CD2-CB 4.16Å; I299-C337 HydrophobicContact CD1-CB 4.36Å; W333-C337 WeakPolarHBondContact O-CB 3.27Å; W333-C337 PolarHBondContact O-N 3.01Å; W333-C337 PolarHBondContact O-SG 2.89Å; F334-C337 WeakPolarHBondContact O-CB 3.42Å; F334-C337 PolarHBondContact O-N 2.87Å; S335-C337 PolarHBondContact O-N 3.4Å; C337-E339 PolarHBondContact O-N 2.78Å; C337-Q340 CarbonylContact O-C 3.57Å; C337-Q340 PolarHBondContact O-N 3.45Å; C337-F341 WeakPolarHBondContact O-CB 3.22Å; C337-F341 PolarHBondContact O-N 3.32Å
338	Q	90.3	Very high	91.8	Very high	113 Å²	113	54.9 Å²	54.9	53%	0.528	27%	0.265	S	S	.	.	H	α-helix	trans	-60.3	-32.9	-179.8	-71.5	-176.9	26	0	0	113.2	F334 S335 Q340	F334-Q338 PolarHBondContact O-N 2.63Å; S335-Q338 PolarHBondContact O-N 2.71Å; S335-Q338 VanDerWaalsContact O-N 3.1Å; Q338-Q340 PolarHBondContact O-N 2.99Å
339	E	88.4	Confident	91.9	Very high	137 Å²	137	51.4 Å²	51.4	64%	0.64	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-18.8	175.1	-68.5	177.8	-177.8	0	0	113.9	S335 C337	S335-E339 PolarHBondContact O-N 3.01Å; C337-E339 PolarHBondContact O-N 2.78Å
340	Q	86.1	Confident	92	Very high	127 Å²	127	50.3 Å²	50.3	59%	0.593	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-122.9	-7.1	-172	-59.5	-63.7	-40	0	0	113.7	I299 C337 Q338	I299-Q340 HydrophobicContact CD1-CB 4.13Å; I299-Q340 HydrophobicContact CD1-CG 4.41Å; C337-Q340 CarbonylContact O-C 3.57Å; C337-Q340 PolarHBondContact O-N 3.45Å; Q338-Q340 PolarHBondContact O-N 2.99Å
341	F	90.3	Very high	91.9	Very high	7 Å²	7	50.7 Å²	50.7	3%	0.031	24%	0.239	C	C	.	.			trans	-149.3	107.3	-171	170	-113.6	0	0	0	111.6	V290 C292 P301 C337 I343 Y346	V290-F341 HydrophobicContact CG1-CE1 4.21Å; V290-F341 HydrophobicContact CG1-CZ 3.85Å; C292-F341 VanDerWaalsContact SG-CD1 3.52Å; P301-F341 HydrophobicContact CB-CD2 3.66Å; P301-F341 HydrophobicContact CB-CE2 3.19Å; P301-F341 HydrophobicContact CB-CZ 3.76Å; P301-F341 HydrophobicContact CG-CD2 3.95Å; P301-F341 HydrophobicContact CG-CE2 3.8Å; C337-F341 WeakPolarHBondContact O-CB 3.22Å; C337-F341 PolarHBondContact O-N 3.32Å; F341-I343 HydrophobicContact CD1-CB 4.39Å; F341-I343 HydrophobicContact CE1-CB 3.65Å; F341-I343 HydrophobicContact CE1-CD1 4.41Å; F341-I343 HydrophobicContact CE1-CG1 4.14Å; F341-I343 HydrophobicContact CZ-CB 3.94Å; F341-I343 HydrophobicContact CZ-CG1 4.18Å; F341-I343 PolarHBondContact O-N 3.22Å; F341-Y346 VanDerWaalsContact CE2-CB 3.44Å; F341-Y346 HydrophobicContact CE2-CD1 4.12Å; F341-Y346 HydrophobicContact CE2-CD2 4.05Å; F341-Y346 AromaticContact CE2-CG 3.63Å; F341-Y346 HydrophobicContact CE2-CG 3.63Å; F341-Y346 HydrophobicContact CZ-CD1 4.02Å; F341-Y346 AromaticContact CZ-CG 4Å; F341-Y346 HydrophobicContact CZ-CG 4Å
342	D	91.9	Very high	91.8	Very high	78 Å²	78	47.9 Å²	47.9	42%	0.417	23%	0.228	S	C	.	.			trans	-81.9	110.7	164.6	179.6	-5.6	0	0	0	109.3	D344 D345 Y346 R348	D342-D344 VanDerWaalsContact C-N 3.34Å; D342-D344 WeakPolarHBondContact OD1-CA 3.48Å; D342-D344 WeakPolarHBondContact OD1-CB 3.4Å; D342-D344 PolarHBondContact OD1-N 3.13Å; D342-D345 HydrophobicContact CB-CB 3.67Å; D342-D345 VanDerWaalsContact CG-CB 3.5Å; D342-D345 PolarHBondContact O-N 3.34Å; D342-D345 PolarHBondContact OD1-N 2.89Å; D342-D345 WeakPolarHBondContact OD2-CB 3.4Å; D342-Y346 PolarHBondContact O-N 2.81Å; D342-R348 IonicContact OD2-NH2 2.71Å
343	I	92.5	Very high	91.3	Very high	15 Å²	15	42.5 Å²	42.5	8%	0.077	21%	0.211	C	C	.	.	H	α-helix	trans	-68.9	-29.2	177.1	-177.2	161.7	0	0	0	113.4	H63 S64 V290 F341 S347	H63-I343 VanDerWaalsContact ND1-CD1 3.28Å; H63-I343 WeakPolarHBondContact ND1-CD1 3.45Å; S64-I343 WeakPolarHBondContact OG-CD1 3.45Å; V290-I343 HydrophobicContact CB-CD1 3.77Å; V290-I343 HydrophobicContact CB-CG1 4.48Å; V290-I343 HydrophobicContact CG1-CD1 3.73Å; V290-I343 HydrophobicContact CG1-CG1 4.09Å; V290-I343 HydrophobicContact CG2-CD1 4.07Å; V290-I343 HydrophobicContact CG2-CG1 4.47Å; F341-I343 HydrophobicContact CD1-CB 4.39Å; F341-I343 HydrophobicContact CE1-CB 3.65Å; F341-I343 HydrophobicContact CE1-CD1 4.41Å; F341-I343 HydrophobicContact CE1-CG1 4.14Å; F341-I343 HydrophobicContact CZ-CB 3.94Å; F341-I343 HydrophobicContact CZ-CG1 4.18Å; F341-I343 PolarHBondContact O-N 3.22Å; I343-S347 WeakPolarHBondContact O-CB 3.41Å; I343-S347 PolarHBondContact O-N 3.23Å; I343-S347 PolarHBondContact O-OG 3.22Å
344	D	92.6	Very high	90.2	Very high	77 Å²	77	49 Å²	49	41%	0.412	24%	0.235	S	C	.	.	H	α-helix	trans	-75.6	-37.6	177.1	-66	-13.1	0	0	0	109.4	R66 D342 S347 R348	R66-D344 IonicContact CZ-OD1 3.7Å; R66-D344 VanDerWaalsContact CZ-OD1 3.23Å; R66-D344 IonicContact NH1-OD1 3.74Å; R66-D344 PolarHBondContact NH1-OD1 3.34Å; R66-D344 IonicContact NH2-OD1 2.82Å; R66-D344 PolarHBondContact NH2-OD1 2.88Å; D342-D344 VanDerWaalsContact C-N 3.34Å; D342-D344 WeakPolarHBondContact OD1-CA 3.48Å; D342-D344 WeakPolarHBondContact OD1-CB 3.4Å; D342-D344 PolarHBondContact OD1-N 3.13Å; D344-S347 WeakPolarHBondContact O-CB 3.47Å; D344-S347 PolarHBondContact O-N 2.72Å; D344-R348 WeakPolarHBondContact O-CG 3.4Å; D344-R348 PolarHBondContact O-N 3.19Å; D344-R348 PolarHBondContact O-NH1 3.03Å
345	D	93.1	Very high	88.2	Confident	26 Å²	26	51.7 Å²	51.7	14%	0.139	27%	0.266	C	S	.	.	H	α-helix	trans	-58.9	-51.4	169.6	-167	49.7	0	0	0	112.1	N265 Q266 Y267 D342 S347 R348 A349	N265-D345 VanDerWaalsContact ND2-CG 3.33Å; N265-D345 PolarHBondContact ND2-O 3Å; N265-D345 PolarHBondContact ND2-OD1 3.31Å; Q266-D345 PolarHBondContact NE2-OD2 3.46Å; Y267-D345 HydrophobicContact CE2-CB 4.43Å; Y267-D345 WeakPolarHBondContact CE2-OD2 3.39Å; D342-D345 HydrophobicContact CB-CB 3.67Å; D342-D345 VanDerWaalsContact CG-CB 3.5Å; D342-D345 PolarHBondContact O-N 3.34Å; D342-D345 PolarHBondContact OD1-N 2.89Å; D342-D345 WeakPolarHBondContact OD2-CB 3.4Å; D345-S347 PolarHBondContact O-N 2.76Å; D345-R348 VanDerWaalsContact CA-NH2 3.26Å; D345-R348 PolarHBondContact O-N 3.06Å; D345-R348 IonicContact OD1-CZ 2.68Å; D345-R348 IonicContact OD1-NH2 2.7Å; D345-R348 PolarHBondContact OD1-NH2 2.66Å; D345-A349 PolarHBondContact O-N 2.76Å
346	Y	94	Very high	86	Confident	18 Å²	18	55.6 Å²	55.6	7%	0.071	28%	0.282	C	S	.	.	H	α-helix	trans	-58.7	-32.9	173.3	-174.7	-104.9	0	0	0	113.1	W68 Y267 V290 P301 T302 H303 F341 D342 R348 R351	W68-Y346 HydrophobicContact CH2-CD1 4.09Å; W68-Y346 AromaticContact CH2-CE1 3.81Å; W68-Y346 HydrophobicContact CH2-CE1 3.81Å; W68-Y346 HydrophobicContact CZ2-CD1 4.1Å; W68-Y346 HydrophobicContact CZ2-CE1 4.22Å; Y267-Y346 AromaticContact CD1-CD2 3.95Å; Y267-Y346 HydrophobicContact CD1-CD2 3.95Å; Y267-Y346 HydrophobicContact CD1-CE2 4.48Å; Y267-Y346 AromaticContact CD2-CD2 3.84Å; Y267-Y346 HydrophobicContact CD2-CD2 3.84Å; Y267-Y346 HydrophobicContact CD2-CG 4.37Å; Y267-Y346 HydrophobicContact CE1-CD2 4.48Å; Y267-Y346 HydrophobicContact CE2-CD2 4.35Å; Y267-Y346 AromaticContact CG-CD2 3.6Å; Y267-Y346 HydrophobicContact CG-CD2 3.6Å; Y267-Y346 HydrophobicContact CG-CE2 4.38Å; V290-Y346 HydrophobicContact CG1-CD1 4.12Å; V290-Y346 HydrophobicContact CG1-CE1 4.18Å; P301-Y346 HydrophobicContact CB-CD2 3.92Å; P301-Y346 HydrophobicContact CB-CE1 4.44Å; P301-Y346 HydrophobicContact CB-CE2 3.74Å; P301-Y346 HydrophobicContact CB-CG 4.35Å; P301-Y346 HydrophobicContact CG-CD2 3.85Å; P301-Y346 HydrophobicContact CG-CE2 3.73Å; P301-Y346 PolarHBondContact O-OH 2.99Å; T302-Y346 WeakPolarHBondContact CA-OH 3.4Å; H303-Y346 HydrophobicContact CB-CE1 4.17Å; H303-Y346 AromaticContact ND1-CE1 4Å; H303-Y346 AromaticContact ND1-CZ 3.8Å; H303-Y346 PolarHBondContact ND1-OH 2.92Å; F341-Y346 VanDerWaalsContact CE2-CB 3.44Å; F341-Y346 HydrophobicContact CE2-CD1 4.12Å; F341-Y346 HydrophobicContact CE2-CD2 4.05Å; F341-Y346 AromaticContact CE2-CG 3.63Å; F341-Y346 HydrophobicContact CE2-CG 3.63Å; F341-Y346 HydrophobicContact CZ-CD1 4.02Å; F341-Y346 AromaticContact CZ-CG 4Å; F341-Y346 HydrophobicContact CZ-CG 4Å; D342-Y346 PolarHBondContact O-N 2.81Å; Y346-R348 VanDerWaalsContact C-N 3.32Å; Y346-R351 PolarHBondContact O-NH1 2.8Å; Y346-R351 VanDerWaalsContact O-NH1 3.12Å; Y346-R351 PolarHBondContact O-NH2 2.9Å
347	S	92.9	Very high	83.9	Confident	17 Å²	17	61 Å²	61	12%	0.119	30%	0.302	C	S	.	.	H	α-helix	trans	-72.2	-22.5	175.3	-59.5	0	0	0	0	113.1	W68 P90 I343 D344 D345	W68-S347 PolarHBondContact NE1-OG 3.07Å; P90-S347 WeakPolarHBondContact CB-O 3.2Å; P90-S347 WeakPolarHBondContact CG-O 3.13Å; I343-S347 WeakPolarHBondContact O-CB 3.41Å; I343-S347 PolarHBondContact O-N 3.23Å; I343-S347 PolarHBondContact O-OG 3.22Å; D344-S347 WeakPolarHBondContact O-CB 3.47Å; D344-S347 PolarHBondContact O-N 2.72Å; D345-S347 PolarHBondContact O-N 2.76Å
348	R	93.5	Very high	81.1	Confident	57 Å²	57	68.4 Å²	68.4	22%	0.215	34%	0.342	C	S	.	.	H	α-helix	trans	-83.8	-17.3	176.6	-69.4	-174	-59.2	-83	0.6	114.1	P90 H92 E94 D342 D344 D345 Y346	P90-R348 WeakPolarHBondContact CG-O 3.48Å; H92-R348 HydrophobicContact CB-CG 4.08Å; H92-R348 WeakPolarHBondContact O-CD 3.49Å; H92-R348 WeakPolarHBondContact O-CG 3.36Å; E94-R348 VanDerWaalsContact OE1-CD 3.3Å; E94-R348 WeakPolarHBondContact OE1-CD 3.13Å; E94-R348 IonicContact OE1-CZ 3.86Å; E94-R348 IonicContact OE1-NE 3.99Å; E94-R348 PolarHBondContact OE1-NE 3.21Å; E94-R348 VanDerWaalsContact OE1-NE 3.14Å; D342-R348 IonicContact OD2-NH2 2.71Å; D344-R348 WeakPolarHBondContact O-CG 3.4Å; D344-R348 PolarHBondContact O-N 3.19Å; D344-R348 PolarHBondContact O-NH1 3.03Å; D345-R348 VanDerWaalsContact CA-NH2 3.26Å; D345-R348 PolarHBondContact O-N 3.06Å; D345-R348 IonicContact OD1-CZ 2.68Å; D345-R348 IonicContact OD1-NH2 2.7Å; D345-R348 PolarHBondContact OD1-NH2 2.66Å; Y346-R348 VanDerWaalsContact C-N 3.32Å
349	A	93.9	Very high	78.1	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.357	C	S	.	.			trans	-66.6	144	-174.8	0	0	0	0	0	115.5	P90 N265 D268 D345 R351	P90-A349 WeakPolarHBondContact CD-O 3.48Å; P90-A349 WeakPolarHBondContact CG-O 3.43Å; N265-A349 HydrophobicContact CB-CB 4.11Å; D268-A349 WeakPolarHBondContact OD1-CA 3.36Å; D345-A349 PolarHBondContact O-N 2.76Å; A349-R351 PolarHBondContact O-NH1 2.77Å
350	V	93.7	Very high	75.5	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	37%	0.371	C	S	.	.			trans	-81.8	137.5	179.5	-172.7	0	0	0	0	110.8	I87 I89 Y93 D268 L269 H270 I272	I87-V350 HydrophobicContact CD1-CG1 4.22Å; I89-V350 HydrophobicContact CG1-CG1 4.24Å; I89-V350 HydrophobicContact CG2-CG2 4.34Å; Y93-V350 HydrophobicContact CD2-CG2 3.64Å; Y93-V350 HydrophobicContact CE2-CG2 3.54Å; Y93-V350 HydrophobicContact CG-CG2 4.3Å; D268-V350 PolarHBondContact OD1-N 3.16Å; L269-V350 PolarHBondContact N-O 3.42Å; H270-V350 HydrophobicContact CB-CG1 4.3Å; I272-V350 HydrophobicContact CD1-CG1 4.14Å; I272-V350 HydrophobicContact CD1-CG2 3.77Å; I272-V350 HydrophobicContact CG1-CG1 4.2Å; I272-V350 HydrophobicContact CG1-CG2 4.18Å
351	R	92.1	Very high	72.7	Confident	14 Å²	14	70 Å²	70	5%	0.053	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	148.4	-171.9	-68	167.3	170.3	79.7	5	111.3	W68 I87 E88 L269 H303 Y346 A349	W68-R351 VanDerWaalsContact CZ3-CZ 3.47Å; I87-R351 CarbonylContact C-O 3.32Å; I87-R351 WeakPolarHBondContact CA-O 3.46Å; E88-R351 PolarHBondContact N-O 3.28Å; E88-R351 PolarHBondContact O-N 2.94Å; L269-R351 HydrophobicContact CD1-CB 4.48Å; L269-R351 HydrophobicContact CD1-CG 4.38Å; H303-R351 PolarHBondContact CE1-NE 2.85Å; H303-R351 VanDerWaalsContact CE1-NE 3.34Å; Y346-R351 PolarHBondContact O-NH1 2.8Å; Y346-R351 VanDerWaalsContact O-NH1 3.12Å; Y346-R351 PolarHBondContact O-NH2 2.9Å; A349-R351 PolarHBondContact O-NH1 2.77Å
352	D	89.9	Confident	69.8	Low	59 Å²	59	74.7 Å²	74.7	32%	0.316	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	147.6	165.7	-62.6	-59.1	0	0	0	110.7	R354	D352-R354 PolarHBondContact O-N 2.7Å
353	V	83.8	Confident	66.6	Low	33 Å²	33	76.3 Å²	76.3	20%	0.2	42%	0.42	C	S	.	.			trans	-79.4	115.6	169.2	176	0	0	0	0	109.3	K86 E88 A355	K86-V353 HydrophobicContact CB-CB 4.31Å; K86-V353 HydrophobicContact CB-CG2 4.49Å; K86-V353 HydrophobicContact CD-CB 4.04Å; K86-V353 HydrophobicContact CD-CG1 3.97Å; K86-V353 HydrophobicContact CD-CG2 4.12Å; K86-V353 HydrophobicContact CG-CB 4Å; K86-V353 HydrophobicContact CG-CG1 4.48Å; K86-V353 HydrophobicContact CG-CG2 3.8Å; K86-V353 WeakPolarHBondContact O-CB 3.48Å; K86-V353 PolarHBondContact O-N 3.02Å; E88-V353 HydrophobicContact CB-CG2 4.46Å; E88-V353 HydrophobicContact CG-CG2 3.8Å; V353-A355 PolarHBondContact O-N 2.81Å
354	R	68.7	Low	63.8	Low	137 Å²	137	81.2 Å²	81.2	52%	0.517	45%	0.453	S	S	.	.			trans	-53.5	127.3	171	-68.7	171.1	165.8	-78.4	-11.5	109.9	E52 D352 D356	E52-R354 IonicContact OE2-CZ 3.97Å; E52-R354 IonicContact OE2-NH1 2.67Å; E52-R354 PolarHBondContact OE2-NH1 2.94Å; E52-R354 IonicContact OE2-NH2 3.25Å; E52-R354 PolarHBondContact OE2-NH2 3.18Å; D352-R354 PolarHBondContact O-N 2.7Å; R354-D356 PolarHBondContact O-N 3Å; R354-D356 VanDerWaalsContact O-N 3.11Å
355	A	50.5	Low	60.9	Low	97 Å²	97	87.4 Å²	87.4	80%	0.802	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-17.8	-168.7	0	0	0	0	0	114.7	V353 W357	V353-A355 PolarHBondContact O-N 2.81Å; A355-W357 VanDerWaalsContact C-N 3.25Å; A355-W357 PolarHBondContact O-N 3.05Å; A355-W357 VanDerWaalsContact O-N 3.09Å
356	D	45.2	Very low	57.9	Low	128 Å²	128	96.3 Å²	96.3	68%	0.684	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	15.8	-164.2	-42.3	-64.5	0	0	0	115.4	R354	R354-D356 PolarHBondContact O-N 3Å; R354-D356 VanDerWaalsContact O-N 3.11Å
357	W	47.4	Very low	54.6	Low	142 Å²	142	100.8 Å²	100.8	54%	0.538	55%	0.547	S	S	.	.	S	Bend	trans	-122.5	95.2	-170.3	-68.1	94.8	0	0	0	113.9	H307 A355	H307-W357 HydrophobicContact CB-CH2 4.47Å; H307-W357 AromaticContact CD2-CH2 3.31Å; H307-W357 WeakPolarHBondContact CD2-CH2 3.44Å; H307-W357 AromaticContact CD2-CZ2 3.18Å; H307-W357 WeakPolarHBondContact CD2-CZ2 3.37Å; H307-W357 AromaticContact NE2-CZ2 3.49Å; H307-W357 WeakPolarHBondContact NE2-CZ2 3.46Å; A355-W357 VanDerWaalsContact C-N 3.25Å; A355-W357 PolarHBondContact O-N 3.05Å; A355-W357 VanDerWaalsContact O-N 3.09Å
358	N	32.3	Very low	51.6	Low	155 Å²	155	106.3 Å²	106.3	83%	0.829	59%	0.586	S	S	*	*	S	Bend	trans	72.8	94	174.1	-73.5	6.9	0	0	0	118.5
359	E	26.6	Very low	48.3	Very low	183 Å²	183	107 Å²	107	86%	0.855	61%	0.612	S	S	*	*				-157.8	99.5	127.3	-107.2	-72.9	110.5	0	0	107.3	G361	E359-G361 PolarHBondContact O-N 2.65Å
360	D	33.8	Very low	45.3	Very low	174 Å²	174	115.5 Å²	115.5	93%	0.93	66%	0.657	S	S	*	*			trans	-85.8	67	-175.5	-150.2	-10.8	0	0	0	110.3
361	G	28.9	Very low	42.2	Very low	52 Å²	52	119.2 Å²	119.2	54%	0.536	70%	0.695	S	S	.	*			trans	-102.7	13.7	-162.2	0	0	0	0	0	117	E359	E359-G361 PolarHBondContact O-N 2.65Å
362	S	27.6	Very low	39.3	Very low	107 Å²	107	124.6 Å²	124.6	75%	0.748	74%	0.735	S	S	*	*			trans	68	128.7	-179.7	82.4	0	0	0	0	117.8
363	S	24.7	Very low	36.4	Very low	111 Å²	111	127.7 Å²	127.7	78%	0.776	76%	0.76	S	S	*	*			trans	-137.8	100.8	158.4	53.7	0	0	0	0	110.3	K365	S363-K365 PolarHBondContact O-N 2.87Å
364	P	34.8	Very low	33.9	Very low	119 Å²	119	130.2 Å²	130.2	77%	0.773	79%	0.792	S	S	*	*			trans	-69.2	116.4	177.5	-19.8	32.9	0	0	0	111.1	K366	P364-K366 PolarHBondContact O-N 2.87Å
365	K	32.4	Very low	32	Very low	207 Å²	207	127.6 Å²	127.6	90%	0.9	81%	0.808	S	S	*	*			trans	-53.9	128.6	171.3	-67	173.9	179.6	172.9	0	110.3	S363	S363-K365 PolarHBondContact O-N 2.87Å
366	K	28.4	Very low	31.1	Very low	212 Å²	212	131.6 Å²	131.6	92%	0.922	82%	0.816	S	S	*	*			trans	-113.2	102.9	158.4	-90	-171.8	173.8	179.1	0	110.5	P364	P364-K366 PolarHBondContact O-N 2.87Å
367	S	26.5	Very low	30.3	Very low	112 Å²	112	129.2 Å²	129.2	78%	0.783	82%	0.822	S	S	*	*			trans	-81.8	170.1	156.4	51.3	0	0	0	0	110.4
368	S	28	Very low	29.4	Very low	133 Å²	133	126.5 Å²	126.5	93%	0.93	84%	0.838	S	S	*	*			trans	90.8	132.2	176.1	-159.3	0	0	0	0	116.7
369	G	25.5	Very low	29.3	Very low	73 Å²	73	125.7 Å²	125.7	75%	0.753	84%	0.844	S	S	*	*			trans	154.9	85.4	180	0	0	0	0	0	112.1
370	N	30.3	Very low	29.4	Very low	177 Å²	177	120.6 Å²	120.6	95%	0.947	84%	0.841	S	S	*	*			trans	-64.4	143.6	178.7	-82.4	-9.3	0	0	0	112.6
371	G	28.1	Very low	29.2	Very low	78 Å²	78	117.6 Å²	117.6	80%	0.804	83%	0.834	S	S	*	*			trans	-149.2	77.9	169.5	0	0	0	0	0	111.5
372	S	31.1	Very low	29.3	Very low	127 Å²	127	119.1 Å²	119.1	89%	0.888	84%	0.836	S	S	*	*			trans	-96.9	117.7	177.5	-175.4	0	0	0	0	111
373	C	30.9	Very low	29.4	Very low	124 Å²	124	122.1 Å²	122.1	84%	0.838	84%	0.844	S	S	*	*			trans	-147.2	124.5	163.5	55	0	0	0	0	109.3
374	G	30	Very low	29.4	Very low	86 Å²	86	120.4 Å²	120.4	89%	0.887	84%	0.843	S	S	*	*			trans	-92.5	146.7	179.3	0	0	0	0	0	112.4
375	G	28.4	Very low	29	Very low	83 Å²	83	120.9 Å²	120.9	86%	0.856	85%	0.848	S	S	*	*			trans	-144.9	124.8	171.3	0	0	0	0	0	109.3
376	N	31.8	Very low	29	Very low	180 Å²	180	116.9 Å²	116.9	96%	0.963	84%	0.844	S	S	*	*			trans	-111.8	134.5	-168.5	-151.5	35.1	0	0	0	110.8
377	G	29	Very low	28.9	Very low	79 Å²	79	110.4 Å²	110.4	81%	0.814	84%	0.837	S	S	*	*			trans	135.4	144	163.1	0	0	0	0	0	116.6
378	G	28.3	Very low	28.9	Very low	84 Å²	84	113 Å²	113	87%	0.866	84%	0.836	S	S	*	*			trans	123.9	90.4	166.3	0	0	0	0	0	115.4
379	S	31	Very low	28.8	Very low	138 Å²	138	116.5 Å²	116.5	97%	0.965	84%	0.835	S	S	*	*			trans	-66.4	142.8	172.4	-178.2	0	0	0	0	112.9
380	G	27.4	Very low	28.9	Very low	76 Å²	76	120.9 Å²	120.9	78%	0.784	84%	0.836	S	S	*	*			trans	-168.9	132.5	172.4	0	0	0	0	0	112.5
381	S	29.4	Very low	29.2	Very low	111 Å²	111	119 Å²	119	78%	0.776	83%	0.831	S	S	*	*			trans	-97.2	146	-165.1	-171.9	0	0	0	0	115.2
382	S	31.7	Very low	29.2	Very low	85 Å²	85	120 Å²	120	59%	0.594	82%	0.822	S	S	*	*			trans	45.4	107.3	144.4	61.6	0	0	0	0	120.3
383	N	30	Very low	29.4	Very low	170 Å²	170	117.4 Å²	117.4	91%	0.909	81%	0.805	S	S	*	*				-179.7	153.6	95.6	-94.2	-21.7	0	0	0	111.4
384	G	25.3	Very low	30.2	Very low	74 Å²	74	115.1 Å²	115.1	76%	0.763	79%	0.79	S	S	*	*			trans	-135	133.9	177.9	0	0	0	0	0	112.9
385	C	25.7	Very low	30.8	Very low	129 Å²	129	116 Å²	116	87%	0.872	77%	0.774	S	S	*	*			trans	-157.9	154.6	156.7	-118	0	0	0	0	109.1
386	P	33.1	Very low	31.4	Very low	124 Å²	124	115 Å²	115	81%	0.805	75%	0.751	S	S	*	*			trans	-86.2	134.1	-158.6	31.8	-35.1	0	0	0	114.9	H388	P386-H388 PolarHBondContact O-N 2.84Å
387	G	25.8	Very low	31.7	Very low	76 Å²	76	113.9 Å²	113.9	78%	0.784	74%	0.735	S	S	*	*			trans	-68.7	121.3	173	0	0	0	0	0	113.1	K389	G387-K389 PolarHBondContact O-N 2.92Å
388	H	26.8	Very low	32.4	Very low	165 Å²	165	112.3 Å²	112.3	76%	0.764	71%	0.714	S	S	*	*			trans	-55	113.9	179.5	-164.2	-71.4	0	0	0	112.4	P386 Q390	P386-H388 PolarHBondContact O-N 2.84Å; H388-Q390 PolarHBondContact O-N 2.82Å
389	K	26.1	Very low	33	Very low	207 Å²	207	116.5 Å²	116.5	90%	0.9	70%	0.704	S	S	*	*			trans	-70.3	88.5	171	-77.1	-166.7	176.2	-173.2	0	110.6	G387	G387-K389 PolarHBondContact O-N 2.92Å
390	Q	27.1	Very low	33.4	Very low	165 Å²	165	114.2 Å²	114.2	77%	0.771	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-69.2	142.7	161.4	-73.2	-176.3	-27.7	0	0	109.6	H388	H388-Q390 PolarHBondContact O-N 2.82Å
391	V	35.6	Very low	34.3	Very low	139 Å²	139	115.5 Å²	115.5	84%	0.842	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-79.9	125.7	171.2	179.5	0	0	0	0	107.6
392	P	28.1	Very low	35.2	Very low	97 Å²	97	115 Å²	115	63%	0.63	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-63.5	139	174.3	-18.8	31.7	0	0	0	110.6
393	S	35.3	Very low	36.1	Very low	74 Å²	74	114.1 Å²	114.1	52%	0.517	65%	0.645	S	S	.	*	P	Polyproline II helix	trans	-75.8	152.1	165	56.4	0	0	0	0	109.8	L395 T396	S393-L395 PolarHBondContact O-N 2.86Å; S393-T396 WeakPolarHBondContact O-CB 3.34Å; S393-T396 PolarHBondContact O-N 3.04Å; S393-T396 PolarHBondContact O-OG1 2.88Å
394	S	47.9	Very low	36.5	Very low	76 Å²	76	111.6 Å²	111.6	53%	0.531	63%	0.628	S	S	.	*	H	α-helix	trans	-58.1	-24.6	-174.1	-35.8	0	0	0	0	113.6	T396 Y397 A398	S394-T396 VanDerWaalsContact C-N 3.27Å; S394-T396 PolarHBondContact O-N 2.95Å; S394-Y397 PolarHBondContact O-N 2.81Å; S394-A398 PolarHBondContact O-N 2.88Å
395	L	43.7	Very low	37.2	Very low	105 Å²	105	110.9 Å²	110.9	55%	0.55	61%	0.612	S	S	.	*	H	α-helix	trans	-66.2	-23.1	173.6	-67.2	174.5	0	0	0	114.1	S393 R399	S393-L395 PolarHBondContact O-N 2.86Å; L395-R399 WeakPolarHBondContact O-CB 3.4Å; L395-R399 WeakPolarHBondContact O-CG 3.38Å; L395-R399 PolarHBondContact O-N 3.08Å
396	T	39.6	Very low	37.8	Very low	62 Å²	62	111.1 Å²	111.1	38%	0.38	60%	0.598	S	S	.	*	H	α-helix	trans	-78.1	-44.8	173.7	-46	0	0	0	0	110.3	S393 S394 A398 R399 D400	S393-T396 WeakPolarHBondContact O-CB 3.34Å; S393-T396 PolarHBondContact O-N 3.04Å; S393-T396 PolarHBondContact O-OG1 2.88Å; S394-T396 VanDerWaalsContact C-N 3.27Å; S394-T396 PolarHBondContact O-N 2.95Å; T396-A398 PolarHBondContact O-N 3.42Å; T396-R399 WeakPolarHBondContact O-CB 3.21Å; T396-R399 PolarHBondContact O-N 2.88Å; T396-R399 VanDerWaalsContact O-N 3.13Å; T396-D400 PolarHBondContact O-N 2.68Å
397	Y	39	Very low	38.1	Very low	155 Å²	155	111.1 Å²	111.1	61%	0.608	59%	0.587	S	S	*	*	H	α-helix	trans	-59.6	-48.7	175.8	-172.9	-86.6	0	0	0	111.5	S394 R399 D400 E401	S394-Y397 PolarHBondContact O-N 2.81Å; Y397-R399 VanDerWaalsContact C-N 3.26Å; Y397-R399 PolarHBondContact O-N 3.14Å; Y397-D400 PolarHBondContact O-N 3.17Å; Y397-D400 VanDerWaalsContact O-N 3.14Å; Y397-E401 HydrophobicContact CE1-CB 4.46Å; Y397-E401 WeakPolarHBondContact O-CB 3.39Å; Y397-E401 PolarHBondContact O-N 3.16Å
398	A	42.6	Very low	38.9	Very low	46 Å²	46	117.3 Å²	117.3	38%	0.38	59%	0.587	S	S	.	*	H	α-helix	trans	-60.7	-33.4	175.9	0	0	0	0	0	112.9	S394 T396 L402	S394-A398 PolarHBondContact O-N 2.88Å; T396-A398 PolarHBondContact O-N 3.42Å; A398-L402 WeakPolarHBondContact O-CB 3.3Å; A398-L402 WeakPolarHBondContact O-CD1 3.45Å; A398-L402 VanDerWaalsContact O-CG 3.31Å; A398-L402 WeakPolarHBondContact O-CG 3.21Å; A398-L402 PolarHBondContact O-N 3.29Å; A398-L402 VanDerWaalsContact O-N 3.1Å
399	R	41.8	Very low	39.5	Very low	172 Å²	172	116.2 Å²	116.2	65%	0.649	59%	0.586	S	S	*	*	H	α-helix	trans	-69.2	-45.3	172.3	-91.8	-169.8	169.8	96.2	-2.1	112.4	L395 T396 Y397 E401 L402 T403	L395-R399 WeakPolarHBondContact O-CB 3.4Å; L395-R399 WeakPolarHBondContact O-CG 3.38Å; L395-R399 PolarHBondContact O-N 3.08Å; T396-R399 WeakPolarHBondContact O-CB 3.21Å; T396-R399 PolarHBondContact O-N 2.88Å; T396-R399 VanDerWaalsContact O-N 3.13Å; Y397-R399 VanDerWaalsContact C-N 3.26Å; Y397-R399 PolarHBondContact O-N 3.14Å; R399-E401 VanDerWaalsContact C-N 3.33Å; R399-L402 PolarHBondContact O-N 3.06Å; R399-T403 VanDerWaalsContact O-CB 3.24Å; R399-T403 WeakPolarHBondContact O-CB 3.13Å; R399-T403 PolarHBondContact O-N 3.11Å; R399-T403 PolarHBondContact O-OG1 3.25Å
400	D	39	Very low	40	Very low	91 Å²	91	110 Å²	110	49%	0.487	57%	0.568	S	S	.	*	H	α-helix	trans	-66.7	-36.1	-179.5	-72.5	-22.4	0	0	0	111.4	T396 Y397 T403 Q404	T396-D400 PolarHBondContact O-N 2.68Å; Y397-D400 PolarHBondContact O-N 3.17Å; Y397-D400 VanDerWaalsContact O-N 3.14Å; D400-T403 PolarHBondContact O-N 3.35Å; D400-Q404 WeakPolarHBondContact O-CB 3.5Å; D400-Q404 WeakPolarHBondContact O-CG 3.24Å; D400-Q404 PolarHBondContact O-N 2.79Å
401	E	47.8	Very low	40.4	Very low	103 Å²	103	108 Å²	108	48%	0.481	57%	0.567	S	S	.	*	H	α-helix	trans	-71.9	-41.2	177.2	-166	164.9	-122.5	0	0	112.3	Y397 R399 S405	Y397-E401 HydrophobicContact CE1-CB 4.46Å; Y397-E401 WeakPolarHBondContact O-CB 3.39Å; Y397-E401 PolarHBondContact O-N 3.16Å; R399-E401 VanDerWaalsContact C-N 3.33Å; E401-S405 WeakPolarHBondContact O-CB 3.48Å; E401-S405 PolarHBondContact O-N 3.26Å; E401-S405 PolarHBondContact O-OG 3.11Å
402	L	48.1	Very low	40.2	Very low	100 Å²	100	107.3 Å²	107.3	52%	0.524	57%	0.567	S	S	.	*	H	α-helix	trans	-60.4	-44.4	167.8	-80	167.6	0	0	0	111.5	A398 R399 S405 F406	A398-L402 WeakPolarHBondContact O-CB 3.3Å; A398-L402 WeakPolarHBondContact O-CD1 3.45Å; A398-L402 VanDerWaalsContact O-CG 3.31Å; A398-L402 WeakPolarHBondContact O-CG 3.21Å; A398-L402 PolarHBondContact O-N 3.29Å; A398-L402 VanDerWaalsContact O-N 3.1Å; R399-L402 PolarHBondContact O-N 3.06Å; L402-S405 WeakPolarHBondContact O-CA 3.31Å; L402-S405 WeakPolarHBondContact O-CB 3.48Å; L402-S405 PolarHBondContact O-N 3.07Å; L402-S405 VanDerWaalsContact O-N 3.12Å; L402-F406 HydrophobicContact CB-CE2 4.45Å; L402-F406 HydrophobicContact CD2-CE2 4.42Å; L402-F406 WeakPolarHBondContact O-CD2 3.25Å; L402-F406 PolarHBondContact O-N 3.1Å
403	T	49.1	Very low	40.3	Very low	66 Å²	66	108.7 Å²	108.7	41%	0.405	57%	0.574	S	S	.	*	H	α-helix	trans	-69.4	-37.1	-177.9	-53.8	0	0	0	0	111.4	R399 D400 S405 F406 H407	R399-T403 VanDerWaalsContact O-CB 3.24Å; R399-T403 WeakPolarHBondContact O-CB 3.13Å; R399-T403 PolarHBondContact O-N 3.11Å; R399-T403 PolarHBondContact O-OG1 3.25Å; D400-T403 PolarHBondContact O-N 3.35Å; T403-S405 VanDerWaalsContact C-N 3.33Å; T403-F406 PolarHBondContact O-N 3.28Å; T403-H407 WeakPolarHBondContact O-CB 3.42Å; T403-H407 PolarHBondContact O-CD2 3.2Å; T403-H407 PolarHBondContact O-N 2.89Å
404	Q	39.8	Very low	40	Very low	118 Å²	118	116.2 Å²	116.2	55%	0.551	59%	0.592	S	S	*	*	H	α-helix	trans	-65.5	-35	169.2	-76.8	-171.6	36.1	0	0	112.3	D400 H407 R408	D400-Q404 WeakPolarHBondContact O-CB 3.5Å; D400-Q404 WeakPolarHBondContact O-CG 3.24Å; D400-Q404 PolarHBondContact O-N 2.79Å; Q404-H407 PolarHBondContact O-N 2.95Å; Q404-R408 WeakPolarHBondContact O-CG 3.36Å; Q404-R408 PolarHBondContact O-N 3.01Å
405	S	39	Very low	38.9	Very low	59 Å²	59	115.8 Å²	115.8	41%	0.413	60%	0.6	S	S	.	*	H	α-helix	trans	-66.2	-46.2	175.3	-60.3	0	0	0	0	111.6	E401 L402 T403 H407 R408 L409	E401-S405 WeakPolarHBondContact O-CB 3.48Å; E401-S405 PolarHBondContact O-N 3.26Å; E401-S405 PolarHBondContact O-OG 3.11Å; L402-S405 WeakPolarHBondContact O-CA 3.31Å; L402-S405 WeakPolarHBondContact O-CB 3.48Å; L402-S405 PolarHBondContact O-N 3.07Å; L402-S405 VanDerWaalsContact O-N 3.12Å; T403-S405 VanDerWaalsContact C-N 3.33Å; S405-H407 VanDerWaalsContact C-N 3.33Å; S405-H407 PolarHBondContact O-N 3.47Å; S405-R408 PolarHBondContact O-N 3.42Å; S405-L409 WeakPolarHBondContact O-CG 3.39Å; S405-L409 PolarHBondContact O-N 3.25Å
406	F	39.7	Very low	38.1	Very low	134 Å²	134	115.3 Å²	115.3	59%	0.588	61%	0.605	S	S	*	*	H	α-helix	trans	-63.1	-36.4	171.7	-70.6	-62.1	0	0	0	112.5	L402 T403 L409 S410	L402-F406 HydrophobicContact CB-CE2 4.45Å; L402-F406 HydrophobicContact CD2-CE2 4.42Å; L402-F406 WeakPolarHBondContact O-CD2 3.25Å; L402-F406 PolarHBondContact O-N 3.1Å; T403-F406 PolarHBondContact O-N 3.28Å; F406-L409 PolarHBondContact O-N 2.71Å; F406-S410 WeakPolarHBondContact O-CB 3.39Å; F406-S410 PolarHBondContact O-N 2.93Å; F406-S410 PolarHBondContact O-OG 3.16Å
407	H	39.3	Very low	37.5	Very low	123 Å²	123	119.3 Å²	119.3	57%	0.569	62%	0.624	S	S	*	*	H	α-helix	trans	-65.6	-40.4	173.3	-81.7	-49.4	0	0	0	113	T403 Q404 S405 L409 S410	T403-H407 WeakPolarHBondContact O-CB 3.42Å; T403-H407 PolarHBondContact O-CD2 3.2Å; T403-H407 PolarHBondContact O-N 2.89Å; Q404-H407 PolarHBondContact O-N 2.95Å; S405-H407 VanDerWaalsContact C-N 3.33Å; S405-H407 PolarHBondContact O-N 3.47Å; H407-L409 VanDerWaalsContact C-N 3.31Å; H407-L409 PolarHBondContact O-N 2.99Å; H407-S410 WeakPolarHBondContact CA-OG 3.36Å; H407-S410 PolarHBondContact O-N 3.25Å; H407-S410 PolarHBondContact O-OG 3.39Å
408	R	42	Very low	37.2	Very low	206 Å²	206	119.3 Å²	119.3	78%	0.777	63%	0.634	S	S	*	*	H	α-helix	trans	-64.2	-33.9	173.1	-75	-179.2	-179.6	178.6	3.8	112.8	Q404 S405 S410	Q404-R408 WeakPolarHBondContact O-CG 3.36Å; Q404-R408 PolarHBondContact O-N 3.01Å; S405-R408 PolarHBondContact O-N 3.42Å; R408-S410 VanDerWaalsContact C-N 3.33Å
409	L	39.5	Very low	36.6	Very low	142 Å²	142	125.5 Å²	125.5	74%	0.743	66%	0.655	S	S	*	*	H	α-helix	trans	-74.7	-19.5	175	-70.9	167.8	0	0	0	113.7	S405 F406 H407	S405-L409 WeakPolarHBondContact O-CG 3.39Å; S405-L409 PolarHBondContact O-N 3.25Å; F406-L409 PolarHBondContact O-N 2.71Å; H407-L409 VanDerWaalsContact C-N 3.31Å; H407-L409 PolarHBondContact O-N 2.99Å
410	S	35.1	Very low	35.9	Very low	77 Å²	77	120.8 Å²	120.8	54%	0.538	66%	0.66	S	S	.	*	H	α-helix	trans	-92.9	-5.7	-175.5	65.5	0	0	0	0	115.8	F406 H407 R408	F406-S410 WeakPolarHBondContact O-CB 3.39Å; F406-S410 PolarHBondContact O-N 2.93Å; F406-S410 PolarHBondContact O-OG 3.16Å; H407-S410 WeakPolarHBondContact CA-OG 3.36Å; H407-S410 PolarHBondContact O-N 3.25Å; H407-S410 PolarHBondContact O-OG 3.39Å; R408-S410 VanDerWaalsContact C-N 3.33Å
411	V	36.4	Very low	35.4	Very low	123 Å²	123	123.7 Å²	123.7	75%	0.745	68%	0.675	S	S	*	*	S	Bend	trans	-104.8	63	-179.5	-169.7	0	0	0	0	111.4
412	C	32	Very low	34.7	Very low	125 Å²	125	125 Å²	125	85%	0.845	70%	0.696	S	S	*	*	S	Bend	trans	-149.6	23.4	169	-122.4	0	0	0	0	114.7
413	V	29.4	Very low	33.9	Very low	126 Å²	126	129.2 Å²	129.2	76%	0.764	71%	0.713	S	S	*	*			trans	-137.5	108.7	172.6	-177.6	0	0	0	0	111.2
414	Y	29.1	Very low	33	Very low	232 Å²	232	133.5 Å²	133.5	91%	0.91	74%	0.738	S	S	*	*				-163.4	122	125.3	-118	-77.1	0	0	0	110.1
415	G	25.2	Very low	32.5	Very low	67 Å²	67	134.1 Å²	134.1	69%	0.691	75%	0.746	S	S	*	*			trans	-149.2	3.2	-168.3	0	0	0	0	0	117
416	S	26.6	Very low	31.9	Very low	94 Å²	94	139.7 Å²	139.7	66%	0.657	77%	0.77	S	S	*	*			trans	72.3	133.6	163.7	74.7	0	0	0	0	121.5
417	N	27.6	Very low	31.3	Very low	146 Å²	146	141.5 Å²	141.5	78%	0.781	78%	0.78	S	S	*	*			trans	69.9	111.6	146.5	-54.6	-20.9	0	0	0	119.1
418	L	33.1	Very low	30.8	Very low	156 Å²	156	139 Å²	139	82%	0.817	79%	0.788	S	S	*	*				-167.1	156.6	56.4	-87.8	171.6	0	0	0	114.9
419	H	29.1	Very low	30	Very low	175 Å²	175	135.5 Å²	135.5	81%	0.81	79%	0.793	S	S	*	*			trans	-10.7	143.9	160	-66.9	75.7	0	0	0	121.3
420	G	27	Very low	29.3	Very low	74 Å²	74	136.1 Å²	136.1	76%	0.763	80%	0.795	S	S	*	*			trans	-177.2	24.8	171.9	0	0	0	0	0	121.8
421	N	29	Very low	29	Very low	152 Å²	152	138.5 Å²	138.5	81%	0.813	81%	0.806	S	S	*	*			trans	22	113.9	165.9	-56.4	-8.9	0	0	0	121.2
422	S	32.2	Very low	28.6	Very low	129 Å²	129	140.7 Å²	140.7	90%	0.902	81%	0.812	S	S	*	*				-171.4	151.7	121.6	28.1	0	0	0	0	111.4
423	E	31.4	Very low	28.3	Very low	190 Å²	190	141.2 Å²	141.2	89%	0.888	82%	0.816	S	S	*	*			trans	-107.8	141.3	-163.6	-56.1	170	136.7	0	0	112.5
424	V	30.8	Very low	28.2	Very low	155 Å²	155	138.3 Å²	138.3	94%	0.939	81%	0.812	S	S	*	*			trans	-146.2	137.1	136.5	-113.6	0	0	0	0	109.8
425	N	28.1	Very low	28	Very low	132 Å²	132	134.1 Å²	134.1	71%	0.706	81%	0.805	S	S	*	*			trans	-104.1	138.3	-170.4	171.9	7.6	0	0	0	110.5	Q427	N425-Q427 PolarHBondContact OD1-N 2.95Å
426	L	28.3	Very low	28	Very low	176 Å²	176	141.4 Å²	141.4	92%	0.921	81%	0.812	S	S	*	*			trans	-145.2	125	145.4	-114.2	171.5	0	0	0	111.4
427	Q	26.8	Very low	27.8	Very low	171 Å²	171	141.3 Å²	141.3	80%	0.799	82%	0.817	S	S	*	*			trans	-96.2	140.2	-169.6	-176.6	78.1	2.5	0	0	111.8	N425	N425-Q427 PolarHBondContact OD1-N 2.95Å
428	G	27.3	Very low	27.7	Very low	72 Å²	72	142.4 Å²	142.4	74%	0.742	82%	0.822	S	S	*	*			trans	105.1	148.9	163.8	0	0	0	0	0	114.8
429	C	25.7	Very low	28.4	Very low	131 Å²	131	140.5 Å²	140.5	89%	0.885	82%	0.819	S	S	*	*			cis	-129	141.3	5.6	-170.7	0	0	0	0	110.7
430	M	25.4	Very low	28.7	Very low	156 Å²	156	138.3 Å²	138.3	77%	0.768	82%	0.82	S	S	*	*			trans	-98.6	144.1	176.6	-139.4	-165.6	85.6	0	0	111.1
431	T	29.6	Very low	28.8	Very low	126 Å²	126	139.2 Å²	139.2	77%	0.773	82%	0.815	S	S	*	*			trans	-70.3	141.5	170.7	37.1	0	0	0	0	111.8
432	L	27.4	Very low	28.6	Very low	169 Å²	169	139.5 Å²	139.5	89%	0.885	82%	0.816	S	S	*	*			trans	-138.7	134.6	156.3	-87.5	176.6	0	0	0	110.1
433	C	25.4	Very low	28.2	Very low	136 Å²	136	136.6 Å²	136.6	92%	0.919	81%	0.807	S	S	*	*			trans	-139.7	128.6	165.6	-179.5	0	0	0	0	105.9
434	G	26.7	Very low	27.9	Very low	66 Å²	66	132.3 Å²	132.3	68%	0.68	80%	0.798	S	S	*	*			trans	174.8	104.2	-175.2	0	0	0	0	0	115.1
435	D	26	Very low	27.7	Very low	143 Å²	143	132.9 Å²	132.9	77%	0.765	79%	0.79	S	S	*	*			trans	82.5	131.3	132	-89	13	0	0	0	124.9
436	W	24.3	Very low	27.8	Very low	220 Å²	220	131.3 Å²	131.3	83%	0.833	79%	0.789	S	S	*	*			trans	59.6	117.2	151	-57.4	113.2	0	0	0	125
437	A	23	Very low	27.7	Very low	93 Å²	93	131.7 Å²	131.7	77%	0.769	79%	0.786	S	S	*	*				86.5	148.3	124.5	0	0	0	0	0	123
438	L	24.6	Very low	27.8	Very low	169 Å²	169	129 Å²	129	89%	0.885	79%	0.786	S	S	*	*			trans	-82.4	170.4	168.6	-60.5	166.5	0	0	0	110
439	P	47.9	Very low	27.9	Very low	116 Å²	116	128.7 Å²	128.7	75%	0.753	78%	0.783	S	S	*	*			cis	-129.1	-151.3	17.8	43.4	-23.1	0	0	0	111.1
440	P	35	Very low	28	Very low	129 Å²	129	130.3 Å²	130.3	84%	0.838	78%	0.778	S	S	*	*			cis	-131.6	-115.8	-2.2	40.4	-17.6	0	0	0	114.8
441	S	29.7	Very low	28.1	Very low	93 Å²	93	128.9 Å²	128.9	65%	0.65	77%	0.773	S	S	*	*			trans	-150.9	149.6	-171	172.1	0	0	0	0	110.9
442	D	24.6	Very low	28.1	Very low	158 Å²	158	128.9 Å²	128.9	85%	0.845	76%	0.764	S	S	*	*				159.1	159.9	127.8	-81.8	0	0	0	0	112.7
443	G	24.6	Very low	28.1	Very low	68 Å²	68	128 Å²	128	70%	0.701	76%	0.755	S	S	*	*			trans	125.2	40.6	150.7	0	0	0	0	0	122.5
444	S	25	Very low	28	Very low	99 Å²	99	128.2 Å²	128.2	69%	0.692	75%	0.747	S	S	*	*			trans	35.1	131.5	140	59.3	0	0	0	0	123.9
445	H	26.6	Very low	28.1	Very low	167 Å²	167	134.3 Å²	134.3	77%	0.773	76%	0.755	S	S	*	*			trans	134.3	113.6	141.1	-77	-63.9	0	0	0	114.2
446	S	30.6	Very low	29.4	Very low	99 Å²	99	132.9 Å²	132.9	69%	0.692	75%	0.753	S	S	*	*				78.8	133.3	89.4	-58.8	0	0	0	0	112.6
447	E	26.6	Very low	29.3	Very low	184 Å²	184	131.4 Å²	131.4	86%	0.86	76%	0.756	S	S	*	*			cis	-160.3	171.6	17.1	-158	169.8	-121.2	0	0	113.1
448	S	27.8	Very low	29.6	Very low	115 Å²	115	134.1 Å²	134.1	80%	0.804	76%	0.757	S	S	*	*			trans	82.8	139.1	155.3	-157.6	0	0	0	0	120.6
449	G	28.8	Very low	29.5	Very low	65 Å²	65	131.6 Å²	131.6	67%	0.67	75%	0.753	S	S	*	*			trans	131.4	85.7	160.8	0	0	0	0	0	117.1
450	E	27.9	Very low	28.3	Very low	166 Å²	166	132.4 Å²	132.4	78%	0.776	75%	0.751	S	S	*	*			trans	-39.1	121	175.6	50.9	-112.3	75.3	0	0	120.8
451	N	27.9	Very low	27.7	Very low	125 Å²	125	135 Å²	135	67%	0.668	75%	0.749	S	S	*	*				71.9	119.7	119.1	-75.4	43.5	0	0	0	122.9
452	E	29.2	Very low	27.4	Very low	126 Å²	126	135.9 Å²	135.9	59%	0.589	75%	0.751	S	S	*	*				81.5	139.1	65.9	-72.9	-177	156.5	0	0	113.1
453	H	27.5	Very low	27.4	Very low	150 Å²	150	133 Å²	133	69%	0.694	74%	0.743	S	S	*	*			cis	-158.5	137.5	15.3	-105.7	-14.8	0	0	0	109.8
454	L	24.2	Very low	27.5	Very low	142 Å²	142	136.8 Å²	136.8	74%	0.743	74%	0.743	S	S	*	*				101.8	157.3	98.3	-78.1	174.7	0	0	0	118.1
455	F	27.6	Very low	27.5	Very low	193 Å²	193	140 Å²	140	85%	0.846	75%	0.746	S	S	*	*			trans	-94.3	-169.2	175.1	-69.8	-98.4	0	0	0	110.8
456	P	54	Low	27.3	Very low	113 Å²	113	135.8 Å²	135.8	73%	0.734	74%	0.74	S	S	*	*			cis	-128.7	-151.3	-39.3	30.8	-8.5	0	0	0	111
457	E	22.7	Very low	27.1	Very low	190 Å²	190	138.2 Å²	138.2	89%	0.888	75%	0.745	S	S	*	*			trans	126.6	166.4	133.8	-156.2	151.4	-138.1	0	0	117.1
458	L	28.7	Very low	27	Very low	150 Å²	150	136.3 Å²	136.3	79%	0.785	74%	0.74	S	S	*	*			trans	-115.5	140.9	-159.2	171.7	81.1	0	0	0	110.5
459	S	21.8	Very low	26.8	Very low	115 Å²	115	136.1 Å²	136.1	80%	0.804	74%	0.739	S	S	*	*			trans	173.8	155.8	141.8	-81.3	0	0	0	0	113.5
460	D	23.9	Very low	26.6	Very low	134 Å²	134	142 Å²	142	72%	0.717	75%	0.747	S	S	*	*			trans	-76.6	164.7	174.8	-54.8	-90.8	0	0	0	114.1
461	F	22.6	Very low	26.4	Very low	182 Å²	182	140.7 Å²	140.7	80%	0.798	74%	0.744	S	S	*	*				171.8	113.4	106.1	-100.3	-77.4	0	0	0	115.9
462	T	23.2	Very low	26.2	Very low	112 Å²	112	141.4 Å²	141.4	69%	0.687	75%	0.748	S	S	*	*			trans	55.8	127.1	140.3	49.6	0	0	0	0	125.7
463	S	23.9	Very low	26.7	Very low	97 Å²	97	141.5 Å²	141.5	68%	0.678	76%	0.757	S	S	*	*			trans	87.7	156.4	134.6	85.8	0	0	0	0	118.8
464	Q	26.1	Very low	26.8	Very low	149 Å²	149	139.5 Å²	139.5	70%	0.696	76%	0.757	S	S	*	*			cis	-154.9	173.3	16.2	-150.8	159.6	122.8	0	0	114.3
465	H	25.1	Very low	26.8	Very low	166 Å²	166	140.6 Å²	140.6	77%	0.769	75%	0.752	S	S	*	*			trans	81.9	131.5	171.4	-51.8	-64.7	0	0	0	117.3
466	A	24.1	Very low	27.1	Very low	78 Å²	78	138.1 Å²	138.1	65%	0.645	74%	0.743	S	S	*	*			cis	-157.9	162.7	-7.7	0	0	0	0	0	112.4
467	D	24.6	Very low	26.3	Very low	150 Å²	150	140 Å²	140	80%	0.802	74%	0.742	S	S	*	*			trans	62.9	148.7	154.9	-70.4	-2.8	0	0	0	120.2
468	L	24.5	Very low	26.8	Very low	144 Å²	144	136.1 Å²	136.1	75%	0.754	73%	0.727	S	S	*	*			cis	-163	156.4	-17.7	-167.5	71.7	0	0	0	108.7
469	S	24.9	Very low	26.8	Very low	111 Å²	111	139.2 Å²	139.2	78%	0.776	73%	0.728	S	S	*	*			trans	60.4	133.9	178.4	43.1	0	0	0	0	116.4
470	K	24.5	Very low	27.1	Very low	190 Å²	190	141 Å²	141	83%	0.826	73%	0.728	S	S	*	*			cis	88.2	140.4	33.7	-159.8	-179	-179.6	-165.4	0	113.8
471	L	24.1	Very low	27.3	Very low	138 Å²	138	140.3 Å²	140.3	72%	0.723	72%	0.724	S	S	*	*			trans	-31.5	153.6	175.9	-76.8	81.6	0	0	0	115.7
472	D	23.7	Very low	27.3	Very low	139 Å²	139	139.8 Å²	139.8	74%	0.743	72%	0.724	S	S	*	*				-160.3	170.1	63.9	-97.5	-53.5	0	0	0	116.5
473	V	38.8	Very low	27.4	Very low	129 Å²	129	142.6 Å²	142.6	78%	0.782	73%	0.734	S	S	*	*			trans	-120.4	127.1	164.8	174.5	0	0	0	0	109.7
474	P	29.8	Very low	27.3	Very low	108 Å²	108	146.5 Å²	146.5	70%	0.701	74%	0.739	S	S	*	*			trans	-108.5	144.8	143.7	-8.5	29.5	0	0	0	109.7
475	Y	24.8	Very low	27.1	Very low	165 Å²	165	150.3 Å²	150.3	65%	0.647	75%	0.747	S	S	*	*			cis	61.8	138.8	42.9	-116.2	-99.9	0	0	0	112.2	E477	Y475-E477 HydrophobicContact CD1-CB 4.29Å; Y475-E477 HydrophobicContact CE1-CB 3.69Å; Y475-E477 HydrophobicContact CE1-CG 4.46Å; Y475-E477 PolarHBondContact OH-OE2 3.05Å
476	E	32.8	Very low	27.1	Very low	140 Å²	140	150.3 Å²	150.3	65%	0.654	75%	0.747	S	S	*	*			cis	-135.3	177	20.2	-26	-161.9	96.1	0	0	109.7	L478	E476-L478 HydrophobicContact CB-CG 4.31Å
477	E	38.2	Very low	27.4	Very low	153 Å²	153	151.8 Å²	151.8	72%	0.715	75%	0.753	S	S	*	*			cis	65.2	56.4	20.8	-84.5	-152.1	161.9	0	0	117.8	Y475	Y475-E477 HydrophobicContact CD1-CB 4.29Å; Y475-E477 HydrophobicContact CE1-CB 3.69Å; Y475-E477 HydrophobicContact CE1-CG 4.46Å; Y475-E477 PolarHBondContact OH-OE2 3.05Å
478	L	32.6	Very low	27.5	Very low	108 Å²	108	150.3 Å²	150.3	57%	0.565	75%	0.751	S	S	*	*			trans	-135.3	135.8	155.2	-64	173.5	0	0	0	107.8	E476	E476-L478 HydrophobicContact CB-CG 4.31Å
479	W	29.7	Very low	27.6	Very low	215 Å²	215	152.9 Å²	152.9	81%	0.814	76%	0.757	S	S	*	*	S	Bend	cis	-137.2	157.8	15.9	-49.6	68.9	0	0	0	108.3
480	L	27.2	Very low	28	Very low	153 Å²	153	152.9 Å²	152.9	80%	0.801	75%	0.754	S	S	*	*			cis	-142.8	158.3	31	-112.6	173.7	0	0	0	113.8
481	D	27.7	Very low	28	Very low	119 Å²	119	148.4 Å²	148.4	64%	0.636	75%	0.747	S	S	*	*			trans	-51.3	156.6	-176.5	-71.1	-92.4	0	0	0	120.4
482	H	24.1	Very low	28.1	Very low	171 Å²	171	147.4 Å²	147.4	79%	0.792	75%	0.751	S	S	*	*			trans	-17.6	131.6	138.7	-70.5	-54.4	0	0	0	117.3
483	L	23.4	Very low	28.2	Very low	172 Å²	172	144.8 Å²	144.8	90%	0.901	74%	0.744	S	S	*	*			trans	-132.2	119.2	131.2	-125.9	161.5	0	0	0	110.9
484	K	22.6	Very low	27.7	Very low	179 Å²	179	147.4 Å²	147.4	78%	0.778	75%	0.747	S	S	*	*			trans	-90.9	155.9	-178.3	-169.6	174.3	-170.3	167.5	0	108.7
485	R	21.8	Very low	27.5	Very low	228 Å²	228	145.2 Å²	145.2	86%	0.86	75%	0.745	S	S	*	*			trans	69.8	149.7	173.3	-96.7	178.5	-167.6	-179	4.1	113.2
486	Q	24.4	Very low	27.7	Very low	166 Å²	166	143.2 Å²	143.2	78%	0.776	75%	0.75	S	S	*	*			cis	-137.4	149.2	8.7	-56.7	-179.5	25.8	0	0	111.9
487	S	30.2	Very low	27.5	Very low	110 Å²	110	146.6 Å²	146.6	77%	0.769	76%	0.756	S	S	*	*			trans	-74.1	146.6	150.2	56.4	0	0	0	0	109.6
488	P	26.9	Very low	26.9	Very low	118 Å²	118	145.6 Å²	145.6	77%	0.766	76%	0.76	S	S	*	*				-148.3	155	101.6	39.6	-24.7	0	0	0	116.3
489	K	27.4	Very low	26.6	Very low	198 Å²	198	144.3 Å²	144.3	86%	0.861	77%	0.766	S	S	*	*			trans	-68.5	157.9	151.8	-96	179.1	178.2	177.8	0	108.7
490	P	32.6	Very low	26.4	Very low	111 Å²	111	141.1 Å²	141.1	72%	0.721	76%	0.764	S	S	*	*				-157.8	173.2	53	41.5	-19	0	0	0	120.5
491	S	24.4	Very low	26.5	Very low	96 Å²	96	140.8 Å²	140.8	67%	0.671	76%	0.764	S	S	*	*			trans	67.1	133.4	136.7	60.6	0	0	0	0	124.4
492	S	27.3	Very low	26.6	Very low	118 Å²	118	142.2 Å²	142.2	83%	0.825	77%	0.771	S	S	*	*			trans	78	153.8	144.1	77.3	0	0	0	0	118
493	S	26.5	Very low	26.8	Very low	83 Å²	83	138.8 Å²	138.8	58%	0.58	77%	0.765	S	S	*	*			cis	-143.8	166.2	5.9	63.6	0	0	0	0	113.6
494	E	26.4	Very low	27.1	Very low	184 Å²	184	134.9 Å²	134.9	86%	0.86	76%	0.758	S	S	*	*			trans	57.5	148.7	152.9	-66.6	148.2	135	0	0	121.1
495	G	25.8	Very low	27.4	Very low	63 Å²	63	131.3 Å²	131.3	65%	0.649	75%	0.751	S	S	*	*			cis	150.8	154.5	-12	0	0	0	0	0	114.2
496	V	29.2	Very low	27.7	Very low	123 Å²	123	127 Å²	127	75%	0.745	75%	0.75	S	S	*	*			trans	71.3	149.1	156.5	174.8	0	0	0	0	117.3
497	R	28.3	Very low	27.9	Very low	210 Å²	210	123.8 Å²	123.8	79%	0.792	75%	0.752	S	S	*	*			cis	-167.5	144.4	-30.9	-95.4	179.9	-154.4	139.1	5.2	108
498	V	25.7	Very low	27.7	Very low	132 Å²	132	122.7 Å²	122.7	80%	0.8	74%	0.744	S	S	*	*			trans	53.2	151	136.4	-176.2	0	0	0	0	121.4
499	A	28.1	Very low	27.7	Very low	82 Å²	82	125.2 Å²	125.2	68%	0.678	75%	0.751	S	S	*	*			trans	85.6	145.7	166.8	0	0	0	0	0	117
500	N	25.4	Very low	27.9	Very low	148 Å²	148	125.6 Å²	125.6	79%	0.791	75%	0.748	S	S	*	*			cis	-161.1	178.4	-13.3	-111.9	11.4	0	0	0	109.7
501	D	29.2	Very low	28.4	Very low	146 Å²	146	125.4 Å²	125.4	78%	0.781	75%	0.747	S	S	*	*			trans	-56.5	171.5	159.3	-51.5	-76	0	0	0	111.7
502	D	28.9	Very low	28.5	Very low	149 Å²	149	126.8 Å²	126.8	80%	0.797	75%	0.751	S	S	*	*			cis	-168.2	171.4	34.1	-163.7	2.4	0	0	0	112.4
503	C	29.3	Very low	28.5	Very low	98 Å²	98	126.4 Å²	126.4	66%	0.662	74%	0.744	S	S	*	*			trans	46.7	127.6	151.2	-145.9	0	0	0	0	119.3
504	A	28.7	Very low	28.4	Very low	91 Å²	91	128.3 Å²	128.3	75%	0.752	76%	0.756	S	S	*	*				167.5	160.5	75	0	0	0	0	0	109.1
505	T	29.1	Very low	29.4	Very low	103 Å²	103	124.8 Å²	124.8	63%	0.632	75%	0.749	S	S	*	*			cis	-171.1	129	-13.1	-98.5	0	0	0	0	109.6
506	T	28.2	Very low	29.5	Very low	137 Å²	137	129.3 Å²	129.3	84%	0.84	76%	0.758	S	S	*	*			trans	54.3	148	162.3	59.2	0	0	0	0	119.2
507	A	28.3	Very low	29.3	Very low	100 Å²	100	128.9 Å²	128.9	83%	0.826	76%	0.76	S	S	*	*			cis	-148.7	161.3	41	0	0	0	0	0	114.9
508	S	26.1	Very low	29.3	Very low	86 Å²	86	123.5 Å²	123.5	60%	0.601	76%	0.76	S	S	*	*			trans	-107.9	155.2	175.6	178.7	0	0	0	0	109.5
509	L	27.6	Very low	29.4	Very low	172 Å²	172	128.5 Å²	128.5	90%	0.901	77%	0.765	S	S	*	*				-168.8	131.8	119.7	-99.1	163.4	0	0	0	112.8
510	Y	30.4	Very low	29.3	Very low	205 Å²	205	130.1 Å²	130.1	80%	0.804	77%	0.766	S	S	*	*			trans	-82.6	-172.2	170.4	-82.7	-85	0	0	0	109.6
511	P	43.4	Very low	29.3	Very low	107 Å²	107	128.2 Å²	128.2	70%	0.695	77%	0.765	S	S	*	*			cis	-157.6	-176.1	25.1	45.1	-21.9	0	0	0	121.4
512	V	27.4	Very low	29.3	Very low	126 Å²	126	128.8 Å²	128.8	76%	0.764	77%	0.767	S	S	*	*			trans	73.1	154.3	141.6	152.4	0	0	0	0	119.7
513	T	26.5	Very low	29.4	Very low	109 Å²	109	129.3 Å²	129.3	67%	0.669	77%	0.77	S	S	*	*				-176.3	131.5	-67.1	35.2	0	0	0	0	111.3
514	C	24.1	Very low	29.4	Very low	124 Å²	124	130.6 Å²	130.6	84%	0.838	77%	0.774	S	S	*	*			trans	61.7	178.8	152.1	-68.3	0	0	0	0	118.8
515	P	48	Very low	29.5	Very low	110 Å²	110	132.1 Å²	132.1	71%	0.714	78%	0.777	S	S	*	*				-135	173.6	-50.1	38.3	-22.9	0	0	0	115.6
516	L	28.5	Very low	29.4	Very low	158 Å²	158	135.6 Å²	135.6	83%	0.827	79%	0.79	S	S	*	*			trans	59.8	132.2	148.8	-105.9	71.3	0	0	0	124.2
517	S	24.3	Very low	29.5	Very low	113 Å²	113	135.4 Å²	135.4	79%	0.79	79%	0.789	S	S	*	*			trans	91.2	147.3	138.1	-64.4	0	0	0	0	123.7
518	A	28	Very low	29.6	Very low	97 Å²	97	136 Å²	136	80%	0.802	79%	0.785	S	S	*	*			trans	90.4	85.3	153.4	0	0	0	0	0	123
519	R	27.8	Very low	29.7	Very low	238 Å²	238	137.3 Å²	137.3	90%	0.898	79%	0.791	S	S	*	*				53.8	140.4	121.3	-125.7	178.1	179.2	173	-2.4	123.9
520	T	26.2	Very low	29.8	Very low	115 Å²	115	135.4 Å²	135.4	71%	0.706	79%	0.789	S	S	*	*			trans	88	118.8	146.4	16.2	0	0	0	0	123.6
521	S	25.7	Very low	29.9	Very low	109 Å²	109	131.6 Å²	131.6	76%	0.762	79%	0.787	S	S	*	*			trans	61.9	148.5	154	53.9	0	0	0	0	119.1
522	L	29.1	Very low	29.4	Very low	157 Å²	157	131.4 Å²	131.4	82%	0.822	79%	0.786	S	S	*	*			cis	-152.9	161.1	31.6	-161.3	91	0	0	0	111.7
523	D	31.4	Very low	29.8	Very low	160 Å²	160	131.6 Å²	131.6	86%	0.856	79%	0.789	S	S	*	*			trans	-80.2	131.5	173.1	-79.7	-63.8	0	0	0	113.9
524	V	28.9	Very low	30.1	Very low	126 Å²	126	135 Å²	135	76%	0.764	80%	0.795	S	S	*	*			trans	-146.6	131.9	157.3	-179.6	0	0	0	0	108
525	P	29.8	Very low	31.1	Very low	123 Å²	123	133.3 Å²	133.3	80%	0.799	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-81.9	147	-170	31.9	-36.2	0	0	0	114.3
526	L	28.4	Very low	30.9	Very low	175 Å²	175	136 Å²	136	92%	0.916	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-103.3	142.7	167.3	-69.8	173.1	0	0	0	110.9
527	T	28.8	Very low	31.5	Very low	133 Å²	133	132.3 Å²	132.3	82%	0.816	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-78.2	145.7	-176.6	48.7	0	0	0	0	113.1
528	P	31.4	Very low	32.4	Very low	114 Å²	114	131 Å²	131	74%	0.74	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-68.6	156.5	174.5	30	-35.6	0	0	0	112.8
529	P	28.7	Very low	33.3	Very low	113 Å²	113	134.1 Å²	134.1	73%	0.734	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-70.7	160.8	-179.2	29.6	-35.9	0	0	0	113.6
530	P	29	Very low	34.1	Very low	131 Å²	131	127.8 Å²	127.8	85%	0.851	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-72.7	145.1	-173	29.3	-36	0	0	0	114
531	V	33	Very low	35.1	Very low	125 Å²	125	129.9 Å²	129.9	76%	0.758	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-94.7	138.6	176.4	-179.4	0	0	0	0	109.7
532	P	32.5	Very low	35.9	Very low	104 Å²	104	128.9 Å²	128.9	68%	0.675	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-64.7	153.8	177.8	26.1	-35.2	0	0	0	113.2
533	P	35.9	Very low	36.6	Very low	129 Å²	129	129.8 Å²	129.8	84%	0.838	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-70.5	135.1	-171.4	28.1	-35.2	0	0	0	113
534	K	33.6	Very low	37.1	Very low	182 Å²	182	129.2 Å²	129.2	79%	0.791	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-79.7	149.5	168.8	-64.2	-174.3	178.2	-175.1	0	110.6
535	S	43.4	Very low	37.6	Very low	87 Å²	87	130.4 Å²	130.4	61%	0.608	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-68.6	154.1	-179.2	49.2	0	0	0	0	113.3	A537 V538	S535-A537 PolarHBondContact O-N 3.37Å; S535-A537 VanDerWaalsContact O-N 3.13Å; S535-V538 PolarHBondContact O-N 3.02Å
536	E	44.5	Very low	37.9	Very low	167 Å²	167	132 Å²	132	78%	0.78	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-23.4	-174.8	-69	-164.4	113.2	0	0	114.7	V538 K539	E536-V538 PolarHBondContact O-N 2.63Å; E536-V538 VanDerWaalsContact O-N 3.08Å; E536-K539 VanDerWaalsContact O-CB 3.28Å; E536-K539 WeakPolarHBondContact O-CB 3.18Å; E536-K539 PolarHBondContact O-N 2.83Å
537	A	41.8	Very low	38.2	Very low	81 Å²	81	128.1 Å²	128.1	67%	0.669	72%	0.722	S	S	*	*	H	α-helix	trans	-54.5	-30.7	-179.2	0	0	0	0	0	113.8	S535 K539	S535-A537 PolarHBondContact O-N 3.37Å; S535-A537 VanDerWaalsContact O-N 3.13Å; A537-K539 VanDerWaalsContact C-N 3.3Å; A537-K539 PolarHBondContact O-N 3.02Å
538	V	42.9	Very low	38.6	Very low	85 Å²	85	127.3 Å²	127.3	52%	0.515	72%	0.719	S	S	.	*	H	α-helix	trans	-80.2	-12.2	-179.9	-174	0	0	0	0	112.3	S535 E536	S535-V538 PolarHBondContact O-N 3.02Å; E536-V538 PolarHBondContact O-N 2.63Å; E536-V538 VanDerWaalsContact O-N 3.08Å
539	K	46.7	Very low	38.7	Very low	163 Å²	163	128 Å²	128	71%	0.709	72%	0.723	S	S	*	*	H	α-helix	trans	-88.7	-26.6	-168.7	-158.2	176	-179.1	-175.5	0	114.1	E536 A537	E536-K539 VanDerWaalsContact O-CB 3.28Å; E536-K539 WeakPolarHBondContact O-CB 3.18Å; E536-K539 PolarHBondContact O-N 2.83Å; A537-K539 VanDerWaalsContact C-N 3.3Å; A537-K539 PolarHBondContact O-N 3.02Å
540	E	45.2	Very low	39	Very low	105 Å²	105	130.4 Å²	130.4	49%	0.491	73%	0.728	S	S	.	*	H	α-helix	trans	-89	-35.9	-174.1	-169	58.3	-163.2	0	0	113.4	C542 R543	E540-C542 VanDerWaalsContact C-N 3.3Å; E540-C542 PolarHBondContact O-N 3.41Å; E540-R543 VanDerWaalsContact O-CB 3.25Å; E540-R543 WeakPolarHBondContact O-CB 3.28Å; E540-R543 PolarHBondContact O-N 2.68Å; E540-R543 VanDerWaalsContact O-N 3.11Å; E540-R543 IonicContact OE1-CZ 3.12Å; E540-R543 IonicContact OE1-NE 3.18Å; E540-R543 PolarHBondContact OE1-NE 2.82Å; E540-R543 IonicContact OE1-NH2 2.7Å; E540-R543 PolarHBondContact OE1-NH2 2.8Å; E540-R543 IonicContact OE2-NE 2.67Å; E540-R543 PolarHBondContact OE2-NE 2.87Å
541	E	46.7	Very low	39	Very low	158 Å²	158	129.4 Å²	129.4	74%	0.738	72%	0.722	S	S	*	*	H	α-helix	trans	-63.1	-36.2	176.9	-67.1	-160.8	133.2	0	0	112.6	R543 L544	E541-R543 PolarHBondContact O-N 2.7Å; E541-L544 PolarHBondContact O-N 3.41Å
542	C	41.6	Very low	39.2	Very low	89 Å²	89	128.7 Å²	128.7	60%	0.601	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-64.5	-11.6	177.5	-64.8	0	0	0	0	113.7	E540 L544	E540-C542 VanDerWaalsContact C-N 3.3Å; E540-C542 PolarHBondContact O-N 3.41Å; C542-L544 VanDerWaalsContact C-N 3.34Å
543	R	43.4	Very low	39.3	Very low	175 Å²	175	135.1 Å²	135.1	66%	0.66	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-80.2	-11.9	-178.9	-158.1	168.8	67.4	79.6	0.2	113.6	E540 E541	E540-R543 VanDerWaalsContact O-CB 3.25Å; E540-R543 WeakPolarHBondContact O-CB 3.28Å; E540-R543 PolarHBondContact O-N 2.68Å; E540-R543 VanDerWaalsContact O-N 3.11Å; E540-R543 IonicContact OE1-CZ 3.12Å; E540-R543 IonicContact OE1-NE 3.18Å; E540-R543 PolarHBondContact OE1-NE 2.82Å; E540-R543 IonicContact OE1-NH2 2.7Å; E540-R543 PolarHBondContact OE1-NH2 2.8Å; E540-R543 IonicContact OE2-NE 2.67Å; E540-R543 PolarHBondContact OE2-NE 2.87Å; E541-R543 PolarHBondContact O-N 2.7Å
544	L	42	Very low	38.9	Very low	148 Å²	148	134.6 Å²	134.6	78%	0.775	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-100.4	-5.9	-175.7	-69.9	172.1	0	0	0	115.1	E541 C542	E541-L544 PolarHBondContact O-N 3.41Å; C542-L544 VanDerWaalsContact C-N 3.34Å
545	L	40	Very low	38.7	Very low	152 Å²	152	133.1 Å²	133.1	80%	0.796	73%	0.728	S	S	*	*	S	Bend	trans	-110.7	13.9	-170.3	-84.9	166.4	0	0	0	115.9
546	N	35.9	Very low	38.1	Very low	155 Å²	155	137.5 Å²	137.5	83%	0.829	74%	0.736	S	S	*	*			trans	-130.7	88.7	173.4	-85.3	-65.8	0	0	0	111.9
547	A	34.6	Very low	37.3	Very low	95 Å²	95	138.7 Å²	138.7	79%	0.785	74%	0.741	S	S	*	*			trans	-121.4	121	170.3	0	0	0	0	0	110.1
548	P	37.3	Very low	36.6	Very low	115 Å²	115	142.6 Å²	142.6	75%	0.747	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-73	161.8	178.1	29.7	-34.2	0	0	0	112.7
549	P	33.8	Very low	36.8	Very low	129 Å²	129	143.6 Å²	143.6	84%	0.838	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-71.6	155.3	-166.9	27.9	-36.4	0	0	0	115.3
550	I	34.3	Very low	35.9	Very low	164 Å²	164	141.5 Å²	141.5	84%	0.841	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-98.9	125.8	-169.9	-58	170.2	0	0	0	112.3
551	P	30.6	Very low	35.1	Very low	109 Å²	109	142 Å²	142	71%	0.708	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-93.6	160.8	162.5	35.5	-31.6	0	0	0	112.8
552	P	36.7	Very low	35.1	Very low	111 Å²	111	140.6 Å²	140.6	72%	0.721	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-103.4	148.7	-157.6	37.5	-35.7	0	0	0	118
553	R	34.2	Very low	34.5	Very low	238 Å²	238	143.1 Å²	143.1	90%	0.898	79%	0.785	S	S	*	*			trans	58.8	122.7	152.2	-62.8	171.3	178.9	165	0.7	119.6
554	S	27.3	Very low	34.4	Very low	118 Å²	118	140.5 Å²	140.5	83%	0.825	79%	0.791	S	S	*	*				168.7	153.3	99.7	54	0	0	0	0	117.1
555	M	29.7	Very low	33.7	Very low	151 Å²	151	139.1 Å²	139.1	74%	0.744	79%	0.793	S	S	*	*			trans	24.2	118.5	149.2	-68.8	-71.4	175.9	0	0	124
556	K	31.4	Very low	33.1	Very low	179 Å²	179	141.2 Å²	141.2	78%	0.778	80%	0.796	S	S	*	*				61.5	145.5	126.3	-72.9	-178	178	177.2	0	123.6
557	Q	26.9	Very low	33.3	Very low	192 Å²	192	139.8 Å²	139.8	90%	0.897	80%	0.795	S	S	*	*			trans	104.6	157	150.3	-84.3	173	-24	0	0	121.2
558	L	26.4	Very low	33	Very low	164 Å²	164	145 Å²	145	86%	0.859	80%	0.795	S	S	*	*			trans	-141.3	-176.1	-167.4	-132.4	76.3	0	0	0	105.8
559	P	48.7	Very low	32.6	Very low	105 Å²	105	145.9 Å²	145.9	68%	0.682	79%	0.788	S	S	*	*			cis	-131.7	-176.2	-27.7	40.7	-25.8	0	0	0	112.9
560	S	26.3	Very low	32.4	Very low	119 Å²	119	146.6 Å²	146.6	83%	0.832	78%	0.781	S	S	*	*			trans	-157.3	144.5	139.6	63.6	0	0	0	0	111.4
561	V	29.5	Very low	32.2	Very low	117 Å²	117	144.3 Å²	144.3	71%	0.709	77%	0.77	S	S	*	*			trans	-151.5	128.7	-167.6	177.5	0	0	0	0	112.9	I563	V561-I563 HydrophobicContact CG1-CD1 4.22Å; V561-I563 HydrophobicContact CG1-CG1 4.12Å
562	P	45.5	Very low	32	Very low	127 Å²	127	144.4 Å²	144.4	83%	0.825	77%	0.769	S	S	*	*			trans	-123.7	156.7	151.5	36	-24.3	0	0	0	113.3
563	I	30.8	Very low	31.7	Very low	142 Å²	142	150.6 Å²	150.6	73%	0.728	78%	0.778	S	S	*	*			trans	-141.7	156.9	177	-53	162.1	0	0	0	105.1	V561	V561-I563 HydrophobicContact CG1-CD1 4.22Å; V561-I563 HydrophobicContact CG1-CG1 4.12Å
564	P	40.3	Very low	31.6	Very low	121 Å²	121	144.2 Å²	144.2	79%	0.786	77%	0.77	S	S	*	*				-169.3	150.8	79.4	41.2	-20	0	0	0	137.9
565	S	26.5	Very low	32.2	Very low	119 Å²	119	144 Å²	144	83%	0.832	77%	0.765	S	S	*	*			trans	-177.9	159.1	132.2	39.2	0	0	0	0	112.5
566	K	28.4	Very low	32.6	Very low	195 Å²	195	141.9 Å²	141.9	85%	0.848	77%	0.765	S	S	*	*			trans	-157.7	144.9	179.5	-120.5	177.8	-176.7	175.2	0	107.9
567	P	39.5	Very low	33.1	Very low	125 Å²	125	138.1 Å²	138.1	81%	0.812	76%	0.76	S	S	*	*				-148.6	174.8	90.7	27.9	-5.7	0	0	0	114.8
568	R	28.2	Very low	33.5	Very low	206 Å²	206	134.7 Å²	134.7	78%	0.777	75%	0.752	S	S	*	*			cis	-178.6	121.4	-26	173.5	178.5	177.8	-179.1	-2.9	111.8
569	Q	30.4	Very low	33.8	Very low	132 Å²	132	134.4 Å²	134.4	62%	0.617	75%	0.75	S	S	*	*			trans	65	157.4	161.1	-67.3	179.2	-93.6	0	0	116.7
570	Q	28.5	Very low	33.1	Very low	145 Å²	145	133.2 Å²	133.2	68%	0.678	74%	0.744	S	S	*	*			cis	-168.8	169.8	-8.8	-115.2	-173.6	-66.7	0	0	108.7
571	D	30	Very low	33.2	Very low	116 Å²	116	136.6 Å²	136.6	62%	0.62	74%	0.74	S	S	*	*			cis	-163.5	174.6	-17.9	-145.9	-26.2	0	0	0	111.6
572	T	27.6	Very low	33.2	Very low	111 Å²	111	142 Å²	142	68%	0.681	75%	0.749	S	S	*	*			trans	63.1	122.7	154.5	48.7	0	0	0	0	122.9
573	R	29.6	Very low	32.4	Very low	240 Å²	240	139.4 Å²	139.4	91%	0.906	74%	0.735	S	S	*	*			trans	71.2	144.3	142.5	-77.1	-177	169.1	169	-2.8	121.6
574	S	32.1	Very low	32.6	Very low	104 Å²	104	138.9 Å²	138.9	73%	0.727	74%	0.743	S	S	*	*			trans	-46.9	155.3	162	53.7	0	0	0	0	114.5
575	P	39.8	Very low	32	Very low	113 Å²	113	136.5 Å²	136.5	73%	0.734	74%	0.741	S	S	*	*			cis	-146	-178.6	43.3	42.4	-23.2	0	0	0	117.8
576	S	38.4	Very low	32.2	Very low	107 Å²	107	137.9 Å²	137.9	75%	0.748	74%	0.739	S	S	*	*			trans	-58.7	144.9	157	53.5	0	0	0	0	111.2
577	P	42.7	Very low	32.2	Very low	101 Å²	101	137.2 Å²	137.2	66%	0.656	74%	0.738	S	S	*	*				-159.6	155.9	106.5	41.3	-22.9	0	0	0	118.2
578	T	33.3	Very low	31.8	Very low	120 Å²	120	138.1 Å²	138.1	74%	0.736	74%	0.736	S	S	*	*			trans	52.4	165.4	136.9	62	0	0	0	0	125.2
579	L	34.1	Very low	31.8	Very low	157 Å²	157	134.9 Å²	134.9	82%	0.822	73%	0.733	S	S	*	*			trans	90.1	148.4	155.5	-60.1	163	0	0	0	117.9
580	S	34.2	Very low	31.5	Very low	80 Å²	80	134.6 Å²	134.6	56%	0.559	75%	0.745	S	S	*	*			cis	178.2	165.4	-42.6	53.2	0	0	0	0	112.2
581	Y	27.5	Very low	31.2	Very low	190 Å²	190	131.1 Å²	131.1	75%	0.745	75%	0.748	S	S	*	*			trans	65.7	134.1	147.9	-95.3	-81.8	0	0	0	120	S583	Y581-S583 WeakPolarHBondContact CD1-OG 3.46Å; Y581-S583 WeakPolarHBondContact CE1-OG 3.05Å
582	Y	29	Very low	31.1	Very low	230 Å²	230	130.2 Å²	130.2	90%	0.902	76%	0.757	S	S	*	*				-149.2	157.9	113.9	-118.3	-81	0	0	0	110.2
583	S	30.2	Very low	31	Very low	73 Å²	73	130.6 Å²	130.6	51%	0.51	76%	0.759	S	S	.	*			trans	-153.3	149.6	-176.4	-53.2	0	0	0	0	111	Y581	Y581-S583 WeakPolarHBondContact CD1-OG 3.46Å; Y581-S583 WeakPolarHBondContact CE1-OG 3.05Å
584	S	33.3	Very low	30.8	Very low	131 Å²	131	128.3 Å²	128.3	92%	0.916	76%	0.759	S	S	*	*			trans	63.5	164.7	167.1	-53.4	0	0	0	0	115.5
585	G	27.9	Very low	30.9	Very low	72 Å²	72	132 Å²	132	74%	0.742	77%	0.765	S	S	*	*			cis	177	171.5	-7.2	0	0	0	0	0	111.7
586	L	31.7	Very low	30.2	Very low	148 Å²	148	136.5 Å²	136.5	78%	0.775	78%	0.776	S	S	*	*			trans	1.2	129.3	164.6	-65.8	161.5	0	0	0	119.4
587	H	28.6	Very low	29.5	Very low	181 Å²	181	134.7 Å²	134.7	84%	0.838	78%	0.775	S	S	*	*				179.9	-178.8	100.9	-91.1	-63.2	0	0	0	111.7
588	N	30.9	Very low	28.8	Very low	144 Å²	144	134.7 Å²	134.7	77%	0.77	78%	0.783	S	S	*	*			trans	-140.3	160	-158.5	-167.5	12.6	0	0	0	113.3
589	I	28	Very low	28.5	Very low	138 Å²	138	137 Å²	137	71%	0.708	79%	0.785	S	S	*	*			trans	65.5	104.2	168.6	-40	-178.2	0	0	0	117.6
590	S	23.6	Very low	28.2	Very low	125 Å²	125	135.9 Å²	135.9	87%	0.874	78%	0.779	S	S	*	*				-173.2	147	120.6	-77.8	0	0	0	0	109
591	G	23.2	Very low	27.8	Very low	72 Å²	72	138.6 Å²	138.6	74%	0.742	78%	0.783	S	S	*	*			trans	-123.2	164.5	-171.4	0	0	0	0	0	114.3
592	A	27.8	Very low	27.8	Very low	97 Å²	97	136.1 Å²	136.1	80%	0.802	78%	0.779	S	S	*	*			trans	58.6	143.6	173.9	0	0	0	0	0	115.4
593	T	25.3	Very low	27.6	Very low	119 Å²	119	132.3 Å²	132.3	73%	0.73	77%	0.769	S	S	*	*			cis	-158.9	145.7	39.7	-51.2	0	0	0	0	109.1
594	E	25.2	Very low	27.5	Very low	193 Å²	193	133 Å²	133	90%	0.902	77%	0.774	S	S	*	*				-179.8	155	119.2	-96.7	174.4	-165.6	0	0	111.7
595	Q	34.2	Very low	27.1	Very low	182 Å²	182	135.4 Å²	135.4	85%	0.85	77%	0.77	S	S	*	*			trans	-160.8	115.5	-153.4	170.1	-166.5	-13.7	0	0	109.5
596	E	24.3	Very low	27.1	Very low	206 Å²	206	138.1 Å²	138.1	96%	0.963	77%	0.772	S	S	*	*			trans	-168	172.5	153.7	-115.1	169.5	-179.6	0	0	109.1
597	G	25.1	Very low	26.8	Very low	70 Å²	70	137.1 Å²	137.1	72%	0.722	78%	0.776	S	S	*	*			trans	175	-149.1	-177.9	0	0	0	0	0	114.7
598	A	27	Very low	26.7	Very low	100 Å²	100	138.8 Å²	138.8	83%	0.826	78%	0.776	S	S	*	*			trans	76.1	119.5	179.7	0	0	0	0	0	116.9
599	E	27.1	Very low	27.5	Very low	168 Å²	168	137.3 Å²	137.3	79%	0.785	77%	0.774	S	S	*	*				145.3	119.4	118.6	-73.6	-122.2	114.3	0	0	114.9
600	L	27.9	Very low	27.4	Very low	134 Å²	134	136.9 Å²	136.9	70%	0.702	78%	0.783	S	S	*	*			trans	63.4	151.4	150.6	-79.4	74.2	0	0	0	119.3
601	Q	25.5	Very low	27.6	Very low	138 Å²	138	135.9 Å²	135.9	65%	0.645	78%	0.775	S	S	*	*			cis	-164	150.5	-10.5	162.6	171.4	-15.7	0	0	110.9
602	E	27	Very low	27.9	Very low	138 Å²	138	145.2 Å²	145.2	65%	0.645	79%	0.788	S	S	*	*			trans	66.8	153.6	166.5	-82.7	176.6	95.8	0	0	119
603	Q	26.4	Very low	27.9	Very low	150 Å²	150	143 Å²	143	70%	0.701	78%	0.775	S	S	*	*			cis	-149.2	140	8.6	-148.6	170.2	63.9	0	0	112.8
604	S	26.2	Very low	28	Very low	87 Å²	87	145 Å²	145	61%	0.608	78%	0.781	S	S	*	*			trans	53	141.7	159.3	57.7	0	0	0	0	120.6
605	H	25.9	Very low	28	Very low	181 Å²	181	141 Å²	141	84%	0.838	78%	0.781	S	S	*	*			cis	-129.9	155.6	12.9	-65.3	-101.9	0	0	0	111.7
606	V	28.3	Very low	27.6	Very low	129 Å²	129	137.2 Å²	137.2	78%	0.782	78%	0.775	S	S	*	*			trans	-137.6	135.7	176.9	177.5	0	0	0	0	110.5
607	C	24.9	Very low	27.6	Very low	128 Å²	128	133.9 Å²	133.9	87%	0.865	77%	0.769	S	S	*	*			trans	-141.5	121.2	159.3	-82.5	0	0	0	0	108.8
608	Y	26.4	Very low	27.6	Very low	216 Å²	216	136.4 Å²	136.4	85%	0.847	77%	0.771	S	S	*	*			trans	-160.2	168.9	-178	-111.9	-53.3	0	0	0	108.3
609	P	49.1	Very low	27.6	Very low	112 Å²	112	140.6 Å²	140.6	73%	0.727	77%	0.773	S	S	*	*				-102.6	173.9	-103	39.5	-34.8	0	0	0	113.6
610	C	24.3	Very low	27.5	Very low	130 Å²	130	141.9 Å²	141.9	88%	0.878	78%	0.776	S	S	*	*			trans	-152	152.4	146.5	-144.4	0	0	0	0	113
611	S	29.2	Very low	27.3	Very low	103 Å²	103	147.2 Å²	147.2	72%	0.72	79%	0.787	S	S	*	*			trans	-82.1	149.5	177.2	50.4	0	0	0	0	112.4
612	W	27.9	Very low	27.4	Very low	268 Å²	268	145.7 Å²	145.7	100%	1.015	80%	0.798	S	S	*	*			trans	-77.5	126.1	163.3	-124.7	-47.6	0	0	0	110.5
613	G	28.9	Very low	27.4	Very low	51 Å²	51	145.3 Å²	145.3	53%	0.526	81%	0.805	S	S	.	*			trans	-160.3	146.6	172.4	0	0	0	0	0	111.3
614	N	28.1	Very low	27.5	Very low	160 Å²	160	143.3 Å²	143.3	86%	0.856	81%	0.807	S	S	*	*			trans	74.8	108.9	172.7	-50.8	-24.2	0	0	0	117.7
615	A	24.5	Very low	28.2	Very low	110 Å²	110	144.2 Å²	144.2	91%	0.909	81%	0.812	S	S	*	*				-111.3	137.5	124.9	0	0	0	0	0	107
616	S	24.6	Very low	28.2	Very low	103 Å²	103	141.6 Å²	141.6	72%	0.72	81%	0.813	S	S	*	*			trans	-136.7	117.7	-170.1	59.7	0	0	0	0	112.9
617	T	24.3	Very low	28.1	Very low	136 Å²	136	139.3 Å²	139.3	83%	0.834	82%	0.816	S	S	*	*			trans	-153.7	115	158	25.3	0	0	0	0	111.1
618	T	26.6	Very low	28.2	Very low	123 Å²	123	136.8 Å²	136.8	76%	0.755	81%	0.811	S	S	*	*			trans	43.2	108.3	134.4	-32.6	0	0	0	0	119.4
619	E	25.8	Very low	28.8	Very low	188 Å²	188	132.5 Å²	132.5	88%	0.879	81%	0.81	S	S	*	*				-165.1	-178.6	99.6	-102.7	-160.3	164.9	0	0	113
620	K	26	Very low	28.4	Very low	195 Å²	195	132 Å²	132	85%	0.848	81%	0.807	S	S	*	*			trans	-132.4	132.9	-163.6	-68.3	175.7	179.5	170.3	0	114.1
621	R	23.7	Very low	28.7	Very low	246 Å²	246	132.8 Å²	132.8	93%	0.928	80%	0.802	S	S	*	*			trans	60.3	105.7	131.6	-170.7	-163.1	-157.1	-178.4	8.1	119.2
622	A	27.6	Very low	28.6	Very low	105 Å²	105	136.6 Å²	136.6	87%	0.868	81%	0.808	S	S	*	*			trans	-149.3	155.2	146.8	0	0	0	0	0	112
623	T	26.4	Very low	28.5	Very low	130 Å²	130	126.9 Å²	126.9	80%	0.798	79%	0.791	S	S	*	*			trans	-105	152.5	-160.3	5.8	0	0	0	0	115.9
624	S	28.5	Very low	28.6	Very low	108 Å²	108	131.1 Å²	131.1	76%	0.755	81%	0.807	S	S	*	*			trans	77.3	176.7	140.7	81.8	0	0	0	0	118.5
625	P	41.8	Very low	28.5	Very low	107 Å²	107	129.4 Å²	129.4	70%	0.695	81%	0.807	S	S	*	*				-139.7	-178.7	-104.9	40.3	-18.5	0	0	0	117.1
626	S	24.9	Very low	28.8	Very low	125 Å²	125	128.9 Å²	128.9	87%	0.874	80%	0.797	S	S	*	*			trans	67.9	125.5	153.8	-56.1	0	0	0	0	120.6
627	G	26.8	Very low	29.2	Very low	81 Å²	81	135.3 Å²	135.3	84%	0.835	81%	0.805	S	S	*	*			trans	150.1	116.8	148.9	0	0	0	0	0	118.6
628	G	26.1	Very low	29.4	Very low	75 Å²	75	135.5 Å²	135.5	77%	0.773	80%	0.8	S	S	*	*			trans	86.8	131.6	140.9	0	0	0	0	0	120.5
629	P	39	Very low	29.5	Very low	127 Å²	127	135.1 Å²	135.1	83%	0.825	80%	0.803	S	S	*	*			trans	-100.5	-163.7	164.8	44.7	-37	0	0	0	110.2
630	P	41.8	Very low	29.6	Very low	101 Å²	101	137 Å²	137	66%	0.656	80%	0.802	S	S	*	*			cis	-141.5	176.6	2.9	44.4	-26.6	0	0	0	118.3
631	L	29.4	Very low	30	Very low	147 Å²	147	132.5 Å²	132.5	77%	0.77	79%	0.793	S	S	*	*			trans	59	143.9	156.8	-65.8	145.6	0	0	0	119.3
632	E	26.9	Very low	30.1	Very low	182 Å²	182	128.1 Å²	128.1	85%	0.85	79%	0.788	S	S	*	*			cis	-165.8	150.4	-22.5	-174.5	163.4	-124.4	0	0	109.2
633	G	27.1	Very low	30.1	Very low	64 Å²	64	129.1 Å²	129.1	66%	0.66	78%	0.778	S	S	*	*			trans	155.1	138.6	165.1	0	0	0	0	0	116.2
634	V	30.2	Very low	30.2	Very low	141 Å²	141	130.9 Å²	130.9	86%	0.855	78%	0.775	S	S	*	*			trans	62	87.7	169.8	-164.1	0	0	0	0	116.2
635	S	26.1	Very low	30.2	Very low	123 Å²	123	133.4 Å²	133.4	86%	0.86	78%	0.779	S	S	*	*			trans	-90.2	145.1	159.3	-174	0	0	0	0	110.9
636	S	30.7	Very low	29.4	Very low	100 Å²	100	132.2 Å²	132.2	70%	0.699	79%	0.785	S	S	*	*			trans	-114.5	134.7	-175.2	-76.7	0	0	0	0	113.5
637	R	33	Very low	29.4	Very low	237 Å²	237	129.2 Å²	129.2	89%	0.894	78%	0.775	S	S	*	*			trans	10	114.2	158.6	-58	177.6	-179.1	-120.3	1.2	117.3
638	L	28.8	Very low	29.5	Very low	140 Å²	140	133.3 Å²	133.3	73%	0.733	78%	0.778	S	S	*	*				-178.3	150.1	100.2	-92.8	166.9	0	0	0	110.6	W640	L638-W640 VanDerWaalsContact O-CD1 3.24Å; L638-W640 PolarHBondContact O-N 3.48Å
639	S	29.7	Very low	29.6	Very low	115 Å²	115	133.1 Å²	133.1	80%	0.804	77%	0.768	S	S	*	*			trans	19.2	94.2	165	56.1	0	0	0	0	118.1
640	W	26.6	Very low	29.1	Very low	229 Å²	229	135.6 Å²	135.6	87%	0.867	77%	0.769	S	S	*	*			trans	-99.6	137.8	174	-85.2	80.6	0	0	0	113.5	L638	L638-W640 VanDerWaalsContact O-CD1 3.24Å; L638-W640 PolarHBondContact O-N 3.48Å
641	P	34.8	Very low	28.3	Very low	100 Å²	100	135.7 Å²	135.7	65%	0.649	77%	0.77	S	S	*	*			trans	-88.1	-170.6	169.3	39.4	-36.8	0	0	0	110.7
642	N	25.1	Very low	28.2	Very low	154 Å²	154	134.4 Å²	134.4	82%	0.824	77%	0.769	S	S	*	*			trans	-149.7	126.2	150.6	-120.5	-27.5	0	0	0	113.6
643	N	27.9	Very low	28.2	Very low	125 Å²	125	132.5 Å²	132.5	67%	0.668	76%	0.764	S	S	*	*			trans	175.4	132.8	174.1	-95.3	-18.1	0	0	0	103.7
644	F	28.1	Very low	28.2	Very low	168 Å²	168	136.2 Å²	136.2	74%	0.737	76%	0.764	S	S	*	*			cis	-159.8	161.3	16.1	-105.4	-56.1	0	0	0	111.5
645	I	29.6	Very low	28.1	Very low	161 Å²	161	137.8 Å²	137.8	83%	0.826	76%	0.76	S	S	*	*			trans	70.3	134.7	143.6	-69.1	163.1	0	0	0	121.2
646	G	24.5	Very low	27.9	Very low	81 Å²	81	138 Å²	138	84%	0.835	76%	0.756	S	S	*	*			trans	167.1	110.4	154.2	0	0	0	0	0	111
647	G	25.8	Very low	28.3	Very low	63 Å²	63	138.5 Å²	138.5	65%	0.649	76%	0.757	S	S	*	*			cis	-171.9	-179	-3.8	0	0	0	0	0	112.6
648	D	27.4	Very low	27.9	Very low	167 Å²	167	133.5 Å²	133.5	89%	0.893	75%	0.752	S	S	*	*			trans	65.6	143.9	169.3	-60.7	-22.4	0	0	0	119.1
649	A	28.7	Very low	27.8	Very low	70 Å²	70	132.3 Å²	132.3	58%	0.579	76%	0.756	S	S	*	*			cis	-149.3	141.6	6.4	0	0	0	0	0	114.2
650	H	29.1	Very low	27.5	Very low	180 Å²	180	132.3 Å²	132.3	83%	0.833	75%	0.754	S	S	*	*			trans	58.3	144.6	154.8	-46.8	-51.5	0	0	0	119.8
651	C	25.7	Very low	27.5	Very low	102 Å²	102	133.1 Å²	133.1	69%	0.689	76%	0.758	S	S	*	*			cis	-158.6	150.4	-4.8	-135.9	0	0	0	0	111.6
652	T	27.1	Very low	26.9	Very low	120 Å²	120	132.7 Å²	132.7	74%	0.736	76%	0.757	S	S	*	*			trans	31.6	131.6	148.8	53.4	0	0	0	0	121.1
653	D	26.4	Very low	26.9	Very low	142 Å²	142	136 Å²	136	76%	0.759	76%	0.759	S	S	*	*			cis	178.8	171.7	2.9	-143	-32.3	0	0	0	111.4
654	E	27	Very low	26.7	Very low	142 Å²	142	139.3 Å²	139.3	66%	0.664	77%	0.768	S	S	*	*			trans	49.9	99.1	149.2	-100.2	-176.3	172.7	0	0	123.8
655	F	27.6	Very low	26.6	Very low	174 Å²	174	136.7 Å²	136.7	76%	0.763	77%	0.771	S	S	*	*				175	150.2	94.2	-101.9	-74.3	0	0	0	114
656	V	23.1	Very low	26.6	Very low	129 Å²	129	140.1 Å²	140.1	78%	0.782	78%	0.775	S	S	*	*			trans	-158.8	159.4	-161	162.1	0	0	0	0	108.2
657	P	38.6	Very low	27	Very low	109 Å²	109	141.7 Å²	141.7	71%	0.708	77%	0.77	S	S	*	*			cis	-133.6	-164.2	6.4	24.5	2.7	0	0	0	116.8
658	V	24.2	Very low	27.3	Very low	132 Å²	132	150.2 Å²	150.2	80%	0.8	78%	0.783	S	S	*	*			trans	110.2	105	143.5	-169.3	0	0	0	0	119.8
659	S	26.6	Very low	27.4	Very low	115 Å²	115	152.1 Å²	152.1	80%	0.804	78%	0.783	S	S	*	*				162.7	155.7	119.5	-167.1	0	0	0	0	111.5
660	C	22.8	Very low	27.4	Very low	115 Å²	115	160.6 Å²	160.6	78%	0.777	80%	0.8	S	S	*	*			trans	-125	144.6	-170.6	-58.5	0	0	0	0	113.6
661	R	26.9	Very low	27.4	Very low	247 Å²	247	158.3 Å²	158.3	93%	0.932	80%	0.799	S	S	*	*				177	134.9	122.3	-99	169.8	-176.8	-155.8	0.3	114.8
662	S	22.6	Very low	27.6	Very low	90 Å²	90	159.8 Å²	159.8	63%	0.629	81%	0.807	S	S	*	*			trans	34.6	123.9	138.3	-178.8	0	0	0	0	121.1
663	Y	25	Very low	27.6	Very low	225 Å²	225	159.5 Å²	159.5	88%	0.882	81%	0.81	S	S	*	*				-162.8	154.9	107.9	-118.2	-81	0	0	0	113.2
664	F	24.6	Very low	27.7	Very low	194 Å²	194	158.9 Å²	158.9	85%	0.851	82%	0.817	S	S	*	*			trans	-78.5	135.1	173.8	-85.4	-107.5	0	0	0	112
665	S	26.5	Very low	27.7	Very low	113 Å²	113	157 Å²	157	79%	0.79	82%	0.819	S	S	*	*			trans	-169.6	132.7	157.3	-84.6	0	0	0	0	112.1
666	Y	27.8	Very low	27.7	Very low	232 Å²	232	157.8 Å²	157.8	91%	0.91	82%	0.822	S	S	*	*			trans	-147.2	158.6	169.3	-95.7	-54.9	0	0	0	109.4
667	P	34.7	Very low	27.9	Very low	114 Å²	114	157.5 Å²	157.5	74%	0.74	82%	0.821	S	S	*	*				-120.3	160.8	-113.3	38.2	-26.7	0	0	0	115.5
668	R	31	Very low	27.2	Very low	243 Å²	243	157.7 Å²	157.7	92%	0.917	82%	0.824	S	S	*	*			trans	-73.6	139.8	171.4	-60.6	178	-174.1	154.2	2.4	110.8
669	K	28.5	Very low	27.4	Very low	207 Å²	207	155.8 Å²	155.8	90%	0.9	82%	0.822	S	S	*	*			trans	-73.3	146.5	163.5	-66.5	-174.4	178.3	-178.9	0	110.2
670	R	29.2	Very low	27.3	Very low	247 Å²	247	158.5 Å²	158.5	93%	0.932	83%	0.826	S	S	*	*			trans	-126.3	146.3	167.1	-97.9	-176.2	169	171.2	-4	109.2
671	T	29.2	Very low	27.5	Very low	133 Å²	133	158.7 Å²	158.7	82%	0.816	83%	0.828	S	S	*	*			trans	-77.3	156	169.2	37.3	0	0	0	0	111.2
672	P	30.6	Very low	27.5	Very low	133 Å²	133	154.2 Å²	154.2	86%	0.864	82%	0.822	S	S	*	*			trans	-82.6	131.3	-173.9	32	-34.4	0	0	0	112.8
673	S	26.3	Very low	27.8	Very low	114 Å²	114	156.6 Å²	156.6	80%	0.797	83%	0.828	S	S	*	*			trans	-107.4	133	162.6	57.2	0	0	0	0	109.5
674	S	30	Very low	28	Very low	128 Å²	128	152.5 Å²	152.5	90%	0.895	82%	0.821	S	S	*	*			trans	-70.5	163.1	-178.7	47	0	0	0	0	113.3
675	S	26	Very low	28.3	Very low	102 Å²	102	153.4 Å²	153.4	71%	0.713	82%	0.821	S	S	*	*			trans	-98.3	149.7	-163.1	50.3	0	0	0	0	115.1
676	K	28.3	Very low	28.5	Very low	191 Å²	191	155.4 Å²	155.4	83%	0.83	82%	0.822	S	S	*	*				179.6	117	124.5	-93.1	151.6	-171.1	179	0	112.7
677	T	25.7	Very low	28.5	Very low	123 Å²	123	147.4 Å²	147.4	76%	0.755	81%	0.81	S	S	*	*				32.7	128.7	110.4	-37.7	0	0	0	0	116.8
678	C	25.8	Very low	28.3	Very low	113 Å²	113	152.3 Å²	152.3	76%	0.764	81%	0.814	S	S	*	*			cis	-158.5	165.4	24.7	-142.8	0	0	0	0	115.5
679	A	27.2	Very low	28.2	Very low	93 Å²	93	147 Å²	147	77%	0.769	80%	0.799	S	S	*	*			trans	45.4	151.4	140.6	0	0	0	0	0	124.1
680	I	24.9	Very low	28.3	Very low	172 Å²	172	144.5 Å²	144.5	88%	0.882	80%	0.795	S	S	*	*			trans	-104	140.8	171.1	-61.9	159.4	0	0	0	108.8
681	S	26	Very low	28.2	Very low	118 Å²	118	136.3 Å²	136.3	83%	0.825	78%	0.78	S	S	*	*			trans	-153.6	139.2	150.8	57.5	0	0	0	0	111.4
682	L	27.6	Very low	28.1	Very low	153 Å²	153	135 Å²	135	80%	0.801	78%	0.776	S	S	*	*			trans	-94.6	142.5	170.9	-172.2	78.4	0	0	0	108.3
683	D	29	Very low	27.8	Very low	140 Å²	140	136.2 Å²	136.2	75%	0.749	77%	0.769	S	S	*	*				161.5	141.1	129.2	-80.5	-24	0	0	0	114.5
684	D	30	Very low	28	Very low	140 Å²	140	139.9 Å²	139.9	75%	0.749	77%	0.765	S	S	*	*			trans	26.5	147	158.2	-81.1	-24.3	0	0	0	127.5
685	Y	30.5	Very low	27.8	Very low	213 Å²	213	137.5 Å²	137.5	84%	0.835	76%	0.762	S	S	*	*			trans	7.2	143.5	139.4	-77.6	-95	0	0	0	119
686	D	30	Very low	27.9	Very low	155 Å²	155	138.5 Å²	138.5	83%	0.829	76%	0.755	S	S	*	*			cis	-160.6	-173.8	29.8	-173	12.4	0	0	0	108.6
687	G	28.7	Very low	27.8	Very low	63 Å²	63	138.4 Å²	138.4	65%	0.649	76%	0.755	S	S	*	*			trans	119.7	97	150.9	0	0	0	0	0	118.5
688	R	30.1	Very low	28.1	Very low	218 Å²	218	137 Å²	137	82%	0.823	75%	0.75	S	S	*	*			trans	-37.9	165.1	145.5	-60.2	-148.6	-153.4	-178.1	4.5	115.4
689	E	29.3	Very low	28.4	Very low	131 Å²	131	138.7 Å²	138.7	61%	0.612	75%	0.751	S	S	*	*			cis	-167.9	158.7	5.4	-119.2	169.8	-147	0	0	109.2
690	L	29.4	Very low	28.6	Very low	155 Å²	155	140.7 Å²	140.7	81%	0.812	74%	0.744	S	S	*	*			trans	50.8	161.4	154.2	-82.6	77.8	0	0	0	121.3
691	A	28.6	Very low	28.7	Very low	74 Å²	74	141 Å²	141	61%	0.612	74%	0.739	S	S	*	*			cis	-174.2	173.1	-28.1	0	0	0	0	0	111
692	C	25.4	Very low	28.7	Very low	107 Å²	107	138.7 Å²	138.7	72%	0.723	73%	0.734	S	S	*	*			trans	68.9	156.4	160.4	-67.2	0	0	0	0	117.8
693	H	26.1	Very low	29.4	Very low	158 Å²	158	137.4 Å²	137.4	73%	0.731	73%	0.734	S	S	*	*			cis	-139.1	140.3	-7.3	-100.6	-41	0	0	0	108.2
694	R	29.3	Very low	29.6	Very low	190 Å²	190	135.7 Å²	135.7	72%	0.717	73%	0.729	S	S	*	*				62.4	117.3	80.1	-173.5	-171.1	-82.9	-88.3	2.8	115	E696	R694-E696 IonicContact CZ-OE1 3.99Å; R694-E696 IonicContact NH1-OE1 2.76Å; R694-E696 PolarHBondContact NH1-OE1 3.11Å; R694-E696 IonicContact NH1-OE2 3.53Å
695	G	26.5	Very low	29.6	Very low	79 Å²	79	135.8 Å²	135.8	81%	0.814	73%	0.73	S	S	*	*			trans	-179.7	137.6	168.7	0	0	0	0	0	109.8
696	E	27.1	Very low	29.7	Very low	123 Å²	123	133.6 Å²	133.6	58%	0.575	73%	0.727	S	S	*	*				-144.2	172.7	-124.8	-161.5	158.8	-137.4	0	0	114.6	R694	R694-E696 IonicContact CZ-OE1 3.99Å; R694-E696 IonicContact NH1-OE1 2.76Å; R694-E696 PolarHBondContact NH1-OE1 3.11Å; R694-E696 IonicContact NH1-OE2 3.53Å
697	F	27.9	Very low	29.5	Very low	188 Å²	188	133.5 Å²	133.5	83%	0.825	73%	0.725	S	S	*	*			trans	75.9	148	174.2	-60.1	-78.8	0	0	0	117.8
698	S	31	Very low	29.4	Very low	94 Å²	94	135.4 Å²	135.4	66%	0.657	73%	0.727	S	S	*	*			cis	-160.6	134.1	-1.5	143.4	0	0	0	0	113.4
699	L	32.7	Very low	29.2	Very low	148 Å²	148	133 Å²	133	78%	0.775	73%	0.729	S	S	*	*			trans	40.7	150.1	142.8	-90.4	56	0	0	0	121.9
700	Q	30.6	Very low	29.1	Very low	136 Å²	136	135.5 Å²	135.5	64%	0.636	74%	0.738	S	S	*	*			cis	-158.5	157	29.8	-143.5	180	69.1	0	0	114.8
701	K	28.2	Very low	29	Very low	179 Å²	179	133.3 Å²	133.3	78%	0.778	74%	0.736	S	S	*	*			trans	74.4	111.4	157.2	-80.4	157.8	179.4	154.1	0	121.7
702	G	25.3	Very low	29	Very low	69 Å²	69	135.2 Å²	135.2	71%	0.711	75%	0.745	S	S	*	*			trans	-91	-147.8	150.1	0	0	0	0	0	111.7
703	P	42.2	Very low	29.1	Very low	125 Å²	125	135.2 Å²	135.2	81%	0.812	75%	0.745	S	S	*	*			cis	-136.2	-165.3	37.9	40.7	-23.1	0	0	0	115.6
704	T	32.6	Very low	29.1	Very low	105 Å²	105	137.8 Å²	137.8	64%	0.644	75%	0.75	S	S	*	*				-154.6	-174.8	-70.4	-42.1	0	0	0	0	108.4
705	D	29.4	Very low	29.1	Very low	141 Å²	141	134.9 Å²	134.9	75%	0.754	75%	0.749	S	S	*	*			trans	83.1	103.7	161.8	-53.1	-20	0	0	0	116.4
706	Q	32.9	Very low	29.1	Very low	167 Å²	167	136.4 Å²	136.4	78%	0.78	75%	0.747	S	S	*	*			cis	78.5	130	27.6	-140.2	175.8	105.8	0	0	111.8
707	I	26.8	Very low	29.4	Very low	154 Å²	154	138.3 Å²	138.3	79%	0.79	76%	0.756	S	S	*	*				-157.7	164.5	70.4	-83.7	167.7	0	0	0	112.8
708	C	25.6	Very low	29.5	Very low	102 Å²	102	136.6 Å²	136.6	69%	0.689	75%	0.753	S	S	*	*			trans	-117.8	157.6	-177.1	167.1	0	0	0	0	112.2
709	I	25.7	Very low	29.4	Very low	169 Å²	169	143.3 Å²	143.3	87%	0.867	77%	0.765	S	S	*	*			trans	-159.8	164.4	151	-107	153.8	0	0	0	111.6
710	K	28.7	Very low	29.3	Very low	182 Å²	182	146.4 Å²	146.4	79%	0.791	77%	0.766	S	S	*	*			trans	-107.5	152.9	-163	-60.1	175.2	179.4	176.3	0	115.1
711	S	27.5	Very low	29.1	Very low	110 Å²	110	147.5 Å²	147.5	77%	0.769	78%	0.777	S	S	*	*			trans	38.2	126.4	142.8	-50.9	0	0	0	0	122.1
712	S	27.3	Very low	29.5	Very low	114 Å²	114	147.2 Å²	147.2	80%	0.797	78%	0.775	S	S	*	*				173.4	151.1	106.2	47.2	0	0	0	0	116.1
713	S	28	Very low	30	Very low	106 Å²	106	149.6 Å²	149.6	74%	0.741	78%	0.779	S	S	*	*			trans	16.2	119.7	154.8	57.9	0	0	0	0	123.8
714	Y	26.5	Very low	29.6	Very low	212 Å²	212	149.2 Å²	149.2	83%	0.831	77%	0.769	S	S	*	*				70.4	142.2	114.1	-150	-105.9	0	0	0	122.3
715	N	28.3	Very low	29.4	Very low	129 Å²	129	153.7 Å²	153.7	69%	0.69	78%	0.782	S	S	*	*			trans	88.7	108.9	158.3	-115.3	-10.7	0	0	0	122.2
716	S	27.6	Very low	29.5	Very low	111 Å²	111	154 Å²	154	78%	0.776	78%	0.779	S	S	*	*			trans	73.9	169.5	136.1	-142.8	0	0	0	0	121.9
717	E	33.8	Very low	29.3	Very low	164 Å²	164	151.5 Å²	151.5	77%	0.766	78%	0.78	S	S	*	*			trans	-106.2	177.4	-158.5	-56.3	177.5	102.4	0	0	115.1
718	M	29.6	Very low	29.6	Very low	152 Å²	152	150 Å²	150	75%	0.749	77%	0.774	S	S	*	*			trans	71.2	110.6	169.5	-54.3	-69.9	166.4	0	0	115.3
719	Y	28.2	Very low	29.9	Very low	235 Å²	235	150.1 Å²	150.1	92%	0.922	77%	0.771	S	S	*	*				-159.4	167.6	69.8	-113.7	-91.9	0	0	0	114.5
720	R	31.3	Very low	30.6	Very low	212 Å²	212	150.1 Å²	150.1	80%	0.8	77%	0.765	S	S	*	*			trans	-96.4	143.5	179.2	176.2	-155	-74.2	-172.8	-4.4	111.6
721	N	26.4	Very low	30.9	Very low	160 Å²	160	148.8 Å²	148.8	86%	0.856	76%	0.761	S	S	*	*			trans	-170.8	158.4	133.6	-93.4	-25.1	0	0	0	114.9
722	K	35.1	Very low	31.1	Very low	172 Å²	172	147.9 Å²	147.9	75%	0.748	76%	0.755	S	S	*	*			trans	-106.4	176.7	176.7	-56.7	-174.8	176.6	-174.1	0	110.6	I724	K722-I724 HydrophobicContact CB-CD1 4.46Å; K722-I724 HydrophobicContact CB-CG1 4.12Å; K722-I724 HydrophobicContact CD-CG1 4.05Å
723	P	37.1	Very low	31.3	Very low	120 Å²	120	150 Å²	150	78%	0.779	76%	0.757	S	S	*	*				-118.3	154.3	75.4	1.2	21.2	0	0	0	112.1
724	I	33.9	Very low	31.5	Very low	117 Å²	117	150.1 Å²	150.1	60%	0.6	76%	0.757	S	S	*	*			cis	81.8	113.8	41.1	-59.2	166.7	0	0	0	113.4	K722 E726	K722-I724 HydrophobicContact CB-CD1 4.46Å; K722-I724 HydrophobicContact CB-CG1 4.12Å; K722-I724 HydrophobicContact CD-CG1 4.05Å; I724-E726 HydrophobicContact CG2-CG 3.58Å
725	E	27.1	Very low	31.9	Very low	198 Å²	198	145.4 Å²	145.4	93%	0.925	76%	0.755	S	S	*	*			trans	-127.6	157.6	136.5	-170.6	160.3	-141.9	0	0	107.3
726	E	32.7	Very low	32.8	Very low	148 Å²	148	145.4 Å²	145.4	69%	0.692	76%	0.762	S	S	*	*			trans	-125.2	158.7	-158.7	-55.6	-172.4	137.6	0	0	114.2	I724	I724-E726 HydrophobicContact CG2-CG 3.58Å
727	S	28.9	Very low	33.1	Very low	115 Å²	115	147.3 Å²	147.3	80%	0.804	76%	0.761	S	S	*	*				154.6	155.3	129.2	52.6	0	0	0	0	111.7
728	N	32.8	Very low	33.1	Very low	123 Å²	123	147.1 Å²	147.1	66%	0.658	77%	0.765	S	S	*	*			cis	-169	149.7	-37.9	-113.1	-54.3	0	0	0	104.3
729	T	31.5	Very low	34.4	Very low	103 Å²	103	145.1 Å²	145.1	63%	0.632	76%	0.763	S	S	*	*			cis	-163.4	145	38.7	41.4	0	0	0	0	112.8
730	K	39.3	Very low	35.1	Very low	170 Å²	170	140.2 Å²	140.2	74%	0.739	76%	0.76	S	S	*	*				58.9	142.2	129.9	-58.5	172.7	-177.7	176.6	0	120.2
731	Q	35.2	Very low	35.2	Very low	153 Å²	153	141.2 Å²	141.2	72%	0.715	76%	0.764	S	S	*	*			cis	-170.3	-176.2	-0.4	-117.3	172.9	-120.5	0	0	107.3
732	S	31.8	Very low	35.6	Very low	91 Å²	91	139.7 Å²	139.7	64%	0.636	76%	0.76	S	S	*	*			cis	-172.5	162.3	-4.6	36.2	0	0	0	0	107.2
733	L	31.9	Very low	35.7	Very low	159 Å²	159	138 Å²	138	83%	0.832	77%	0.767	S	S	*	*			cis	-145.9	-120.4	-2.6	-121.7	168.2	0	0	0	110.8
734	S	31.8	Very low	35.3	Very low	108 Å²	108	141.6 Å²	141.6	76%	0.755	77%	0.77	S	S	*	*			trans	-162.6	174.8	-167.1	59	0	0	0	0	116.8
735	C	34.5	Very low	35	Very low	114 Å²	114	140.8 Å²	140.8	77%	0.77	78%	0.775	S	S	*	*			trans	-74.3	178.1	-177.4	-43.1	0	0	0	0	115.7
736	P	48.3	Very low	35	Very low	129 Å²	129	139 Å²	139	84%	0.838	77%	0.772	S	S	*	*				-145.5	-146.7	102.6	38.8	-20.2	0	0	0	116.5
737	I	32.9	Very low	34.8	Very low	150 Å²	150	136.1 Å²	136.1	77%	0.769	77%	0.774	S	S	*	*			trans	-136.1	131.8	-138.7	-72.2	167.9	0	0	0	116.9
738	L	34.9	Very low	34.8	Very low	160 Å²	160	137.4 Å²	137.4	84%	0.838	77%	0.77	S	S	*	*			trans	39.1	171.6	142.8	-61.3	178.8	0	0	0	124.2
739	P	56.9	Low	34.7	Very low	110 Å²	110	140.5 Å²	140.5	71%	0.714	78%	0.778	S	S	*	*			cis	-131.2	-174.2	-37.7	39.6	-22.1	0	0	0	113.3
740	P	42.2	Very low	34.5	Very low	133 Å²	133	144.9 Å²	144.9	86%	0.864	79%	0.788	S	S	*	*				-152.5	-153.6	91.3	39.7	-17.3	0	0	0	115.6
741	R	33.4	Very low	33.7	Very low	233 Å²	233	142.1 Å²	142.1	88%	0.879	79%	0.789	S	S	*	*			trans	-116.6	140	-160.6	-65.9	176.6	170.3	143.8	-5.1	118.1
742	T	35.9	Very low	34.3	Very low	127 Å²	127	140.2 Å²	140.2	78%	0.779	79%	0.79	S	S	*	*			trans	37.8	138.6	140.2	65.1	0	0	0	0	123
743	P	36.7	Very low	33.9	Very low	136 Å²	136	143 Å²	143	88%	0.883	80%	0.797	S	S	*	*				-145	-149.6	94.1	40.1	-22.7	0	0	0	116
744	K	28.5	Very low	33.7	Very low	196 Å²	196	144.7 Å²	144.7	85%	0.852	80%	0.798	S	S	*	*			trans	-120.3	160.2	-155.3	-61.8	179	177.6	177.4	0	117.7
745	S	27.5	Very low	34.1	Very low	100 Å²	100	144.8 Å²	144.8	70%	0.699	80%	0.797	S	S	*	*			trans	74.8	123.8	138	63.9	0	0	0	0	124.6
746	N	26.4	Very low	33.7	Very low	160 Å²	160	145.5 Å²	145.5	86%	0.856	80%	0.798	S	S	*	*			trans	64.4	128.2	132.7	-64.6	0.5	0	0	0	123.9
747	A	29.4	Very low	32.6	Very low	89 Å²	89	148 Å²	148	74%	0.736	80%	0.798	S	S	*	*			trans	103.4	120.8	131.3	0	0	0	0	0	122.7
748	I	29.2	Very low	32.3	Very low	142 Å²	142	146.2 Å²	146.2	73%	0.728	80%	0.799	S	S	*	*			trans	86	108.2	130.5	-72.5	172.5	0	0	0	121.8
749	K	29.9	Very low	31.9	Very low	187 Å²	187	145 Å²	145	81%	0.813	80%	0.798	S	S	*	*			trans	64.3	162.6	139.4	-61.4	179.8	-171.6	176.7	0	118.4
750	K	27.1	Very low	30.5	Very low	196 Å²	196	144.4 Å²	144.4	85%	0.852	80%	0.796	S	S	*	*			cis	-149.7	171	14.4	-151.8	-179.6	177.8	-169.1	0	112.8
751	C	23.7	Very low	29.8	Very low	112 Å²	112	144.9 Å²	144.9	76%	0.757	79%	0.791	S	S	*	*			trans	-71.9	179.5	177.7	-36.9	0	0	0	0	114.3
752	P	47	Very low	29.6	Very low	113 Å²	113	141.3 Å²	141.3	73%	0.734	79%	0.785	S	S	*	*				-133.4	174.6	86.3	44.2	-33.8	0	0	0	112.5
753	D	24.6	Very low	29.2	Very low	149 Å²	149	138.8 Å²	138.8	80%	0.797	77%	0.772	S	S	*	*			cis	-148.6	-176.9	21.4	-112	-45.9	0	0	0	113.5
754	F	26.6	Very low	29.1	Very low	195 Å²	195	138.8 Å²	138.8	86%	0.855	76%	0.76	S	S	*	*			trans	-112.2	-175.7	-178.2	-85.3	-80	0	0	0	111.3
755	P	40.8	Very low	29.2	Very low	110 Å²	110	140.1 Å²	140.1	71%	0.714	76%	0.76	S	S	*	*			cis	-148.5	-177.2	17.7	46.2	-25.7	0	0	0	120.2
756	T	25.1	Very low	29.2	Very low	129 Å²	129	139.6 Å²	139.6	79%	0.791	76%	0.762	S	S	*	*			trans	91.7	140.9	148.1	-50.8	0	0	0	0	120.4
757	E	25.9	Very low	29.3	Very low	181 Å²	181	136.1 Å²	136.1	85%	0.846	76%	0.755	S	S	*	*			trans	-101.9	160.4	-175.9	-52.2	154.6	106.7	0	0	112.3
758	S	26.3	Very low	29.2	Very low	113 Å²	113	137.6 Å²	137.6	79%	0.79	76%	0.755	S	S	*	*			trans	-169.1	101.5	140.7	53.3	0	0	0	0	114.3
759	V	28	Very low	29.2	Very low	134 Å²	134	139.1 Å²	139.1	81%	0.812	76%	0.759	S	S	*	*				47.9	109.6	115.7	178.1	0	0	0	0	119.7
760	S	26.5	Very low	29.1	Very low	98 Å²	98	135.6 Å²	135.6	69%	0.685	75%	0.753	S	S	*	*			trans	72.5	122.6	133.1	-81.8	0	0	0	0	125.3
761	D	28	Very low	29.1	Very low	142 Å²	142	134.3 Å²	134.3	76%	0.759	75%	0.75	S	S	*	*				103.5	149.5	113.7	-87.7	-58.9	0	0	0	126.2
762	E	28.8	Very low	29.4	Very low	159 Å²	159	137 Å²	137	74%	0.743	76%	0.756	S	S	*	*			trans	72.7	118.6	147.4	-78.5	-136	73.5	0	0	124.9
763	S	28.6	Very low	28.3	Very low	73 Å²	73	135 Å²	135	51%	0.51	76%	0.757	S	S	.	*				67.3	101	121.9	-68.4	0	0	0	0	123.4
764	Q	33.3	Very low	28.5	Very low	136 Å²	136	134.3 Å²	134.3	64%	0.636	76%	0.757	S	S	*	*				67.2	132.1	111.8	-74.7	-172.1	64.7	0	0	122
765	R	30.3	Very low	28.5	Very low	224 Å²	224	131.4 Å²	131.4	85%	0.845	75%	0.751	S	S	*	*			trans	73.5	147.7	143.7	-70.3	172.2	-177	175	6	117.3
766	A	28	Very low	27.9	Very low	89 Å²	89	133.8 Å²	133.8	74%	0.736	75%	0.753	S	S	*	*			cis	-167.7	-179	-14.6	0	0	0	0	0	111
767	A	27.6	Very low	28.1	Very low	87 Å²	87	134.1 Å²	134.1	72%	0.719	75%	0.748	S	S	*	*			trans	103.3	113.9	133.4	0	0	0	0	0	120.2
768	V	28.4	Very low	28.1	Very low	120 Å²	120	130.7 Å²	130.7	73%	0.727	74%	0.743	S	S	*	*				95.3	111.4	112.5	161.5	0	0	0	0	121
769	Q	29.9	Very low	28.2	Very low	175 Å²	175	130.4 Å²	130.4	82%	0.818	74%	0.741	S	S	*	*				115.1	140.7	125	-105.8	166.6	15	0	0	124.4
770	T	26.1	Very low	28.2	Very low	112 Å²	112	130.1 Å²	130.1	69%	0.687	75%	0.745	S	S	*	*			trans	88	87.2	144.8	-50	0	0	0	0	121.8
771	E	28.5	Very low	28.5	Very low	169 Å²	169	131.5 Å²	131.5	79%	0.79	76%	0.755	S	S	*	*				38.2	152	115.2	-54.9	-160.4	160.8	0	0	125.8
772	L	29.5	Very low	28.6	Very low	169 Å²	169	129.4 Å²	129.4	89%	0.885	76%	0.757	S	S	*	*			trans	82.7	139.7	147.3	-114.4	76.1	0	0	0	121.1
773	G	24.8	Very low	28.6	Very low	72 Å²	72	127.8 Å²	127.8	74%	0.742	76%	0.758	S	S	*	*			trans	155.2	137.8	169.4	0	0	0	0	0	113.7
774	T	27.2	Very low	28.9	Very low	133 Å²	133	131.5 Å²	131.5	82%	0.816	77%	0.771	S	S	*	*			trans	-142.4	162	-173.2	-15.1	0	0	0	0	113
775	N	27.8	Very low	28.7	Very low	135 Å²	135	132.4 Å²	132.4	72%	0.722	78%	0.781	S	S	*	*			trans	78.9	118.4	156.2	-67.3	3.4	0	0	0	122
776	E	27.9	Very low	28.8	Very low	159 Å²	159	127.9 Å²	127.9	74%	0.743	78%	0.782	S	S	*	*				73.5	127.6	120.8	-64.3	-155.1	133.7	0	0	125.7
777	I	29.9	Very low	29.1	Very low	136 Å²	136	129.8 Å²	129.8	70%	0.697	79%	0.787	S	S	*	*				86.5	133	129.6	-72.9	171.3	0	0	0	122.4
778	C	25	Very low	29.4	Very low	109 Å²	109	131.2 Å²	131.2	74%	0.736	79%	0.792	S	S	*	*			trans	57.9	110.9	159.3	-82.5	0	0	0	0	123.2
779	S	28.1	Very low	30.1	Very low	108 Å²	108	132 Å²	132	76%	0.755	80%	0.796	S	S	*	*				39.8	115.2	107.7	-49.5	0	0	0	0	120.9
780	S	28.2	Very low	30.3	Very low	128 Å²	128	128.8 Å²	128.8	90%	0.895	79%	0.793	S	S	*	*				-172.1	156.5	125.7	-83.8	0	0	0	0	112.6
781	S	32.2	Very low	31.2	Very low	127 Å²	127	128.4 Å²	128.4	89%	0.888	79%	0.793	S	S	*	*			trans	-99.4	135.4	-170.9	-46.1	0	0	0	0	113.6
782	A	30.5	Very low	32	Very low	98 Å²	98	126.7 Å²	126.7	81%	0.81	79%	0.794	S	S	*	*			trans	-157.4	123.9	156.7	0	0	0	0	0	113.8
783	T	28.1	Very low	32.9	Very low	125 Å²	125	123.3 Å²	123.3	77%	0.767	79%	0.79	S	S	*	*			trans	-15.9	144.5	164.3	42.6	0	0	0	0	122.7
784	L	35.8	Very low	34.9	Very low	150 Å²	150	127.1 Å²	127.1	79%	0.785	79%	0.789	S	S	*	*			trans	66.4	103.8	139.4	-65.9	165.6	0	0	0	119.8
785	N	28.1	Very low	37.5	Very low	155 Å²	155	125.5 Å²	125.5	83%	0.829	77%	0.768	S	S	*	*				-176.5	144.3	105.1	-92.2	-36.5	0	0	0	112
786	C	32.2	Very low	40.1	Very low	130 Å²	130	124.3 Å²	124.3	88%	0.878	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-95.4	124.3	171	-66.7	0	0	0	0	111
787	P	35.8	Very low	42.9	Very low	128 Å²	128	117.1 Å²	117.1	83%	0.831	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-77.1	141	155.8	-11.2	28.8	0	0	0	110.2
788	S	33.8	Very low	45.5	Very low	118 Å²	118	112.5 Å²	112.5	83%	0.825	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-73.7	152.2	176.9	52.5	0	0	0	0	113.1
789	V	42.4	Very low	48.1	Very low	135 Å²	135	114.8 Å²	114.8	82%	0.818	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-54.2	133	176.8	175.1	0	0	0	0	113.1
790	S	34.1	Very low	50.8	Low	109 Å²	109	114.5 Å²	114.5	76%	0.762	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-100.6	126.5	157.2	57.4	0	0	0	0	110
791	P	45.8	Very low	53.8	Low	103 Å²	103	108.6 Å²	108.6	67%	0.669	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-79	162.4	-170.3	-16	31.6	0	0	0	116
792	T	45.5	Very low	56.5	Low	133 Å²	133	105.1 Å²	105.1	82%	0.816	63%	0.632	S	S	*	*			trans	59.7	53.9	155.8	53.9	0	0	0	0	118.3
793	A	47.3	Very low	59.1	Low	98 Å²	98	103.1 Å²	103.1	81%	0.81	62%	0.621	S	S	*	*				-77.2	117.6	122.8	0	0	0	0	0	107	W795	A793-W795 PolarHBondContact O-N 3.24Å; A793-W795 VanDerWaalsContact O-N 3.14Å
794	Q	67.1	Low	62.2	Low	152 Å²	152	97.9 Å²	97.9	71%	0.71	59%	0.588	S	S	*	*			trans	-65.2	114.7	169.5	-87.9	-172.6	-21.1	0	0	107.9	Q796	Q794-Q796 PolarHBondContact O-N 3.32Å
795	W	82.6	Confident	65	Low	100 Å²	100	92.9 Å²	92.9	38%	0.379	57%	0.566	S	S	.	*			trans	-62.9	120.9	174.6	-178.8	87.5	0	0	0	109.1	A793 P797 K811 C812 F815	A793-W795 PolarHBondContact O-N 3.24Å; A793-W795 VanDerWaalsContact O-N 3.14Å; W795-P797 HydrophobicContact CH2-CB 3.9Å; W795-P797 HydrophobicContact CZ3-CB 4.06Å; W795-K811 HydrophobicContact CD2-CB 4.24Å; W795-K811 HydrophobicContact CD2-CD 4.47Å; W795-K811 HydrophobicContact CE3-CB 4.09Å; W795-K811 HydrophobicContact CH2-CB 3.35Å; W795-K811 HydrophobicContact CZ2-CB 3.51Å; W795-K811 HydrophobicContact CZ2-CD 4.07Å; W795-K811 HydrophobicContact CZ2-CG 4.43Å; W795-K811 HydrophobicContact CZ3-CB 3.66Å; W795-C812 HydrophobicContact CH2-CB 4.47Å; W795-F815 HydrophobicContact CE3-CD2 4.49Å; W795-F815 HydrophobicContact CZ3-CB 4.08Å; W795-F815 HydrophobicContact CZ3-CD2 4.38Å; W795-F815 HydrophobicContact CZ3-CG 4.47Å
796	Q	80.9	Confident	68.2	Low	109 Å²	109	87.4 Å²	87.4	51%	0.509	54%	0.536	S	S	.	.			trans	-107.7	138.2	176.5	-68.6	-66.8	-24.8	0	0	108.9	Q794	Q794-Q796 PolarHBondContact O-N 3.32Å
797	P	86.6	Confident	71	Confident	9 Å²	9	86.9 Å²	86.9	6%	0.058	52%	0.521	C	S	.	.			trans	-64.3	137	176.7	27.2	-36.7	0	0	0	111.4	W795 F815 F861	W795-P797 HydrophobicContact CH2-CB 3.9Å; W795-P797 HydrophobicContact CZ3-CB 4.06Å; P797-F815 HydrophobicContact CG-CD1 3.67Å; P797-F815 HydrophobicContact CG-CD2 4.41Å; P797-F815 HydrophobicContact CG-CE1 3.63Å; P797-F815 HydrophobicContact CG-CE2 4.37Å; P797-F815 HydrophobicContact CG-CG 4.08Å; P797-F815 HydrophobicContact CG-CZ 4Å; P797-F861 HydrophobicContact CB-CE2 3.88Å; P797-F861 HydrophobicContact CB-CZ 3.7Å; P797-F861 HydrophobicContact CG-CE2 3.99Å; P797-F861 HydrophobicContact CG-CZ 4.33Å
798	P	85.2	Confident	73.8	Confident	38 Å²	38	83.8 Å²	83.8	25%	0.247	50%	0.495	C	S	.	.			trans	-49.9	144.1	174	-31.2	38.1	0	0	0	113.4	N800 I804 R866	P798-N800 VanDerWaalsContact CB-O 3.25Å; P798-N800 WeakPolarHBondContact CB-O 3.19Å; P798-I804 HydrophobicContact CB-CG2 4.26Å; P798-I804 HydrophobicContact CG-CG2 4.17Å; P798-R866 PolarHBondContact O-NH2 3.08Å
799	L	80.4	Confident	76.7	Confident	157 Å²	157	78.2 Å²	78.2	82%	0.822	46%	0.456	S	S	*	.	S	Bend	trans	-71.8	-39.5	177.2	-69.5	176	0	0	0	111.9
800	N	85	Confident	79.2	Confident	103 Å²	103	72.6 Å²	72.6	55%	0.551	42%	0.423	S	S	*	.			trans	-97.9	136	168.7	-174.1	8.1	0	0	0	109.1	P798 S802	P798-N800 VanDerWaalsContact CB-O 3.25Å; P798-N800 WeakPolarHBondContact CB-O 3.19Å; N800-S802 PolarHBondContact ND2-OG 3.22Å; N800-S802 PolarHBondContact OD1-N 3.46Å; N800-S802 PolarHBondContact OD1-OG 3.08Å
801	L	90.4	Very high	82	Confident	4 Å²	4	71.7 Å²	71.7	2%	0.021	41%	0.405	C	S	.	.			trans	-99.4	-13.1	178.8	-55.8	178	0	0	0	112.8	G803 I804 G833 L836 L837 F861 I862	L801-G803 PolarHBondContact O-N 2.72Å; L801-I804 HydrophobicContact CD2-CD1 3.97Å; L801-I804 WeakPolarHBondContact O-CG1 3.48Å; L801-I804 PolarHBondContact O-N 3.01Å; L801-G833 CarbonylContact O-C 3.57Å; L801-G833 VanDerWaalsContact O-C 3.32Å; L801-G833 WeakPolarHBondContact O-CA 3.23Å; L801-L836 HydrophobicContact CD1-CD2 4.29Å; L801-L837 HydrophobicContact CB-CD2 4.17Å; L801-L837 HydrophobicContact CB-CG 4.35Å; L801-L837 HydrophobicContact CD1-CD2 4.46Å; L801-F861 HydrophobicContact CD1-CD1 3.9Å; L801-F861 HydrophobicContact CD1-CE1 3.71Å; L801-F861 HydrophobicContact CD2-CE1 3.77Å; L801-F861 HydrophobicContact CD2-CZ 4.19Å; L801-F861 HydrophobicContact CG-CE1 4.39Å; L801-I862 HydrophobicContact CD1-CG1 4.16Å
802	S	88.8	Confident	84.3	Confident	53 Å²	53	66.8 Å²	66.8	37%	0.371	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	130.5	177.4	68.3	0	0	0	0	110.7	N800	N800-S802 PolarHBondContact ND2-OG 3.22Å; N800-S802 PolarHBondContact OD1-N 3.46Å; N800-S802 PolarHBondContact OD1-OG 3.08Å
803	G	85.8	Confident	86.7	Confident	57 Å²	57	60.5 Å²	60.5	59%	0.588	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.9	9.7	176.5	0	0	0	0	0	116.5	L801 N834	L801-G803 PolarHBondContact O-N 2.72Å; G803-N834 PolarHBondContact N-OD1 2.59Å
804	I	92.8	Very high	88.9	Confident	15 Å²	15	60.8 Å²	60.8	8%	0.077	32%	0.318	C	S	.	.			trans	-79.8	149.6	172	76.7	174.1	0	0	0	111.4	P798 L801 E808 V809 G833	P798-I804 HydrophobicContact CB-CG2 4.26Å; P798-I804 HydrophobicContact CG-CG2 4.17Å; L801-I804 HydrophobicContact CD2-CD1 3.97Å; L801-I804 WeakPolarHBondContact O-CG1 3.48Å; L801-I804 PolarHBondContact O-N 3.01Å; I804-E808 HydrophobicContact CB-CB 4.1Å; I804-E808 HydrophobicContact CD1-CB 4.16Å; I804-E808 HydrophobicContact CG1-CB 4.31Å; I804-V809 HydrophobicContact CD1-CG2 3.98Å; I804-V809 HydrophobicContact CG1-CG2 3.89Å; I804-G833 PolarHBondContact O-N 2.92Å
805	S	94.3	Very high	90.1	Very high	44 Å²	44	55.3 Å²	55.3	31%	0.308	29%	0.292	S	S	.	.			trans	-69.8	160.7	-179.2	59.5	0	0	0	0	113.5	E807 E808 V809	S805-E807 PolarHBondContact O-N 3.25Å; S805-E808 WeakPolarHBondContact CB-OE2 3.29Å; S805-E808 PolarHBondContact N-OE2 3.05Å; S805-E808 CarbonylContact O-C 3.55Å; S805-E808 WeakPolarHBondContact O-CA 3.34Å; S805-E808 WeakPolarHBondContact O-CB 3.26Å; S805-E808 PolarHBondContact O-N 3.44Å; S805-E808 WeakPolarHBondContact OG-CB 3.34Å; S805-E808 VanDerWaalsContact OG-CD 3.26Å; S805-E808 WeakPolarHBondContact OG-CG 3.4Å; S805-E808 PolarHBondContact OG-N 3.27Å; S805-E808 PolarHBondContact OG-OE2 3.29Å; S805-V809 PolarHBondContact O-N 2.95Å
806	I	95	Very high	90.6	Very high	41 Å²	41	50.8 Å²	50.8	21%	0.21	28%	0.275	C	S	.	.	H	α-helix	trans	-58.9	-37	175.1	-60.6	161.7	0	0	0	110.1	E808 V809 S810 V827 K830 D832	I806-E808 VanDerWaalsContact C-N 3.31Å; I806-E808 PolarHBondContact O-N 2.96Å; I806-V809 PolarHBondContact O-N 2.68Å; I806-S810 PolarHBondContact O-N 3.07Å; I806-V827 HydrophobicContact CG2-CB 4.35Å; I806-V827 HydrophobicContact CG2-CG1 4.33Å; I806-V827 HydrophobicContact CG2-CG2 4.06Å; I806-K830 HydrophobicContact CD1-CB 3.82Å; I806-K830 HydrophobicContact CD1-CG 4.39Å; I806-D832 HydrophobicContact CG1-CB 4.21Å
807	E	92.3	Very high	91.1	Very high	118 Å²	118	47.8 Å²	47.8	55%	0.551	27%	0.273	S	S	*	.	H	α-helix	trans	-63.5	-35.4	174.9	-66.4	70.2	-158	0	0	112	S805 S810 K811	S805-E807 PolarHBondContact O-N 3.25Å; E807-S810 PolarHBondContact O-OG 3.13Å; E807-K811 WeakPolarHBondContact O-CG 3.44Å; E807-K811 PolarHBondContact O-N 3.27Å
808	E	92.9	Very high	91.4	Very high	63 Å²	63	47.8 Å²	47.8	29%	0.294	27%	0.272	S	S	.	.	H	α-helix	trans	-78.3	-38.2	175.3	-72.2	166.6	125.3	0	0	112.6	I804 S805 I806 S810 K811 C812	I804-E808 HydrophobicContact CB-CB 4.1Å; I804-E808 HydrophobicContact CD1-CB 4.16Å; I804-E808 HydrophobicContact CG1-CB 4.31Å; S805-E808 WeakPolarHBondContact CB-OE2 3.29Å; S805-E808 PolarHBondContact N-OE2 3.05Å; S805-E808 CarbonylContact O-C 3.55Å; S805-E808 WeakPolarHBondContact O-CA 3.34Å; S805-E808 WeakPolarHBondContact O-CB 3.26Å; S805-E808 PolarHBondContact O-N 3.44Å; S805-E808 WeakPolarHBondContact OG-CB 3.34Å; S805-E808 VanDerWaalsContact OG-CD 3.26Å; S805-E808 WeakPolarHBondContact OG-CG 3.4Å; S805-E808 PolarHBondContact OG-N 3.27Å; S805-E808 PolarHBondContact OG-OE2 3.29Å; I806-E808 VanDerWaalsContact C-N 3.31Å; I806-E808 PolarHBondContact O-N 2.96Å; E808-S810 VanDerWaalsContact C-N 3.25Å; E808-S810 PolarHBondContact O-N 2.76Å; E808-K811 PolarHBondContact O-N 2.91Å; E808-K811 VanDerWaalsContact O-N 3.1Å; E808-C812 PolarHBondContact O-N 2.99Å; E808-C812 PolarHBondContact O-SG 2.98Å; E808-C812 VanDerWaalsContact O-SG 3.39Å
809	V	95.4	Very high	91.8	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-53.6	-46.9	166.4	171.8	0	0	0	0	109.5	I804 S805 I806 K811 C812 L813 F826 L836	I804-V809 HydrophobicContact CD1-CG2 3.98Å; I804-V809 HydrophobicContact CG1-CG2 3.89Å; S805-V809 PolarHBondContact O-N 2.95Å; I806-V809 PolarHBondContact O-N 2.68Å; V809-K811 VanDerWaalsContact C-N 3.25Å; V809-K811 PolarHBondContact O-N 2.84Å; V809-C812 WeakPolarHBondContact O-CB 3.37Å; V809-C812 PolarHBondContact O-N 2.85Å; V809-C812 VanDerWaalsContact O-N 3.09Å; V809-L813 HydrophobicContact CG1-CD1 3.79Å; V809-L813 HydrophobicContact CG1-CG 4.13Å; V809-L813 VanDerWaalsContact O-CG 3.3Å; V809-L813 WeakPolarHBondContact O-CG 3.47Å; V809-L813 PolarHBondContact O-N 3.46Å; V809-F826 HydrophobicContact CG1-CD1 4.44Å; V809-L836 HydrophobicContact CG1-CD2 4.07Å; V809-L836 HydrophobicContact CG2-CD2 4.08Å
810	S	95.3	Very high	92.4	Very high	18 Å²	18	46 Å²	46	13%	0.126	27%	0.265	C	S	.	.	H	α-helix	trans	-59.2	-34.4	178.7	90.6	0	0	0	0	113.4	I806 E807 E808 K814 V823	I806-S810 PolarHBondContact O-N 3.07Å; E807-S810 PolarHBondContact O-OG 3.13Å; E808-S810 VanDerWaalsContact C-N 3.25Å; E808-S810 PolarHBondContact O-N 2.76Å; S810-K814 WeakPolarHBondContact O-CD 3.45Å; S810-K814 WeakPolarHBondContact O-CG 3.21Å; S810-K814 PolarHBondContact O-N 2.86Å; S810-V823 WeakPolarHBondContact O-CG1 3.31Å
811	K	93.6	Very high	92.7	Very high	90 Å²	90	47 Å²	47	39%	0.391	27%	0.27	S	S	.	.	H	α-helix	trans	-74.7	-40.6	175.6	-64.5	162.5	-164	161.3	0	111.2	W795 E807 E808 V809 K814 F815	W795-K811 HydrophobicContact CD2-CB 4.24Å; W795-K811 HydrophobicContact CD2-CD 4.47Å; W795-K811 HydrophobicContact CE3-CB 4.09Å; W795-K811 HydrophobicContact CH2-CB 3.35Å; W795-K811 HydrophobicContact CZ2-CB 3.51Å; W795-K811 HydrophobicContact CZ2-CD 4.07Å; W795-K811 HydrophobicContact CZ2-CG 4.43Å; W795-K811 HydrophobicContact CZ3-CB 3.66Å; E807-K811 WeakPolarHBondContact O-CG 3.44Å; E807-K811 PolarHBondContact O-N 3.27Å; E808-K811 PolarHBondContact O-N 2.91Å; E808-K811 VanDerWaalsContact O-N 3.1Å; V809-K811 VanDerWaalsContact C-N 3.25Å; V809-K811 PolarHBondContact O-N 2.84Å; K811-K814 PolarHBondContact O-N 2.95Å; K811-F815 WeakPolarHBondContact O-CB 3.35Å; K811-F815 PolarHBondContact O-N 3.49Å
812	C	94	Very high	92.8	Very high	0 Å²	0	48 Å²	48	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-58.1	-47.6	174	-74.8	0	0	0	0	111.9	W795 E808 V809 K814 F815 I816 F861	W795-C812 HydrophobicContact CH2-CB 4.47Å; E808-C812 PolarHBondContact O-N 2.99Å; E808-C812 PolarHBondContact O-SG 2.98Å; E808-C812 VanDerWaalsContact O-SG 3.39Å; V809-C812 WeakPolarHBondContact O-CB 3.37Å; V809-C812 PolarHBondContact O-N 2.85Å; V809-C812 VanDerWaalsContact O-N 3.09Å; C812-K814 PolarHBondContact O-N 2.99Å; C812-F815 WeakPolarHBondContact O-CB 3.36Å; C812-F815 PolarHBondContact O-N 3.48Å; C812-I816 PolarHBondContact O-N 2.79Å; C812-F861 HydrophobicContact CB-CE1 3.7Å; C812-F861 HydrophobicContact CB-CZ 3.59Å
813	L	94.8	Very high	93.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.8	-40.3	179.3	-63	173.1	0	0	0	111.8	V809 I816 L818 V823 F826 L858	V809-L813 HydrophobicContact CG1-CD1 3.79Å; V809-L813 HydrophobicContact CG1-CG 4.13Å; V809-L813 VanDerWaalsContact O-CG 3.3Å; V809-L813 WeakPolarHBondContact O-CG 3.47Å; V809-L813 PolarHBondContact O-N 3.46Å; L813-I816 VanDerWaalsContact O-CG1 3.28Å; L813-I816 WeakPolarHBondContact O-CG1 3.22Å; L813-L818 HydrophobicContact CB-CD1 3.95Å; L813-L818 HydrophobicContact CD2-CD1 3.53Å; L813-L818 HydrophobicContact CG-CD1 4.27Å; L813-L818 WeakPolarHBondContact O-CB 3.29Å; L813-L818 PolarHBondContact O-N 3.47Å; L813-L818 VanDerWaalsContact O-N 3.13Å; L813-V823 HydrophobicContact CB-CG1 4.39Å; L813-V823 HydrophobicContact CB-CG2 3.74Å; L813-F826 HydrophobicContact CD1-CB 3.55Å; L813-F826 HydrophobicContact CD1-CD1 3.67Å; L813-F826 HydrophobicContact CD1-CD2 3.97Å; L813-F826 HydrophobicContact CD1-CE1 4.35Å; L813-F826 HydrophobicContact CD1-CG 3.45Å; L813-F826 VanDerWaalsContact CD1-CG 3.45Å; L813-F826 HydrophobicContact CD2-CE1 4.47Å; L813-L858 HydrophobicContact CD2-CD1 3.64Å; L813-L858 HydrophobicContact CD2-CD2 3.96Å; L813-L858 HydrophobicContact CD2-CG 4.46Å
814	K	93.5	Very high	93.4	Very high	104 Å²	104	46.2 Å²	46.2	45%	0.452	25%	0.254	S	S	.	.	H	α-helix	trans	-63.2	-41.8	172.4	-76.6	166.4	178.1	159.6	0	112.2	S810 K811 C812 I816 G817 N820 V823	S810-K814 WeakPolarHBondContact O-CD 3.45Å; S810-K814 WeakPolarHBondContact O-CG 3.21Å; S810-K814 PolarHBondContact O-N 2.86Å; K811-K814 PolarHBondContact O-N 2.95Å; C812-K814 PolarHBondContact O-N 2.99Å; K814-I816 PolarHBondContact O-N 2.88Å; K814-G817 WeakPolarHBondContact O-CA 3.24Å; K814-G817 PolarHBondContact O-N 2.83Å; K814-N820 WeakPolarHBondContact CE-OD1 3.27Å; K814-V823 HydrophobicContact CD-CG1 4.38Å; K814-V823 HydrophobicContact CG-CG1 4.26Å; K814-V823 HydrophobicContact CG-CG2 4Å
815	F	93.1	Very high	93.5	Very high	37 Å²	37	48.4 Å²	48.4	16%	0.162	27%	0.265	C	S	.	.	H	α-helix	trans	-62.8	-35.9	-179.7	-176.2	-86.8	0	0	0	113.5	W795 P797 K811 C812 G817 P867 I869	W795-F815 HydrophobicContact CE3-CD2 4.49Å; W795-F815 HydrophobicContact CZ3-CB 4.08Å; W795-F815 HydrophobicContact CZ3-CD2 4.38Å; W795-F815 HydrophobicContact CZ3-CG 4.47Å; P797-F815 HydrophobicContact CG-CD1 3.67Å; P797-F815 HydrophobicContact CG-CD2 4.41Å; P797-F815 HydrophobicContact CG-CE1 3.63Å; P797-F815 HydrophobicContact CG-CE2 4.37Å; P797-F815 HydrophobicContact CG-CG 4.08Å; P797-F815 HydrophobicContact CG-CZ 4Å; K811-F815 WeakPolarHBondContact O-CB 3.35Å; K811-F815 PolarHBondContact O-N 3.49Å; C812-F815 WeakPolarHBondContact O-CB 3.36Å; C812-F815 PolarHBondContact O-N 3.48Å; F815-G817 PolarHBondContact O-N 3.09Å; F815-P867 HydrophobicContact CD1-CG 3.95Å; F815-P867 HydrophobicContact CE1-CG 3.69Å; F815-I869 HydrophobicContact CD1-CD1 4.32Å; F815-I869 HydrophobicContact CD2-CD1 3.99Å; F815-I869 HydrophobicContact CE1-CD1 4.03Å; F815-I869 HydrophobicContact CE2-CD1 3.68Å; F815-I869 HydrophobicContact CG-CD1 4.31Å; F815-I869 HydrophobicContact CZ-CD1 3.7Å; F815-I869 HydrophobicContact CZ-CG1 4.37Å
816	I	93.1	Very high	93.5	Very high	6 Å²	6	46.4 Å²	46.4	3%	0.031	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	1.8	173.3	61.9	173.7	0	0	0	113.9	C812 L813 K814 L818 K857 L858 F861 W865 P867	C812-I816 PolarHBondContact O-N 2.79Å; L813-I816 VanDerWaalsContact O-CG1 3.28Å; L813-I816 WeakPolarHBondContact O-CG1 3.22Å; K814-I816 PolarHBondContact O-N 2.88Å; I816-L818 HydrophobicContact CD1-CD1 3.87Å; I816-L818 HydrophobicContact CD1-CG 4.2Å; I816-L818 HydrophobicContact CG1-CD1 4.18Å; I816-L818 HydrophobicContact CG1-CG 4.11Å; I816-K857 PolarHBondContact O-NZ 2.85Å; I816-L858 HydrophobicContact CD1-CB 4.29Å; I816-L858 HydrophobicContact CD1-CD1 3.97Å; I816-F861 HydrophobicContact CD1-CB 4.3Å; I816-F861 HydrophobicContact CD1-CG 4.45Å; I816-F861 HydrophobicContact CG2-CB 4.07Å; I816-F861 HydrophobicContact CG2-CD2 3.24Å; I816-F861 HydrophobicContact CG2-CE2 3.77Å; I816-F861 HydrophobicContact CG2-CG 3.77Å; I816-W865 HydrophobicContact CG2-CZ3 4.2Å; I816-P867 HydrophobicContact CG2-CG 4.38Å
817	G	90.8	Very high	93.5	Very high	45 Å²	45	47.7 Å²	47.7	46%	0.464	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	52.9	179.6	0	0	0	0	0	112.7	K814 F815 K857	K814-G817 WeakPolarHBondContact O-CA 3.24Å; K814-G817 PolarHBondContact O-N 2.83Å; F815-G817 PolarHBondContact O-N 3.09Å; G817-K857 PolarHBondContact O-NZ 2.79Å
818	L	93.6	Very high	93.5	Very high	9 Å²	9	45.1 Å²	45.1	5%	0.047	26%	0.256	C	S	.	.			trans	-88.5	145.8	158	-66.7	170.6	0	0	0	109.5	L813 I816 I822 V823 Q854	L813-L818 HydrophobicContact CB-CD1 3.95Å; L813-L818 HydrophobicContact CD2-CD1 3.53Å; L813-L818 HydrophobicContact CG-CD1 4.27Å; L813-L818 WeakPolarHBondContact O-CB 3.29Å; L813-L818 PolarHBondContact O-N 3.47Å; L813-L818 VanDerWaalsContact O-N 3.13Å; I816-L818 HydrophobicContact CD1-CD1 3.87Å; I816-L818 HydrophobicContact CD1-CG 4.2Å; I816-L818 HydrophobicContact CG1-CD1 4.18Å; I816-L818 HydrophobicContact CG1-CG 4.11Å; L818-I822 HydrophobicContact CB-CG2 4.2Å; L818-I822 HydrophobicContact CD1-CG2 4.23Å; L818-V823 HydrophobicContact CB-CG2 4.27Å; L818-Q854 HydrophobicContact CD2-CB 3.61Å; L818-Q854 HydrophobicContact CD2-CG 3.63Å
819	P	92.6	Very high	93.6	Very high	53 Å²	53	47.3 Å²	47.3	34%	0.344	27%	0.266	S	S	.	.			trans	-70	155	179.5	31.6	-35.6	0	0	0	111	D821 I822 V823	P819-D821 PolarHBondContact O-N 2.88Å; P819-D821 VanDerWaalsContact O-N 3.16Å; P819-I822 HydrophobicContact CG-CB 4.17Å; P819-I822 HydrophobicContact CG-CD1 3.69Å; P819-I822 HydrophobicContact CG-CG1 4.23Å; P819-I822 PolarHBondContact O-N 2.82Å; P819-V823 WeakPolarHBondContact O-CG2 3.35Å; P819-V823 PolarHBondContact O-N 2.99Å; P819-V823 VanDerWaalsContact O-N 3.16Å
820	N	92.6	Very high	93.5	Very high	105 Å²	105	54.4 Å²	54.4	56%	0.561	30%	0.297	S	S	*	.	H	α-helix	trans	-57.1	-34.3	-175	-73.3	-45.9	0	0	0	112.9	K814 I822 V823 S824	K814-N820 WeakPolarHBondContact CE-OD1 3.27Å; N820-I822 PolarHBondContact O-N 3.21Å; N820-V823 CarbonylContact O-C 3.59Å; N820-V823 WeakPolarHBondContact O-CA 3.47Å; N820-V823 WeakPolarHBondContact O-CB 3.4Å; N820-V823 PolarHBondContact O-N 3.24Å; N820-S824 PolarHBondContact O-N 3.38Å; N820-S824 PolarHBondContact O-OG 3.43Å; N820-S824 VanDerWaalsContact O-OG 3.08Å
821	D	92.1	Very high	93.5	Very high	125 Å²	125	53.9 Å²	53.9	67%	0.668	29%	0.292	S	S	*	.	H	α-helix	trans	-63.8	-42.6	-176.3	-34.2	-54.2	0	0	0	111.4	P819 S824 L825	P819-D821 PolarHBondContact O-N 2.88Å; P819-D821 VanDerWaalsContact O-N 3.16Å; D821-S824 VanDerWaalsContact C-OG 3.32Å; D821-S824 WeakPolarHBondContact CA-OG 3.37Å; D821-S824 PolarHBondContact O-N 3.25Å; D821-S824 PolarHBondContact O-OG 3.14Å; D821-L825 PolarHBondContact O-N 2.75Å
822	I	92.5	Very high	93.6	Very high	24 Å²	24	52 Å²	52	12%	0.123	29%	0.287	C	S	.	.	H	α-helix	trans	-65.5	-39.6	170.4	-80.9	161.3	0	0	0	110.7	L818 P819 N820 S824 L825 F826 L850 Q854	L818-I822 HydrophobicContact CB-CG2 4.2Å; L818-I822 HydrophobicContact CD1-CG2 4.23Å; P819-I822 HydrophobicContact CG-CB 4.17Å; P819-I822 HydrophobicContact CG-CD1 3.69Å; P819-I822 HydrophobicContact CG-CG1 4.23Å; P819-I822 PolarHBondContact O-N 2.82Å; N820-I822 PolarHBondContact O-N 3.21Å; I822-S824 VanDerWaalsContact C-N 3.31Å; I822-S824 PolarHBondContact O-N 3.23Å; I822-L825 WeakPolarHBondContact O-CB 3.22Å; I822-L825 PolarHBondContact O-N 3.05Å; I822-L825 VanDerWaalsContact O-N 3.17Å; I822-F826 HydrophobicContact CG2-CD2 4.33Å; I822-F826 HydrophobicContact CG2-CE2 4.22Å; I822-F826 WeakPolarHBondContact O-CD2 3.3Å; I822-F826 PolarHBondContact O-N 2.68Å; I822-L850 HydrophobicContact CB-CD2 4.2Å; I822-L850 HydrophobicContact CD1-CD2 3.41Å; I822-L850 VanDerWaalsContact CD1-CD2 3.41Å; I822-L850 HydrophobicContact CG1-CD2 3.58Å; I822-L850 HydrophobicContact CG2-CD2 3.54Å; I822-Q854 VanDerWaalsContact CD1-NE2 3.27Å
823	V	95.1	Very high	93.6	Very high	3 Å²	3	52 Å²	52	2%	0.018	29%	0.287	C	S	.	.	H	α-helix	trans	-66.4	-33.5	178.3	-176.9	0	0	0	0	111.8	S810 L813 K814 L818 P819 N820 V827	S810-V823 WeakPolarHBondContact O-CG1 3.31Å; L813-V823 HydrophobicContact CB-CG1 4.39Å; L813-V823 HydrophobicContact CB-CG2 3.74Å; K814-V823 HydrophobicContact CD-CG1 4.38Å; K814-V823 HydrophobicContact CG-CG1 4.26Å; K814-V823 HydrophobicContact CG-CG2 4Å; L818-V823 HydrophobicContact CB-CG2 4.27Å; P819-V823 WeakPolarHBondContact O-CG2 3.35Å; P819-V823 PolarHBondContact O-N 2.99Å; P819-V823 VanDerWaalsContact O-N 3.16Å; N820-V823 CarbonylContact O-C 3.59Å; N820-V823 WeakPolarHBondContact O-CA 3.47Å; N820-V823 WeakPolarHBondContact O-CB 3.4Å; N820-V823 PolarHBondContact O-N 3.24Å; V823-V827 WeakPolarHBondContact O-CG2 3.45Å; V823-V827 PolarHBondContact O-N 3.06Å
824	S	93.1	Very high	93.5	Very high	70 Å²	70	55.2 Å²	55.2	49%	0.49	30%	0.304	S	S	.	.	H	α-helix	trans	-67.7	-33.6	171.2	33.9	0	0	0	0	113.2	N820 D821 I822 V827 S828	N820-S824 PolarHBondContact O-N 3.38Å; N820-S824 PolarHBondContact O-OG 3.43Å; N820-S824 VanDerWaalsContact O-OG 3.08Å; D821-S824 VanDerWaalsContact C-OG 3.32Å; D821-S824 WeakPolarHBondContact CA-OG 3.37Å; D821-S824 PolarHBondContact O-N 3.25Å; D821-S824 PolarHBondContact O-OG 3.14Å; I822-S824 VanDerWaalsContact C-N 3.31Å; I822-S824 PolarHBondContact O-N 3.23Å; S824-V827 CarbonylContact O-C 3.56Å; S824-V827 WeakPolarHBondContact O-CA 3.25Å; S824-V827 PolarHBondContact O-N 2.92Å; S824-V827 VanDerWaalsContact O-N 3.08Å; S824-S828 PolarHBondContact O-N 2.88Å
825	L	93.1	Very high	93.5	Very high	61 Å²	61	53.4 Å²	53.4	32%	0.319	30%	0.299	S	S	.	.	H	α-helix	trans	-63.8	-41.8	176.2	-171.2	64.4	0	0	0	111.7	D821 I822 V827 S828 E829 F848	D821-L825 PolarHBondContact O-N 2.75Å; I822-L825 WeakPolarHBondContact O-CB 3.22Å; I822-L825 PolarHBondContact O-N 3.05Å; I822-L825 VanDerWaalsContact O-N 3.17Å; L825-V827 PolarHBondContact O-N 2.75Å; L825-S828 PolarHBondContact O-N 2.9Å; L825-S828 PolarHBondContact O-OG 2.92Å; L825-E829 WeakPolarHBondContact O-CG 3.14Å; L825-E829 PolarHBondContact O-N 3.16Å; L825-F848 HydrophobicContact CD2-CB 4.41Å; L825-F848 HydrophobicContact CD2-CD1 3.84Å; L825-F848 HydrophobicContact CG-CD1 4.01Å; L825-F848 HydrophobicContact CG-CE1 4.36Å
826	F	94.9	Very high	93.6	Very high	1 Å²	1	51.7 Å²	51.7	0%	0.004	29%	0.291	C	S	.	.	H	α-helix	trans	-65.3	-23.3	173.4	-81.7	-110.5	0	0	0	113.2	V809 L813 I822 K830 I831 L836 L839 L844 F848 L850 L858	V809-F826 HydrophobicContact CG1-CD1 4.44Å; L813-F826 HydrophobicContact CD1-CB 3.55Å; L813-F826 HydrophobicContact CD1-CD1 3.67Å; L813-F826 HydrophobicContact CD1-CD2 3.97Å; L813-F826 HydrophobicContact CD1-CE1 4.35Å; L813-F826 HydrophobicContact CD1-CG 3.45Å; L813-F826 VanDerWaalsContact CD1-CG 3.45Å; L813-F826 HydrophobicContact CD2-CE1 4.47Å; I822-F826 HydrophobicContact CG2-CD2 4.33Å; I822-F826 HydrophobicContact CG2-CE2 4.22Å; I822-F826 WeakPolarHBondContact O-CD2 3.3Å; I822-F826 PolarHBondContact O-N 2.68Å; F826-K830 PolarHBondContact O-N 2.86Å; F826-I831 HydrophobicContact CB-CB 4.4Å; F826-I831 HydrophobicContact CB-CG1 4.4Å; F826-I831 HydrophobicContact CD1-CB 3.87Å; F826-I831 HydrophobicContact CD1-CG1 3.96Å; F826-I831 HydrophobicContact CD1-CG2 3.87Å; F826-I831 HydrophobicContact CE1-CG2 4.31Å; F826-I831 HydrophobicContact CG-CG1 4.37Å; F826-I831 PolarHBondContact O-N 2.81Å; F826-L836 HydrophobicContact CD1-CD1 4.23Å; F826-L836 HydrophobicContact CE1-CD1 3.74Å; F826-L839 HydrophobicContact CE1-CD1 3.74Å; F826-L839 HydrophobicContact CZ-CD1 4.27Å; F826-L844 HydrophobicContact CE1-CD2 4.31Å; F826-L844 HydrophobicContact CZ-CD2 3.67Å; F826-F848 AromaticContact CD2-CD1 3.75Å; F826-F848 HydrophobicContact CD2-CD1 3.75Å; F826-F848 AromaticContact CD2-CE1 3.97Å; F826-F848 HydrophobicContact CD2-CE1 3.97Å; F826-F848 HydrophobicContact CE1-CE1 4.48Å; F826-F848 HydrophobicContact CE2-CB 4.3Å; F826-F848 AromaticContact CE2-CD1 3.41Å; F826-F848 HydrophobicContact CE2-CD1 3.41Å; F826-F848 VanDerWaalsContact CE2-CD1 3.41Å; F826-F848 AromaticContact CE2-CE1 3.95Å; F826-F848 HydrophobicContact CE2-CE1 3.95Å; F826-F848 AromaticContact CE2-CG 3.97Å; F826-F848 HydrophobicContact CE2-CG 3.97Å; F826-F848 HydrophobicContact CG-CD1 4.48Å; F826-F848 HydrophobicContact CG-CE1 4.27Å; F826-F848 AromaticContact CZ-CD1 3.89Å; F826-F848 HydrophobicContact CZ-CD1 3.89Å; F826-F848 HydrophobicContact CZ-CE1 4.21Å; F826-F848 HydrophobicContact CZ-CG 4.17Å; F826-L850 HydrophobicContact CE2-CD1 4.35Å; F826-L850 HydrophobicContact CZ-CD1 4.36Å; F826-L858 HydrophobicContact CE1-CD2 4.03Å; F826-L858 HydrophobicContact CZ-CD2 3.7Å
827	V	94.4	Very high	93.6	Very high	68 Å²	68	54.9 Å²	54.9	41%	0.412	31%	0.308	S	S	.	.	H	α-helix	trans	-84.7	-35.9	175.4	175.9	0	0	0	0	111.7	I806 V823 S824 L825 K830	I806-V827 HydrophobicContact CG2-CB 4.35Å; I806-V827 HydrophobicContact CG2-CG1 4.33Å; I806-V827 HydrophobicContact CG2-CG2 4.06Å; V823-V827 WeakPolarHBondContact O-CG2 3.45Å; V823-V827 PolarHBondContact O-N 3.06Å; S824-V827 CarbonylContact O-C 3.56Å; S824-V827 WeakPolarHBondContact O-CA 3.25Å; S824-V827 PolarHBondContact O-N 2.92Å; S824-V827 VanDerWaalsContact O-N 3.08Å; L825-V827 PolarHBondContact O-N 2.75Å; V827-K830 PolarHBondContact O-N 3.48Å
828	S	93.1	Very high	93.7	Very high	65 Å²	65	59.4 Å²	59.4	46%	0.455	32%	0.317	S	S	.	.	H	α-helix	trans	-65.6	-43.9	174.4	63.9	0	0	0	0	111.4	S824 L825 K830	S824-S828 PolarHBondContact O-N 2.88Å; L825-S828 PolarHBondContact O-N 2.9Å; L825-S828 PolarHBondContact O-OG 2.92Å; S828-K830 PolarHBondContact O-N 3.39Å
829	E	94.6	Very high	93.6	Very high	108 Å²	108	59.8 Å²	59.8	51%	0.505	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	4	176.8	-54.5	-33.1	108.5	0	0	112.9	L825 I831 F848	L825-E829 WeakPolarHBondContact O-CG 3.14Å; L825-E829 PolarHBondContact O-N 3.16Å; E829-I831 VanDerWaalsContact C-N 3.27Å; E829-I831 HydrophobicContact CB-CD1 3.84Å; E829-I831 HydrophobicContact CB-CG1 4Å; E829-I831 WeakPolarHBondContact O-CD1 3.48Å; E829-I831 PolarHBondContact O-N 2.95Å; E829-F848 HydrophobicContact CB-CE1 4.34Å; E829-F848 HydrophobicContact CB-CZ 4.38Å; E829-F848 HydrophobicContact CG-CE1 4.17Å; E829-F848 HydrophobicContact CG-CZ 4.41Å
830	K	94.3	Very high	93.7	Very high	151 Å²	151	60 Å²	60	66%	0.657	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	40	175	-59.6	174.4	-174.1	171.3	0	113.5	I806 F826 V827 S828 D832	I806-K830 HydrophobicContact CD1-CB 3.82Å; I806-K830 HydrophobicContact CD1-CG 4.39Å; F826-K830 PolarHBondContact O-N 2.86Å; V827-K830 PolarHBondContact O-N 3.48Å; S828-K830 PolarHBondContact O-N 3.39Å; K830-D832 PolarHBondContact O-N 3.33Å
831	I	95.2	Very high	93.6	Very high	7 Å²	7	59.9 Å²	59.9	4%	0.036	32%	0.315	C	S	.	.			trans	-71.2	101.9	-177.5	-51.2	-55.6	0	0	0	109.7	F826 E829 L835 L836 L839 F848	F826-I831 HydrophobicContact CB-CB 4.4Å; F826-I831 HydrophobicContact CB-CG1 4.4Å; F826-I831 HydrophobicContact CD1-CB 3.87Å; F826-I831 HydrophobicContact CD1-CG1 3.96Å; F826-I831 HydrophobicContact CD1-CG2 3.87Å; F826-I831 HydrophobicContact CE1-CG2 4.31Å; F826-I831 HydrophobicContact CG-CG1 4.37Å; F826-I831 PolarHBondContact O-N 2.81Å; E829-I831 VanDerWaalsContact C-N 3.27Å; E829-I831 HydrophobicContact CB-CD1 3.84Å; E829-I831 HydrophobicContact CB-CG1 4Å; E829-I831 WeakPolarHBondContact O-CD1 3.48Å; E829-I831 PolarHBondContact O-N 2.95Å; I831-L835 HydrophobicContact CD1-CD2 3.53Å; I831-L835 HydrophobicContact CD1-CG 4.01Å; I831-L835 HydrophobicContact CG2-CB 4.4Å; I831-L835 HydrophobicContact CG2-CG 4.4Å; I831-L836 HydrophobicContact CG2-CB 4Å; I831-L836 HydrophobicContact CG2-CD1 4.28Å; I831-L839 HydrophobicContact CG2-CD1 4.13Å; I831-F848 HydrophobicContact CD1-CZ 3.88Å; I831-F848 HydrophobicContact CG1-CE1 4.16Å; I831-F848 HydrophobicContact CG1-CZ 3.95Å
832	D	94.6	Very high	93.6	Very high	51 Å²	51	59.2 Å²	59.2	27%	0.273	31%	0.308	S	S	.	.			trans	-79.1	175.6	171.3	92.5	-28.6	0	0	0	111.5	I806 K830 N834 L835 L836	I806-D832 HydrophobicContact CG1-CB 4.21Å; K830-D832 PolarHBondContact O-N 3.33Å; D832-N834 PolarHBondContact O-N 3.38Å; D832-N834 WeakPolarHBondContact OD1-CA 3.46Å; D832-N834 WeakPolarHBondContact OD1-CB 3.22Å; D832-N834 PolarHBondContact OD1-N 2.89Å; D832-N834 PolarHBondContact OD2-ND2 2.64Å; D832-L835 PolarHBondContact O-N 3.47Å; D832-L835 WeakPolarHBondContact OD1-CB 3.42Å; D832-L835 PolarHBondContact OD1-N 3.17Å; D832-L836 VanDerWaalsContact O-CB 3.24Å; D832-L836 WeakPolarHBondContact O-CB 3.45Å; D832-L836 PolarHBondContact O-N 2.79Å
833	G	93.8	Very high	93.6	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62	-22.8	178.7	0	0	0	0	0	115.6	L801 I804 L837	L801-G833 CarbonylContact O-C 3.57Å; L801-G833 VanDerWaalsContact O-C 3.32Å; L801-G833 WeakPolarHBondContact O-CA 3.23Å; I804-G833 PolarHBondContact O-N 2.92Å; G833-L837 WeakPolarHBondContact O-CG 3.44Å
834	N	93.9	Very high	93.5	Very high	67 Å²	67	60.6 Å²	60.6	36%	0.358	32%	0.315	S	S	.	.	H	α-helix	trans	-84.3	-44.7	-179.4	-57.3	-62.4	0	0	0	111.1	G803 D832 L836 L837	G803-N834 PolarHBondContact N-OD1 2.59Å; D832-N834 PolarHBondContact O-N 3.38Å; D832-N834 WeakPolarHBondContact OD1-CA 3.46Å; D832-N834 WeakPolarHBondContact OD1-CB 3.22Å; D832-N834 PolarHBondContact OD1-N 2.89Å; D832-N834 PolarHBondContact OD2-ND2 2.64Å; N834-L836 VanDerWaalsContact C-N 3.33Å; N834-L837 PolarHBondContact O-N 3.37Å
835	L	94.3	Very high	93.4	Very high	66 Å²	66	59.6 Å²	59.6	35%	0.346	31%	0.308	S	S	.	.	H	α-helix	trans	-66.5	-37	174.9	-175.5	52.5	0	0	0	111	I831 D832 L837 Q838 L839	I831-L835 HydrophobicContact CD1-CD2 3.53Å; I831-L835 HydrophobicContact CD1-CG 4.01Å; I831-L835 HydrophobicContact CG2-CB 4.4Å; I831-L835 HydrophobicContact CG2-CG 4.4Å; D832-L835 PolarHBondContact O-N 3.47Å; D832-L835 WeakPolarHBondContact OD1-CB 3.42Å; D832-L835 PolarHBondContact OD1-N 3.17Å; L835-L837 PolarHBondContact O-N 2.74Å; L835-Q838 WeakPolarHBondContact O-CA 3.37Å; L835-Q838 WeakPolarHBondContact O-CB 3.37Å; L835-Q838 PolarHBondContact O-N 2.74Å; L835-L839 HydrophobicContact CD1-CD2 4.38Å; L835-L839 HydrophobicContact CG-CD2 4.45Å; L835-L839 WeakPolarHBondContact O-CG 3.42Å; L835-L839 PolarHBondContact O-N 2.8Å
836	L	93.8	Very high	93.2	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-56.4	-32.6	173	-174.3	64.5	0	0	0	113.3	L801 V809 F826 I831 D832 N834 Q838 L839 L858 I862	L801-L836 HydrophobicContact CD1-CD2 4.29Å; V809-L836 HydrophobicContact CG1-CD2 4.07Å; V809-L836 HydrophobicContact CG2-CD2 4.08Å; F826-L836 HydrophobicContact CD1-CD1 4.23Å; F826-L836 HydrophobicContact CE1-CD1 3.74Å; I831-L836 HydrophobicContact CG2-CB 4Å; I831-L836 HydrophobicContact CG2-CD1 4.28Å; D832-L836 VanDerWaalsContact O-CB 3.24Å; D832-L836 WeakPolarHBondContact O-CB 3.45Å; D832-L836 PolarHBondContact O-N 2.79Å; N834-L836 VanDerWaalsContact C-N 3.33Å; L836-Q838 VanDerWaalsContact C-N 3.29Å; L836-L839 HydrophobicContact CD1-CD1 4.29Å; L836-L858 HydrophobicContact CD1-CD1 4.29Å; L836-L858 HydrophobicContact CD1-CD2 4.39Å; L836-I862 HydrophobicContact CD1-CD1 4.42Å; L836-I862 HydrophobicContact CG-CD1 4.32Å; L836-I862 HydrophobicContact CG-CG1 4.44Å; L836-I862 VanDerWaalsContact O-CD1 3.31Å; L836-I862 WeakPolarHBondContact O-CD1 3.24Å
837	L	93.4	Very high	92.8	Very high	74 Å²	74	67.9 Å²	67.9	39%	0.387	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-9.1	176.2	-69.3	174.9	0	0	0	113.6	L801 G833 N834 L835 I862	L801-L837 HydrophobicContact CB-CD2 4.17Å; L801-L837 HydrophobicContact CB-CG 4.35Å; L801-L837 HydrophobicContact CD1-CD2 4.46Å; G833-L837 WeakPolarHBondContact O-CG 3.44Å; N834-L837 PolarHBondContact O-N 3.37Å; L835-L837 PolarHBondContact O-N 2.74Å; L837-I862 HydrophobicContact CD2-CG2 3.82Å
838	Q	92.4	Very high	92.5	Very high	140 Å²	140	65.5 Å²	65.5	65%	0.654	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-17	178.7	-64.2	177.4	0.7	0	0	113.2	L835 L836 T840	L835-Q838 WeakPolarHBondContact O-CA 3.37Å; L835-Q838 WeakPolarHBondContact O-CB 3.37Å; L835-Q838 PolarHBondContact O-N 2.74Å; L836-Q838 VanDerWaalsContact C-N 3.29Å; Q838-T840 PolarHBondContact O-N 3.36Å
839	L	93.1	Very high	92.4	Very high	16 Å²	16	69.9 Å²	69.9	8%	0.084	35%	0.346	C	S	.	.			trans	-65.4	131	175.7	-53.2	-175.3	0	0	0	110.5	F826 I831 L835 L836 I843 L844 F848 M859	F826-L839 HydrophobicContact CE1-CD1 3.74Å; F826-L839 HydrophobicContact CZ-CD1 4.27Å; I831-L839 HydrophobicContact CG2-CD1 4.13Å; L835-L839 HydrophobicContact CD1-CD2 4.38Å; L835-L839 HydrophobicContact CG-CD2 4.45Å; L835-L839 WeakPolarHBondContact O-CG 3.42Å; L835-L839 PolarHBondContact O-N 2.8Å; L836-L839 HydrophobicContact CD1-CD1 4.29Å; L839-I843 HydrophobicContact CD2-CG2 3.98Å; L839-L844 HydrophobicContact CB-CD2 4.08Å; L839-L844 HydrophobicContact CB-CG 4.14Å; L839-L844 HydrophobicContact CD1-CD2 3.72Å; L839-F848 HydrophobicContact CD1-CE2 4.04Å; L839-F848 HydrophobicContact CD1-CZ 4.32Å; L839-F848 HydrophobicContact CD2-CE2 4.27Å; L839-M859 WeakPolarHBondContact O-CE 3.16Å
840	T	92.8	Very high	92.3	Very high	58 Å²	58	65 Å²	65	36%	0.356	32%	0.323	S	S	.	.			trans	-95.2	174.1	178.8	73.6	0	0	0	0	112	Q838 E842 I843 L844	Q838-T840 PolarHBondContact O-N 3.36Å; T840-E842 WeakPolarHBondContact CB-OE2 3.25Å; T840-E842 PolarHBondContact O-N 3.34Å; T840-E842 PolarHBondContact OG1-N 3.35Å; T840-E842 PolarHBondContact OG1-OE2 2.98Å; T840-I843 HydrophobicContact CG2-CD1 4.35Å; T840-I843 PolarHBondContact OG1-N 3.08Å; T840-L844 WeakPolarHBondContact O-CB 3.29Å; T840-L844 VanDerWaalsContact O-CG 3.25Å; T840-L844 WeakPolarHBondContact O-CG 3.29Å; T840-L844 PolarHBondContact O-N 2.84Å; T840-L844 VanDerWaalsContact O-N 3.09Å
841	E	92.2	Very high	92.3	Very high	102 Å²	102	60.7 Å²	60.7	48%	0.477	31%	0.312	S	S	.	.	H	α-helix	trans	-63.1	-34.4	175	168.7	144.1	-153	0	0	111.2	S845 V855 M859	E841-S845 WeakPolarHBondContact O-CB 3.35Å; E841-S845 PolarHBondContact O-N 3.35Å; E841-S845 VanDerWaalsContact O-N 3.13Å; E841-S845 PolarHBondContact O-OG 2.89Å; E841-V855 HydrophobicContact CB-CG1 4.04Å; E841-V855 HydrophobicContact CG-CG1 3.75Å; E841-M859 HydrophobicContact CB-CG 4.49Å
842	E	90.6	Very high	92.1	Very high	112 Å²	112	68.9 Å²	68.9	52%	0.523	35%	0.347	S	S	.	.	H	α-helix	trans	-62	-61.3	174.8	-56.7	72.9	-159	0	0	110.7	T840 L844 S845 E846	T840-E842 WeakPolarHBondContact CB-OE2 3.25Å; T840-E842 PolarHBondContact O-N 3.34Å; T840-E842 PolarHBondContact OG1-N 3.35Å; T840-E842 PolarHBondContact OG1-OE2 2.98Å; E842-L844 VanDerWaalsContact C-N 3.27Å; E842-L844 PolarHBondContact O-N 2.87Å; E842-S845 CarbonylContact O-C 3.54Å; E842-S845 WeakPolarHBondContact O-CA 3.45Å; E842-S845 PolarHBondContact O-N 2.84Å; E842-S845 PolarHBondContact O-OG 2.88Å; E842-E846 PolarHBondContact O-N 2.9Å
843	I	92.5	Very high	91.9	Very high	55 Å²	55	72.3 Å²	72.3	28%	0.282	37%	0.365	S	S	.	.	H	α-helix	trans	-53.8	-43.3	-179.7	-67	168.6	0	0	0	111.4	L839 T840 S845 D847 F848	L839-I843 HydrophobicContact CD2-CG2 3.98Å; T840-I843 HydrophobicContact CG2-CD1 4.35Å; T840-I843 PolarHBondContact OG1-N 3.08Å; I843-S845 VanDerWaalsContact C-N 3.28Å; I843-S845 PolarHBondContact O-N 3.37Å; I843-D847 HydrophobicContact CG2-CB 4.42Å; I843-D847 WeakPolarHBondContact O-CB 3.45Å; I843-D847 PolarHBondContact O-N 3.45Å; I843-F848 HydrophobicContact CG2-CD2 4.07Å; I843-F848 HydrophobicContact CG2-CE2 3.97Å; I843-F848 PolarHBondContact O-N 2.81Å
844	L	93.3	Very high	92	Very high	0 Å²	0	74.1 Å²	74.1	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-65.3	-29.7	177.6	-72.7	-177.5	0	0	0	113.4	F826 L839 T840 E842 F848 L850 V855 L858 M859	F826-L844 HydrophobicContact CE1-CD2 4.31Å; F826-L844 HydrophobicContact CZ-CD2 3.67Å; L839-L844 HydrophobicContact CB-CD2 4.08Å; L839-L844 HydrophobicContact CB-CG 4.14Å; L839-L844 HydrophobicContact CD1-CD2 3.72Å; T840-L844 WeakPolarHBondContact O-CB 3.29Å; T840-L844 VanDerWaalsContact O-CG 3.25Å; T840-L844 WeakPolarHBondContact O-CG 3.29Å; T840-L844 PolarHBondContact O-N 2.84Å; T840-L844 VanDerWaalsContact O-N 3.09Å; E842-L844 VanDerWaalsContact C-N 3.27Å; E842-L844 PolarHBondContact O-N 2.87Å; L844-F848 HydrophobicContact CD2-CD2 4.26Å; L844-L850 HydrophobicContact CB-CD1 4.24Å; L844-L850 HydrophobicContact CD2-CD1 4.02Å; L844-L850 WeakPolarHBondContact O-CB 3.3Å; L844-L850 VanDerWaalsContact O-CG 3.25Å; L844-L850 WeakPolarHBondContact O-CG 3.29Å; L844-L850 PolarHBondContact O-N 3.23Å; L844-V855 HydrophobicContact CB-CB 4.49Å; L844-V855 HydrophobicContact CB-CG1 3.89Å; L844-V855 HydrophobicContact CB-CG2 4.05Å; L844-V855 HydrophobicContact CD1-CG1 4.14Å; L844-L858 HydrophobicContact CD1-CB 4.33Å; L844-L858 HydrophobicContact CD1-CD2 3.86Å; L844-L858 HydrophobicContact CD1-CG 4.08Å; L844-L858 HydrophobicContact CD2-CD2 3.84Å; L844-M859 HydrophobicContact CD1-CE 3.44Å; L844-M859 VanDerWaalsContact CD1-CE 3.44Å; L844-M859 HydrophobicContact CD1-CG 4.36Å; L844-M859 HydrophobicContact CG-CE 4.47Å
845	S	92	Very high	92	Very high	49 Å²	49	71 Å²	71	34%	0.343	36%	0.357	S	S	.	.	H	α-helix	trans	-90.6	-35	-179.8	73.7	0	0	0	0	113.8	E841 E842 I843 H849	E841-S845 WeakPolarHBondContact O-CB 3.35Å; E841-S845 PolarHBondContact O-N 3.35Å; E841-S845 VanDerWaalsContact O-N 3.13Å; E841-S845 PolarHBondContact O-OG 2.89Å; E842-S845 CarbonylContact O-C 3.54Å; E842-S845 WeakPolarHBondContact O-CA 3.45Å; E842-S845 PolarHBondContact O-N 2.84Å; E842-S845 PolarHBondContact O-OG 2.88Å; I843-S845 VanDerWaalsContact C-N 3.28Å; I843-S845 PolarHBondContact O-N 3.37Å; S845-H849 WeakPolarHBondContact O-CA 2.95Å
846	E	87.9	Confident	92	Very high	128 Å²	128	73.6 Å²	73.6	60%	0.598	37%	0.365	S	S	*	.	H	α-helix	trans	-91.8	-50.7	-175.1	-61.6	-163.2	165.8	0	0	111.2	E842 H849	E842-E846 PolarHBondContact O-N 2.9Å; E846-H849 PolarHBondContact O-CE1 2.79Å; E846-H849 PolarHBondContact O-ND1 3.33Å
847	D	86.3	Confident	92.1	Very high	109 Å²	109	76.4 Å²	76.4	58%	0.583	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-43.8	-175.8	-54.9	-52	0	0	0	112.7	I843 H849	I843-D847 HydrophobicContact CG2-CB 4.42Å; I843-D847 WeakPolarHBondContact O-CB 3.45Å; I843-D847 PolarHBondContact O-N 3.45Å; D847-H849 VanDerWaalsContact C-N 3.3Å
848	F	88.5	Confident	92.1	Very high	17 Å²	17	72.9 Å²	72.9	8%	0.075	36%	0.359	C	S	.	.	S	Bend	trans	-87.5	2	177.7	-68.5	-91.6	0	0	0	113.6	L825 F826 E829 I831 L839 I843 L844 L850	L825-F848 HydrophobicContact CD2-CB 4.41Å; L825-F848 HydrophobicContact CD2-CD1 3.84Å; L825-F848 HydrophobicContact CG-CD1 4.01Å; L825-F848 HydrophobicContact CG-CE1 4.36Å; F826-F848 AromaticContact CD2-CD1 3.75Å; F826-F848 HydrophobicContact CD2-CD1 3.75Å; F826-F848 AromaticContact CD2-CE1 3.97Å; F826-F848 HydrophobicContact CD2-CE1 3.97Å; F826-F848 HydrophobicContact CE1-CE1 4.48Å; F826-F848 HydrophobicContact CE2-CB 4.3Å; F826-F848 AromaticContact CE2-CD1 3.41Å; F826-F848 HydrophobicContact CE2-CD1 3.41Å; F826-F848 VanDerWaalsContact CE2-CD1 3.41Å; F826-F848 AromaticContact CE2-CE1 3.95Å; F826-F848 HydrophobicContact CE2-CE1 3.95Å; F826-F848 AromaticContact CE2-CG 3.97Å; F826-F848 HydrophobicContact CE2-CG 3.97Å; F826-F848 HydrophobicContact CG-CD1 4.48Å; F826-F848 HydrophobicContact CG-CE1 4.27Å; F826-F848 AromaticContact CZ-CD1 3.89Å; F826-F848 HydrophobicContact CZ-CD1 3.89Å; F826-F848 HydrophobicContact CZ-CE1 4.21Å; F826-F848 HydrophobicContact CZ-CG 4.17Å; E829-F848 HydrophobicContact CB-CE1 4.34Å; E829-F848 HydrophobicContact CB-CZ 4.38Å; E829-F848 HydrophobicContact CG-CE1 4.17Å; E829-F848 HydrophobicContact CG-CZ 4.41Å; I831-F848 HydrophobicContact CD1-CZ 3.88Å; I831-F848 HydrophobicContact CG1-CE1 4.16Å; I831-F848 HydrophobicContact CG1-CZ 3.95Å; L839-F848 HydrophobicContact CD1-CE2 4.04Å; L839-F848 HydrophobicContact CD1-CZ 4.32Å; L839-F848 HydrophobicContact CD2-CE2 4.27Å; I843-F848 HydrophobicContact CG2-CD2 4.07Å; I843-F848 HydrophobicContact CG2-CE2 3.97Å; I843-F848 PolarHBondContact O-N 2.81Å; L844-F848 HydrophobicContact CD2-CD2 4.26Å; F848-L850 HydrophobicContact CB-CD1 4.49Å; F848-L850 HydrophobicContact CB-CD2 4.41Å; F848-L850 HydrophobicContact CB-CG 3.95Å; F848-L850 WeakPolarHBondContact O-CD2 3.4Å; F848-L850 PolarHBondContact O-N 2.82Å
849	H	90.4	Very high	92.2	Very high	158 Å²	158	68 Å²	68	73%	0.731	34%	0.337	S	S	*	.			trans	48.5	28.4	179.2	-60.7	-23.3	0	0	0	114.9	S845 E846 D847	S845-H849 WeakPolarHBondContact O-CA 2.95Å; E846-H849 PolarHBondContact O-CE1 2.79Å; E846-H849 PolarHBondContact O-ND1 3.33Å; D847-H849 VanDerWaalsContact C-N 3.3Å
850	L	92.8	Very high	92.2	Very high	6 Å²	6	71.4 Å²	71.4	3%	0.031	35%	0.352	C	S	.	.			trans	-73.3	135.4	-176.4	-56.8	-174.3	0	0	0	110.7	I822 F826 L844 F848 Q854 V855 L858	I822-L850 HydrophobicContact CB-CD2 4.2Å; I822-L850 HydrophobicContact CD1-CD2 3.41Å; I822-L850 VanDerWaalsContact CD1-CD2 3.41Å; I822-L850 HydrophobicContact CG1-CD2 3.58Å; I822-L850 HydrophobicContact CG2-CD2 3.54Å; F826-L850 HydrophobicContact CE2-CD1 4.35Å; F826-L850 HydrophobicContact CZ-CD1 4.36Å; L844-L850 HydrophobicContact CB-CD1 4.24Å; L844-L850 HydrophobicContact CD2-CD1 4.02Å; L844-L850 WeakPolarHBondContact O-CB 3.3Å; L844-L850 VanDerWaalsContact O-CG 3.25Å; L844-L850 WeakPolarHBondContact O-CG 3.29Å; L844-L850 PolarHBondContact O-N 3.23Å; F848-L850 HydrophobicContact CB-CD1 4.49Å; F848-L850 HydrophobicContact CB-CD2 4.41Å; F848-L850 HydrophobicContact CB-CG 3.95Å; F848-L850 WeakPolarHBondContact O-CD2 3.4Å; F848-L850 PolarHBondContact O-N 2.82Å; L850-Q854 HydrophobicContact CB-CB 4.06Å; L850-V855 HydrophobicContact CB-CG2 3.6Å; L850-V855 WeakPolarHBondContact O-CG2 3.44Å; L850-L858 HydrophobicContact CD1-CD2 4.18Å
851	S	94.4	Very high	92.3	Very high	59 Å²	59	68.6 Å²	68.6	41%	0.413	34%	0.335	S	S	.	.			trans	-62.6	153.3	173.5	69.7	0	0	0	0	111.3	L853 Q854 V855	S851-L853 PolarHBondContact O-N 2.99Å; S851-Q854 VanDerWaalsContact CB-OE1 3.3Å; S851-Q854 WeakPolarHBondContact O-CA 3.24Å; S851-Q854 WeakPolarHBondContact O-CB 3.32Å; S851-Q854 PolarHBondContact O-N 2.93Å; S851-Q854 VanDerWaalsContact OG-CD 3.27Å; S851-Q854 WeakPolarHBondContact OG-CG 3.42Å; S851-Q854 PolarHBondContact OG-OE1 2.89Å; S851-V855 PolarHBondContact O-N 2.97Å
852	K	91.1	Very high	92.3	Very high	179 Å²	179	65.4 Å²	65.4	78%	0.778	32%	0.321	S	S	*	.	H	α-helix	trans	-54.8	-24.3	-177	-58	-168.1	177.7	-166.8	0	114.4	K856	K852-K856 WeakPolarHBondContact O-CB 3.04Å; K852-K856 PolarHBondContact O-N 2.9Å
853	L	91.6	Very high	92.3	Very high	124 Å²	124	66.3 Å²	66.3	65%	0.649	33%	0.329	S	S	*	.	H	α-helix	trans	-77.4	-35.7	172.7	-178.5	60.4	0	0	0	112.7	S851 K857	S851-L853 PolarHBondContact O-N 2.99Å; L853-K857 WeakPolarHBondContact O-CB 3.44Å; L853-K857 WeakPolarHBondContact O-CG 3.43Å; L853-K857 PolarHBondContact O-N 2.62Å
854	Q	93.9	Very high	92	Very high	38 Å²	38	65.9 Å²	65.9	18%	0.178	34%	0.338	C	S	.	.	H	α-helix	trans	-73.5	-45	177.9	-68.4	165.8	-53.6	0	0	111.3	L818 I822 L850 S851 K856 K857 L858	L818-Q854 HydrophobicContact CD2-CB 3.61Å; L818-Q854 HydrophobicContact CD2-CG 3.63Å; I822-Q854 VanDerWaalsContact CD1-NE2 3.27Å; L850-Q854 HydrophobicContact CB-CB 4.06Å; S851-Q854 VanDerWaalsContact CB-OE1 3.3Å; S851-Q854 WeakPolarHBondContact O-CA 3.24Å; S851-Q854 WeakPolarHBondContact O-CB 3.32Å; S851-Q854 PolarHBondContact O-N 2.93Å; S851-Q854 VanDerWaalsContact OG-CD 3.27Å; S851-Q854 WeakPolarHBondContact OG-CG 3.42Å; S851-Q854 PolarHBondContact OG-OE1 2.89Å; Q854-K856 VanDerWaalsContact C-N 3.34Å; Q854-K856 PolarHBondContact O-N 2.93Å; Q854-K857 WeakPolarHBondContact O-CB 3.36Å; Q854-K857 PolarHBondContact O-N 3.1Å; Q854-L858 PolarHBondContact O-N 2.97Å
855	V	95.6	Very high	92	Very high	1 Å²	1	70.6 Å²	70.6	1%	0.006	36%	0.356	C	S	.	.	H	α-helix	trans	-56.2	-50.6	172.1	-175.9	0	0	0	0	110.1	E841 L844 L850 S851 K857 L858 M859	E841-V855 HydrophobicContact CB-CG1 4.04Å; E841-V855 HydrophobicContact CG-CG1 3.75Å; L844-V855 HydrophobicContact CB-CB 4.49Å; L844-V855 HydrophobicContact CB-CG1 3.89Å; L844-V855 HydrophobicContact CB-CG2 4.05Å; L844-V855 HydrophobicContact CD1-CG1 4.14Å; L850-V855 HydrophobicContact CB-CG2 3.6Å; L850-V855 WeakPolarHBondContact O-CG2 3.44Å; S851-V855 PolarHBondContact O-N 2.97Å; V855-K857 PolarHBondContact O-N 2.9Å; V855-L858 PolarHBondContact O-N 3.19Å; V855-L858 VanDerWaalsContact O-N 3.08Å; V855-M859 HydrophobicContact CG1-CG 4.2Å; V855-M859 WeakPolarHBondContact O-CB 3.22Å; V855-M859 PolarHBondContact O-N 2.97Å
856	K	94.4	Very high	91.9	Very high	121 Å²	121	70.5 Å²	70.5	53%	0.526	35%	0.348	S	S	.	.	H	α-helix	trans	-61.4	-38.6	179.5	-172.7	166.2	-173.1	164.2	0	113.5	K852 Q854 Q860	K852-K856 WeakPolarHBondContact O-CB 3.04Å; K852-K856 PolarHBondContact O-N 2.9Å; Q854-K856 VanDerWaalsContact C-N 3.34Å; Q854-K856 PolarHBondContact O-N 2.93Å; K856-Q860 VanDerWaalsContact O-CB 3.32Å; K856-Q860 WeakPolarHBondContact O-CB 3.42Å; K856-Q860 VanDerWaalsContact O-CG 3.27Å; K856-Q860 WeakPolarHBondContact O-CG 3.17Å; K856-Q860 PolarHBondContact O-N 3.13Å
857	K	94	Very high	91.9	Very high	58 Å²	58	65.9 Å²	65.9	25%	0.252	33%	0.329	S	S	.	.	H	α-helix	trans	-60	-47.4	171.3	-84.8	179.4	168.7	-161.9	0	111.5	I816 G817 L853 Q854 V855 Q860 F861 W865	I816-K857 PolarHBondContact O-NZ 2.85Å; G817-K857 PolarHBondContact O-NZ 2.79Å; L853-K857 WeakPolarHBondContact O-CB 3.44Å; L853-K857 WeakPolarHBondContact O-CG 3.43Å; L853-K857 PolarHBondContact O-N 2.62Å; Q854-K857 WeakPolarHBondContact O-CB 3.36Å; Q854-K857 PolarHBondContact O-N 3.1Å; V855-K857 PolarHBondContact O-N 2.9Å; K857-Q860 PolarHBondContact O-N 3.18Å; K857-F861 WeakPolarHBondContact O-CB 3.44Å; K857-F861 PolarHBondContact O-N 3.27Å; K857-W865 HydrophobicContact CG-CZ3 4.47Å
858	L	95	Very high	91.6	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-70.7	-43.9	-175.8	-175.4	50.6	0	0	0	111.8	L813 I816 F826 L836 L844 L850 Q854 V855 Q860 F861 I862	L813-L858 HydrophobicContact CD2-CD1 3.64Å; L813-L858 HydrophobicContact CD2-CD2 3.96Å; L813-L858 HydrophobicContact CD2-CG 4.46Å; I816-L858 HydrophobicContact CD1-CB 4.29Å; I816-L858 HydrophobicContact CD1-CD1 3.97Å; F826-L858 HydrophobicContact CE1-CD2 4.03Å; F826-L858 HydrophobicContact CZ-CD2 3.7Å; L836-L858 HydrophobicContact CD1-CD1 4.29Å; L836-L858 HydrophobicContact CD1-CD2 4.39Å; L844-L858 HydrophobicContact CD1-CB 4.33Å; L844-L858 HydrophobicContact CD1-CD2 3.86Å; L844-L858 HydrophobicContact CD1-CG 4.08Å; L844-L858 HydrophobicContact CD2-CD2 3.84Å; L850-L858 HydrophobicContact CD1-CD2 4.18Å; Q854-L858 PolarHBondContact O-N 2.97Å; V855-L858 PolarHBondContact O-N 3.19Å; V855-L858 VanDerWaalsContact O-N 3.08Å; L858-Q860 PolarHBondContact O-N 2.85Å; L858-F861 HydrophobicContact CD1-CD1 4.4Å; L858-F861 WeakPolarHBondContact O-CB 3.35Å; L858-F861 PolarHBondContact O-N 3.15Å; L858-F861 VanDerWaalsContact O-N 3.12Å; L858-I862 HydrophobicContact CD1-CD1 4.29Å; L858-I862 HydrophobicContact CG-CD1 4.14Å; L858-I862 WeakPolarHBondContact O-CG1 3.41Å; L858-I862 PolarHBondContact O-N 3.43Å
859	M	94.5	Very high	90.7	Very high	37 Å²	37	78.3 Å²	78.3	18%	0.182	38%	0.384	C	S	.	.	H	α-helix	trans	-59.4	-42.4	172.2	-80	-67.1	118.9	0	0	112.3	L839 E841 L844 V855 I862 N863	L839-M859 WeakPolarHBondContact O-CE 3.16Å; E841-M859 HydrophobicContact CB-CG 4.49Å; L844-M859 HydrophobicContact CD1-CE 3.44Å; L844-M859 VanDerWaalsContact CD1-CE 3.44Å; L844-M859 HydrophobicContact CD1-CG 4.36Å; L844-M859 HydrophobicContact CG-CE 4.47Å; V855-M859 HydrophobicContact CG1-CG 4.2Å; V855-M859 WeakPolarHBondContact O-CB 3.22Å; V855-M859 PolarHBondContact O-N 2.97Å; M859-I862 HydrophobicContact CE-CD1 3.65Å; M859-N863 WeakPolarHBondContact O-CB 3.4Å; M859-N863 PolarHBondContact O-N 2.91Å; M859-N863 PolarHBondContact O-ND2 2.87Å
860	Q	92.4	Very high	90.7	Very high	88 Å²	88	74.3 Å²	74.3	41%	0.411	37%	0.367	S	S	.	.	H	α-helix	trans	-65.3	-39.5	173.4	-75.1	-175.5	-12.8	0	0	111.8	K856 K857 L858 N863 G864 W865	K856-Q860 VanDerWaalsContact O-CB 3.32Å; K856-Q860 WeakPolarHBondContact O-CB 3.42Å; K856-Q860 VanDerWaalsContact O-CG 3.27Å; K856-Q860 WeakPolarHBondContact O-CG 3.17Å; K856-Q860 PolarHBondContact O-N 3.13Å; K857-Q860 PolarHBondContact O-N 3.18Å; L858-Q860 PolarHBondContact O-N 2.85Å; Q860-N863 CarbonylContact O-C 3.59Å; Q860-N863 WeakPolarHBondContact O-CA 3.16Å; Q860-N863 PolarHBondContact O-N 2.98Å; Q860-N863 VanDerWaalsContact O-N 3.17Å; Q860-G864 PolarHBondContact O-N 2.89Å; Q860-W865 HydrophobicContact CB-CB 3.92Å; Q860-W865 HydrophobicContact CB-CD2 4.31Å; Q860-W865 HydrophobicContact CB-CE3 4.14Å; Q860-W865 HydrophobicContact CB-CG 4.26Å; Q860-W865 WeakPolarHBondContact O-CB 3.48Å; Q860-W865 PolarHBondContact O-N 3.35Å
861	F	93.9	Very high	90.6	Very high	0 Å²	0	77.9 Å²	77.9	0%	0	39%	0.385	C	S	.	.	H	α-helix	trans	-65.3	-40.2	177.4	179.6	-92.8	0	0	0	113.1	P797 L801 C812 I816 K857 L858 N863 G864 W865 R866	P797-F861 HydrophobicContact CB-CE2 3.88Å; P797-F861 HydrophobicContact CB-CZ 3.7Å; P797-F861 HydrophobicContact CG-CE2 3.99Å; P797-F861 HydrophobicContact CG-CZ 4.33Å; L801-F861 HydrophobicContact CD1-CD1 3.9Å; L801-F861 HydrophobicContact CD1-CE1 3.71Å; L801-F861 HydrophobicContact CD2-CE1 3.77Å; L801-F861 HydrophobicContact CD2-CZ 4.19Å; L801-F861 HydrophobicContact CG-CE1 4.39Å; C812-F861 HydrophobicContact CB-CE1 3.7Å; C812-F861 HydrophobicContact CB-CZ 3.59Å; I816-F861 HydrophobicContact CD1-CB 4.3Å; I816-F861 HydrophobicContact CD1-CG 4.45Å; I816-F861 HydrophobicContact CG2-CB 4.07Å; I816-F861 HydrophobicContact CG2-CD2 3.24Å; I816-F861 HydrophobicContact CG2-CE2 3.77Å; I816-F861 HydrophobicContact CG2-CG 3.77Å; K857-F861 WeakPolarHBondContact O-CB 3.44Å; K857-F861 PolarHBondContact O-N 3.27Å; L858-F861 HydrophobicContact CD1-CD1 4.4Å; L858-F861 WeakPolarHBondContact O-CB 3.35Å; L858-F861 PolarHBondContact O-N 3.15Å; L858-F861 VanDerWaalsContact O-N 3.12Å; F861-N863 VanDerWaalsContact C-N 3.28Å; F861-N863 PolarHBondContact O-N 3.17Å; F861-G864 PolarHBondContact O-N 3.17Å; F861-W865 WeakPolarHBondContact CA-O 3.42Å; F861-W865 HydrophobicContact CB-CE3 4.38Å; F861-W865 WeakPolarHBondContact CD2-O 3.37Å; F861-R866 VanDerWaalsContact CE2-CD 3.44Å; F861-R866 PolarHBondContact O-NH1 2.76Å
862	I	92.7	Very high	90.4	Very high	34 Å²	34	78.9 Å²	78.9	17%	0.174	38%	0.383	C	S	.	.	H	α-helix	trans	-58.3	-43.6	170.1	-76.8	159.7	0	0	0	110.2	L801 L836 L837 L858 M859 G864	L801-I862 HydrophobicContact CD1-CG1 4.16Å; L836-I862 HydrophobicContact CD1-CD1 4.42Å; L836-I862 HydrophobicContact CG-CD1 4.32Å; L836-I862 HydrophobicContact CG-CG1 4.44Å; L836-I862 VanDerWaalsContact O-CD1 3.31Å; L836-I862 WeakPolarHBondContact O-CD1 3.24Å; L837-I862 HydrophobicContact CD2-CG2 3.82Å; L858-I862 HydrophobicContact CD1-CD1 4.29Å; L858-I862 HydrophobicContact CG-CD1 4.14Å; L858-I862 WeakPolarHBondContact O-CG1 3.41Å; L858-I862 PolarHBondContact O-N 3.43Å; M859-I862 HydrophobicContact CE-CD1 3.65Å; I862-G864 PolarHBondContact O-N 3.5Å
863	N	90.6	Very high	90.3	Very high	132 Å²	132	73.1 Å²	73.1	71%	0.706	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	26.7	173.1	-71.8	-80.7	0	0	0	114.4	M859 Q860 F861 W865	M859-N863 WeakPolarHBondContact O-CB 3.4Å; M859-N863 PolarHBondContact O-N 2.91Å; M859-N863 PolarHBondContact O-ND2 2.87Å; Q860-N863 CarbonylContact O-C 3.59Å; Q860-N863 WeakPolarHBondContact O-CA 3.16Å; Q860-N863 PolarHBondContact O-N 2.98Å; Q860-N863 VanDerWaalsContact O-N 3.17Å; F861-N863 VanDerWaalsContact C-N 3.28Å; F861-N863 PolarHBondContact O-N 3.17Å; N863-W865 VanDerWaalsContact C-N 3.34Å; N863-W865 PolarHBondContact O-N 2.75Å
864	G	87.3	Confident	90.3	Very high	45 Å²	45	69.9 Å²	69.9	46%	0.464	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	-0.3	170.4	0	0	0	0	0	116.7	Q860 F861 I862	Q860-G864 PolarHBondContact O-N 2.89Å; F861-G864 PolarHBondContact O-N 3.17Å; I862-G864 PolarHBondContact O-N 3.5Å
865	W	92.4	Very high	90	Very high	100 Å²	100	72 Å²	72	38%	0.379	35%	0.353	S	S	.	.			trans	-64.9	138.8	172	172.5	77.2	0	0	0	110.8	I816 K857 Q860 F861 N863 P867	I816-W865 HydrophobicContact CG2-CZ3 4.2Å; K857-W865 HydrophobicContact CG-CZ3 4.47Å; Q860-W865 HydrophobicContact CB-CB 3.92Å; Q860-W865 HydrophobicContact CB-CD2 4.31Å; Q860-W865 HydrophobicContact CB-CE3 4.14Å; Q860-W865 HydrophobicContact CB-CG 4.26Å; Q860-W865 WeakPolarHBondContact O-CB 3.48Å; Q860-W865 PolarHBondContact O-N 3.35Å; F861-W865 WeakPolarHBondContact CA-O 3.42Å; F861-W865 HydrophobicContact CB-CE3 4.38Å; F861-W865 WeakPolarHBondContact CD2-O 3.37Å; N863-W865 VanDerWaalsContact C-N 3.34Å; N863-W865 PolarHBondContact O-N 2.75Å; W865-P867 HydrophobicContact CH2-CB 3.89Å; W865-P867 HydrophobicContact CH2-CG 4.15Å; W865-P867 HydrophobicContact CZ2-CB 3.87Å
866	R	91.1	Very high	89.6	Confident	47 Å²	47	77.1 Å²	77.1	18%	0.177	38%	0.377	C	S	.	.			trans	-130.8	128	172.3	-59.8	-64.5	179.7	-94.4	5.9	108.2	P798 F861	P798-R866 PolarHBondContact O-NH2 3.08Å; F861-R866 VanDerWaalsContact CE2-CD 3.44Å; F861-R866 PolarHBondContact O-NH1 2.76Å
867	P	86.3	Confident	89.3	Confident	30 Å²	30	73.7 Å²	73.7	20%	0.195	37%	0.366	C	S	.	.			trans	-61	141.1	171.2	25.5	-33.4	0	0	0	109.8	F815 I816 W865 I869	F815-P867 HydrophobicContact CD1-CG 3.95Å; F815-P867 HydrophobicContact CE1-CG 3.69Å; I816-P867 HydrophobicContact CG2-CG 4.38Å; W865-P867 HydrophobicContact CH2-CB 3.89Å; W865-P867 HydrophobicContact CH2-CG 4.15Å; W865-P867 HydrophobicContact CZ2-CB 3.87Å; P867-I869 HydrophobicContact CB-CG1 4.37Å; P867-I869 HydrophobicContact CG-CD1 4.43Å; P867-I869 HydrophobicContact CG-CG1 4.43Å
868	K	80.9	Confident	88.9	Confident	214 Å²	214	75 Å²	75	93%	0.93	38%	0.376	S	S	*	.			trans	-85.3	120.4	166.3	-63.1	-175.7	179.7	-175.3	0	107
869	I	69.3	Low	88.3	Confident	173 Å²	173	81.8 Å²	81.8	89%	0.887	41%	0.41	S	S	*	.			trans	-112.7	0	-176.6	-52.5	-177.9	0	0	0	107.9	F815 P867	F815-I869 HydrophobicContact CD1-CD1 4.32Å; F815-I869 HydrophobicContact CD2-CD1 3.99Å; F815-I869 HydrophobicContact CE1-CD1 4.03Å; F815-I869 HydrophobicContact CE2-CD1 3.68Å; F815-I869 HydrophobicContact CG-CD1 4.31Å; F815-I869 HydrophobicContact CZ-CD1 3.7Å; F815-I869 HydrophobicContact CZ-CG1 4.37Å; P867-I869 HydrophobicContact CB-CG1 4.37Å; P867-I869 HydrophobicContact CG-CD1 4.43Å; P867-I869 HydrophobicContact CG-CG1 4.43Å

Retrieved 869 of 869 residues in 551.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).