A0A5K4FBA4_SCHMA Loading...

receptor protein serine/threonine kinase

AlphaFold DB , UniProt , Accession A0A5K4FBA4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 811 aa.

						>A0A5K4FBA4_SCHMA|A0A5K4FBA4
MECHCTPSASNCGENRRKKCDRDVTHCLLSLRWQNESNKHIEHIQDCWHWSPDDPDCPKEPGLCYLLSESKEGFTNCCCKGPLCNGVDNNTIISPPPTQVNRSLVMTGLDPFFIQNSRPLGNTPLPSQSFDMQHTDSFLTLIITAPIIIGLFLILIFSVFALFLPRYRVCRLKQSMRFSWKHKTCTHCGKLSDLFNPLHCFSVCTRGHTVKDNISNKSVAQNEYFGMNSLSKHPITGLRWLSNECIELCSFIKKVELKAHGRFGQVWLGRFSSPDDQNDFNLNSSQLSLNKNNKEIDVAIKIFMSTEKRSWETEVALFNVPGLEHINILQYYGADQVIVDNSIGEDKLEYWLVTEYHPLGSVYDYLHVYDIQWIDLLKICTGLAQGLAHLHMEIPNLSKPSIAHRDLNSRNVLLKSDLTACIADFGLAIRFEAGQCMRDAHLQLGTRRYMAPEVLDGAIQFSKDAFLRIDVYAMGLVFWELMMRCCCGSNKNATIHITNYLAPYEIELGPQPSMEALQRWVAHAKQRPKFNPQWASDGGLCTLWETVEECWDQDAEARLSAGCVTKRLTTLLRLSVVNQQYNDSYNNNSNNNDGDGINEKDNNNNNNTIMSNYLTNSQKTDCKPPPPYYYCYYSPYNTTSTTTITTTTTTTTVTTTTTLLDASKDLSNGGYTTTSLRNYSRTDDIGVYNCSDVLSTTTTTDNNSNIDKINTILSRGSTGCPPTICLPYSMNINFSTLTDHRSNLITSEVSQCKRKNQTLCFNDILNGTENQIQYKYDSTEYLKPNQQSQTIVNEEQSTEYQKLLSSASNMK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	79.8	Confident	74.4	Confident	65 Å²	65	63.5 Å²	63.5	32%	0.32	38%	0.379	S	S	.	.				0	145.1	0	-173.6	177.4	73.7	0	0	108	C20 V24 H26	M1-C20 HydrophobicContact CB-CB 4.45Å; M1-C20 HydrophobicContact CE-CB 3.77Å; M1-C20 WeakPolarHBondContact CE-SG 3.48Å; M1-C20 PolarHBondContact O-N 3.15Å; M1-V24 HydrophobicContact CE-CB 4.05Å; M1-V24 HydrophobicContact CE-CG1 3.4Å; M1-V24 VanDerWaalsContact CE-O 3.24Å; M1-V24 WeakPolarHBondContact CE-O 3.28Å; M1-H26 WeakPolarHBondContact CE-O 3.47Å
2	E	83.1	Confident	74.6	Confident	82 Å²	82	60.8 Å²	60.8	38%	0.383	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	130	175.2	-68.5	178.6	-176.9	0	0	108.7	R17 K18 K19 N85	E2-R17 IonicContact OE2-NH1 3.92Å; E2-K18 WeakPolarHBondContact CA-O 3.33Å; E2-K19 HydrophobicContact CG-CG 4.41Å; E2-N85 PolarHBondContact O-ND2 3.47Å; E2-N85 VanDerWaalsContact O-ND2 3.13Å
3	C	83.6	Confident	74.5	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	156.7	172.3	-56	0	0	0	0	108.6	R17 K18 C20 C27	C3-R17 WeakPolarHBondContact O-CA 2.98Å; C3-K18 PolarHBondContact N-O 2.74Å; C3-K18 PolarHBondContact O-N 3.13Å; C3-C20 PolarHBondContact SG-SG 2.06Å; C3-C27 HydrophobicContact CB-CB 3.86Å; C3-C27 WeakPolarHBondContact CB-SG 3.35Å; C3-C27 VanDerWaalsContact SG-CA 3.52Å; C3-C27 WeakPolarHBondContact SG-CB 3.37Å; C3-C27 CovalentContact SG-SG 2.04Å; C3-C27 PolarHBondContact SG-SG 3.01Å
4	H	79.9	Confident	74.6	Confident	39 Å²	39	69.2 Å²	69.2	18%	0.181	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	158.2	163.1	-81.8	-75.5	0	0	0	110.5	R16 Q45 D46 N85	H4-R16 CarbonylContact C-O 3.53Å; H4-R16 WeakPolarHBondContact CA-O 3.29Å; H4-R16 WeakPolarHBondContact CB-O 3.45Å; H4-R16 PolarHBondContact ND1-O 3.04Å; H4-Q45 CarbonylContact C-O 3.55Å; H4-Q45 HydrophobicContact CB-CB 3.66Å; H4-Q45 HydrophobicContact CB-CG 3.66Å; H4-Q45 CarbonylContact O-C 3.49Å; H4-Q45 WeakPolarHBondContact O-CB 3.41Å; H4-D46 PolarHBondContact O-N 3.28Å; H4-N85 PolarHBondContact CD2-OD1 3.26Å; H4-N85 VanDerWaalsContact CD2-OD1 3.3Å; H4-N85 PolarHBondContact N-OD1 2.71Å
5	C	77.9	Confident	74.9	Confident	5 Å²	5	73.4 Å²	73.4	3%	0.034	43%	0.429	C	S	.	.			trans	-138.1	154.2	-178.3	49.4	0	0	0	0	111.5	A9 C12 R16 R17 K18 Q45	C5-A9 HydrophobicContact CB-CB 4.42Å; C5-C12 HydrophobicContact CB-CB 3.76Å; C5-C12 WeakPolarHBondContact CB-SG 3.3Å; C5-C12 WeakPolarHBondContact SG-CA 3.18Å; C5-C12 WeakPolarHBondContact SG-CB 3.26Å; C5-C12 CovalentContact SG-SG 2.02Å; C5-C12 PolarHBondContact SG-SG 2.94Å; C5-R16 PolarHBondContact N-O 2.87Å; C5-R17 PolarHBondContact SG-N 2.99Å; C5-R17 VanDerWaalsContact SG-N 3.4Å; C5-K18 HydrophobicContact CB-CB 3.9Å; C5-K18 HydrophobicContact CB-CD 4.36Å; C5-K18 HydrophobicContact CB-CG 4.43Å; C5-K18 PolarHBondContact SG-N 3.21Å; C5-Q45 VanDerWaalsContact CA-O 3.27Å; C5-Q45 WeakPolarHBondContact CA-O 3.01Å
6	T	72.7	Confident	75.2	Confident	36 Å²	36	77 Å²	77	22%	0.221	43%	0.433	C	S	.	.			trans	-67.3	139.7	167.8	-38.2	0	0	0	0	109.4	S8 A9 C12 I44	T6-S8 VanDerWaalsContact CG2-OG 3.23Å; T6-S8 WeakPolarHBondContact CG2-OG 3.17Å; T6-S8 PolarHBondContact O-N 2.76Å; T6-A9 VanDerWaalsContact O-CB 3.3Å; T6-A9 WeakPolarHBondContact O-CB 3.34Å; T6-A9 PolarHBondContact O-N 3.3Å; T6-C12 WeakPolarHBondContact O-CB 3.43Å; T6-C12 PolarHBondContact O-SG 3.1Å; T6-I44 HydrophobicContact CG2-CD1 4.4Å; T6-I44 WeakPolarHBondContact OG1-CG2 2.99Å
7	P	70.1	Confident	75.6	Confident	108 Å²	108	78.9 Å²	78.9	70%	0.701	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-21.4	174.9	-27.1	34.9	0	0	0	114.6
8	S	65.8	Low	76	Confident	94 Å²	94	76.8 Å²	76.8	66%	0.657	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-6.2	175.8	56.1	0	0	0	0	114.6	T6	T6-S8 VanDerWaalsContact CG2-OG 3.23Å; T6-S8 WeakPolarHBondContact CG2-OG 3.17Å; T6-S8 PolarHBondContact O-N 2.76Å
9	A	67	Low	76.5	Confident	22 Å²	22	81.5 Å²	81.5	18%	0.182	43%	0.434	C	S	.	.	S	Bend	trans	-79.2	136.8	179.8	0	0	0	0	0	111	C5 T6 N11 C12	C5-A9 HydrophobicContact CB-CB 4.42Å; T6-A9 VanDerWaalsContact O-CB 3.3Å; T6-A9 WeakPolarHBondContact O-CB 3.34Å; T6-A9 PolarHBondContact O-N 3.3Å; A9-N11 PolarHBondContact O-N 3.21Å; A9-C12 HydrophobicContact CB-CB 4.36Å; A9-C12 VanDerWaalsContact O-CB 3.29Å; A9-C12 WeakPolarHBondContact O-CB 3.41Å; A9-C12 PolarHBondContact O-N 3.14Å
10	S	66.3	Low	76.9	Confident	100 Å²	100	78.1 Å²	78.1	70%	0.699	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	136.6	173.3	48.1	0	0	0	0	110.4	C12	S10-C12 VanDerWaalsContact C-N 3.33Å; S10-C12 PolarHBondContact O-N 2.94Å
11	N	72.5	Confident	77.3	Confident	148 Å²	148	80.6 Å²	80.6	79%	0.791	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	20.8	-175.1	-50.9	-27.3	0	0	0	115.7	A9 G13	A9-N11 PolarHBondContact O-N 3.21Å; N11-G13 PolarHBondContact O-N 2.83Å
12	C	75.9	Confident	77.3	Confident	31 Å²	31	89.4 Å²	89.4	21%	0.209	46%	0.46	C	S	.	.			trans	-78.5	109.1	169.7	-167.2	0	0	0	0	110.4	C5 T6 A9 S10	C5-C12 HydrophobicContact CB-CB 3.76Å; C5-C12 WeakPolarHBondContact CB-SG 3.3Å; C5-C12 WeakPolarHBondContact SG-CA 3.18Å; C5-C12 WeakPolarHBondContact SG-CB 3.26Å; C5-C12 CovalentContact SG-SG 2.02Å; C5-C12 PolarHBondContact SG-SG 2.94Å; T6-C12 WeakPolarHBondContact O-CB 3.43Å; T6-C12 PolarHBondContact O-SG 3.1Å; A9-C12 HydrophobicContact CB-CB 4.36Å; A9-C12 VanDerWaalsContact O-CB 3.29Å; A9-C12 WeakPolarHBondContact O-CB 3.41Å; A9-C12 PolarHBondContact O-N 3.14Å; S10-C12 VanDerWaalsContact C-N 3.33Å; S10-C12 PolarHBondContact O-N 2.94Å
13	G	73.3	Confident	77	Confident	41 Å²	41	91.4 Å²	91.4	42%	0.423	47%	0.473	S	S	.	.			trans	-72.5	168.3	179.8	0	0	0	0	0	113.2	N11 N15 R16 R17	N11-G13 PolarHBondContact O-N 2.83Å; G13-N15 PolarHBondContact O-N 2.85Å; G13-R16 WeakPolarHBondContact O-CA 3.38Å; G13-R16 PolarHBondContact O-N 3.47Å; G13-R17 PolarHBondContact N-O 2.73Å
14	E	76.8	Confident	76.9	Confident	198 Å²	198	92.1 Å²	92.1	93%	0.925	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-29.4	180	-67.7	-175	154.8	0	0	113.7	R16	E14-R16 PolarHBondContact O-N 3.17Å; E14-R16 VanDerWaalsContact O-N 3.15Å
15	N	78.7	Confident	77	Confident	132 Å²	132	93.5 Å²	93.5	71%	0.706	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	10.4	178.4	-60.6	-18.7	0	0	0	113.8	G13 R17	G13-N15 PolarHBondContact O-N 2.85Å; N15-R17 PolarHBondContact O-N 3.12Å
16	R	80.2	Confident	77.4	Confident	131 Å²	131	93.4 Å²	93.4	49%	0.494	49%	0.488	S	S	.	.	S	Bend	trans	52.5	36.3	-169.6	-60	-160.1	-66.7	172	-0.1	113	H4 C5 G13 E14	H4-R16 CarbonylContact C-O 3.53Å; H4-R16 WeakPolarHBondContact CA-O 3.29Å; H4-R16 WeakPolarHBondContact CB-O 3.45Å; H4-R16 PolarHBondContact ND1-O 3.04Å; C5-R16 PolarHBondContact N-O 2.87Å; G13-R16 WeakPolarHBondContact O-CA 3.38Å; G13-R16 PolarHBondContact O-N 3.47Å; E14-R16 PolarHBondContact O-N 3.17Å; E14-R16 VanDerWaalsContact O-N 3.15Å
17	R	82.2	Confident	78	Confident	109 Å²	109	91.7 Å²	91.7	41%	0.411	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	137.7	177.9	-68.9	-173.9	178.8	-163	-0.2	110.7	E2 C3 C5 G13 N15	E2-R17 IonicContact OE2-NH1 3.92Å; C3-R17 WeakPolarHBondContact O-CA 2.98Å; C5-R17 PolarHBondContact SG-N 2.99Å; C5-R17 VanDerWaalsContact SG-N 3.4Å; G13-R17 PolarHBondContact N-O 2.73Å; N15-R17 PolarHBondContact O-N 3.12Å
18	K	82.2	Confident	78.6	Confident	41 Å²	41	87.3 Å²	87.3	18%	0.178	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	142.1	169.9	105.9	-179.6	-166.8	-174.8	0	110.5	E2 C3 C5 D46 C47	E2-K18 WeakPolarHBondContact CA-O 3.33Å; C3-K18 PolarHBondContact N-O 2.74Å; C3-K18 PolarHBondContact O-N 3.13Å; C5-K18 HydrophobicContact CB-CB 3.9Å; C5-K18 HydrophobicContact CB-CD 4.36Å; C5-K18 HydrophobicContact CB-CG 4.43Å; C5-K18 PolarHBondContact SG-N 3.21Å; K18-D46 WeakPolarHBondContact CE-OD1 3.3Å; K18-D46 IonicContact NZ-OD1 2.74Å; K18-D46 PolarHBondContact NZ-OD1 3.38Å; K18-D46 IonicContact NZ-OD2 3.41Å; K18-C47 WeakPolarHBondContact CE-SG 3.31Å; K18-C47 VanDerWaalsContact CG-SG 3.57Å
19	K	86.2	Confident	79.4	Confident	166 Å²	166	82.9 Å²	82.9	72%	0.722	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	123.1	174.2	-152.1	172.1	-170.1	173.9	0	108.3	E2	E2-K19 HydrophobicContact CG-CG 4.41Å
20	C	84.2	Confident	80	Confident	14 Å²	14	82.9 Å²	82.9	10%	0.095	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-80.3	154.2	178.8	-51.7	0	0	0	0	111.6	M1 C3 V24 C47	M1-C20 HydrophobicContact CB-CB 4.45Å; M1-C20 HydrophobicContact CE-CB 3.77Å; M1-C20 WeakPolarHBondContact CE-SG 3.48Å; M1-C20 PolarHBondContact O-N 3.15Å; C3-C20 PolarHBondContact SG-SG 2.06Å; C20-V24 HydrophobicContact CB-CB 3.79Å; C20-V24 HydrophobicContact CB-CG1 3.88Å; C20-V24 HydrophobicContact CB-CG2 4.37Å; C20-C47 WeakPolarHBondContact CA-SG 3.36Å; C20-C47 HydrophobicContact CB-CB 3.76Å; C20-C47 WeakPolarHBondContact CB-SG 3.48Å; C20-C47 WeakPolarHBondContact SG-CB 3.4Å; C20-C47 CovalentContact SG-SG 2.02Å; C20-C47 PolarHBondContact SG-SG 2.86Å
21	D	84.2	Confident	80.6	Confident	130 Å²	130	78.1 Å²	78.1	70%	0.695	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-59.4	159.9	172.6	-65.3	-34.7	0	0	0	111.6	D23 V24	D21-D23 PolarHBondContact O-N 3.05Å; D21-D23 VanDerWaalsContact O-N 3.07Å; D21-V24 HydrophobicContact CB-CG2 4.07Å; D21-V24 PolarHBondContact O-N 3.09Å; D21-V24 VanDerWaalsContact O-N 3.14Å
22	R	79.9	Confident	80.8	Confident	251 Å²	251	77.3 Å²	77.3	95%	0.947	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-26.3	-172.8	-73	-174.9	-177.5	177.2	2	113.8
23	D	78.4	Confident	80.7	Confident	123 Å²	123	80.2 Å²	80.2	66%	0.658	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-4.2	-173.3	-51.2	-32.4	0	0	0	112.8	D21	D21-D23 PolarHBondContact O-N 3.05Å; D21-D23 VanDerWaalsContact O-N 3.07Å
24	V	81.1	Confident	80.6	Confident	15 Å²	15	81.8 Å²	81.8	9%	0.091	37%	0.371	C	S	.	.			trans	-87.2	124.1	179.6	-177.9	0	0	0	0	109.6	M1 C20 D21 H26 C47 W48	M1-V24 HydrophobicContact CE-CB 4.05Å; M1-V24 HydrophobicContact CE-CG1 3.4Å; M1-V24 VanDerWaalsContact CE-O 3.24Å; M1-V24 WeakPolarHBondContact CE-O 3.28Å; C20-V24 HydrophobicContact CB-CB 3.79Å; C20-V24 HydrophobicContact CB-CG1 3.88Å; C20-V24 HydrophobicContact CB-CG2 4.37Å; D21-V24 HydrophobicContact CB-CG2 4.07Å; D21-V24 PolarHBondContact O-N 3.09Å; D21-V24 VanDerWaalsContact O-N 3.14Å; V24-H26 WeakPolarHBondContact CG1-O 3.45Å; V24-C47 HydrophobicContact CG1-CB 3.78Å; V24-W48 WeakPolarHBondContact CG1-O 3.37Å
25	T	82.1	Confident	80.1	Confident	69 Å²	69	78.9 Å²	78.9	42%	0.423	36%	0.362	S	S	.	.			trans	-117.6	-2.1	180	62.1	0	0	0	0	114.5	G81	T25-G81 PolarHBondContact O-N 3.32Å
26	H	85.7	Confident	79.8	Confident	3 Å²	3	81.2 Å²	81.2	1%	0.014	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	150.5	-177.4	-60.3	76.5	0	0	0	112.8	M1 V24 W48 C57 P58 C79	M1-H26 WeakPolarHBondContact CE-O 3.47Å; V24-H26 WeakPolarHBondContact CG1-O 3.45Å; H26-W48 HydrophobicContact CB-CB 4.32Å; H26-W48 PolarHBondContact O-N 2.66Å; H26-C57 PolarHBondContact CE1-SG 2.71Å; H26-C57 PolarHBondContact NE2-SG 3.36Å; H26-C57 VanDerWaalsContact NE2-SG 3.4Å; H26-P58 PolarHBondContact NE2-O 3.32Å; H26-C79 CarbonylContact C-O 3.51Å; H26-C79 WeakPolarHBondContact CA-O 3.45Å
27	C	84.4	Confident	79.2	Confident	0 Å²	0	77.3 Å²	77.3	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	135.2	165.4	-58.6	0	0	0	0	108.9	C3 L29 D46 C79 C84	C3-C27 HydrophobicContact CB-CB 3.86Å; C3-C27 WeakPolarHBondContact CB-SG 3.35Å; C3-C27 VanDerWaalsContact SG-CA 3.52Å; C3-C27 WeakPolarHBondContact SG-CB 3.37Å; C3-C27 CovalentContact SG-SG 2.04Å; C3-C27 PolarHBondContact SG-SG 3.01Å; C27-L29 HydrophobicContact CB-CD1 4.33Å; C27-L29 WeakPolarHBondContact O-CD1 2.94Å; C27-D46 CarbonylContact C-O 3.6Å; C27-D46 WeakPolarHBondContact CA-O 3.09Å; C27-C79 PolarHBondContact N-O 2.93Å; C27-C79 PolarHBondContact O-N 3.26Å; C27-C84 HydrophobicContact CB-CB 3.99Å
28	L	84.3	Confident	78.5	Confident	16 Å²	16	77.5 Å²	77.5	8%	0.084	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	133.8	167.2	175.3	71.1	0	0	0	108.5	Q45 D46 W48 L67 M106	L28-Q45 CarbonylContact O-C 3.57Å; L28-Q45 WeakPolarHBondContact O-CA 3.17Å; L28-Q45 WeakPolarHBondContact O-CB 3.46Å; L28-D46 PolarHBondContact N-O 2.93Å; L28-D46 PolarHBondContact O-N 3.48Å; L28-W48 HydrophobicContact CB-CB 4.14Å; L28-W48 HydrophobicContact CB-CE3 4.16Å; L28-W48 HydrophobicContact CD2-CE3 3.74Å; L28-W48 HydrophobicContact CD2-CZ3 3.85Å; L28-W48 HydrophobicContact CG-CE3 4.4Å; L28-L67 HydrophobicContact CD1-CD1 3.48Å; L28-L67 VanDerWaalsContact CD1-CD1 3.48Å; L28-M106 HydrophobicContact CD1-SD 3.78Å; L28-M106 HydrophobicContact CD2-CE 3.52Å; L28-M106 HydrophobicContact CD2-SD 3.28Å; L28-M106 WeakPolarHBondContact CD2-SD 3.47Å; L28-M106 HydrophobicContact CG-SD 4.06Å
29	L	81.2	Confident	77.8	Confident	1 Å²	1	82 Å²	82	1%	0.005	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	136.1	-179.5	-65.5	92.7	0	0	0	110.3	C27 L31 Q45 N76 C77 C79 C84 V87	C27-L29 HydrophobicContact CB-CD1 4.33Å; C27-L29 WeakPolarHBondContact O-CD1 2.94Å; L29-L31 HydrophobicContact CB-CD2 4.47Å; L29-L31 HydrophobicContact CD2-CD2 4.35Å; L29-Q45 HydrophobicContact CB-CG 4.49Å; L29-Q45 HydrophobicContact CD2-CG 4.15Å; L29-Q45 VanDerWaalsContact CD2-NE2 3.34Å; L29-Q45 HydrophobicContact CG-CG 3.9Å; L29-N76 CarbonylContact O-C 3.56Å; L29-N76 VanDerWaalsContact O-CA 3.22Å; L29-N76 WeakPolarHBondContact O-CA 3.12Å; L29-C77 PolarHBondContact N-O 3.15Å; L29-C77 PolarHBondContact O-N 3.44Å; L29-C79 HydrophobicContact CD1-CB 3.71Å; L29-C84 HydrophobicContact CD1-CB 4.11Å; L29-C84 WeakPolarHBondContact CD2-O 3.16Å; L29-V87 HydrophobicContact CD2-CB 4.23Å; L29-V87 HydrophobicContact CD2-CG2 3.47Å; L29-V87 VanDerWaalsContact CD2-CG2 3.47Å
30	S	80.1	Confident	76.8	Confident	22 Å²	22	75.8 Å²	75.8	15%	0.154	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	110.7	167.8	-151.5	0	0	0	0	107.2	H43 I44 N76	S30-H43 WeakPolarHBondContact O-CA 2.71Å; S30-H43 WeakPolarHBondContact O-CB 3.46Å; S30-H43 PolarHBondContact O-N 3.08Å; S30-I44 PolarHBondContact N-O 3.04Å; S30-I44 PolarHBondContact O-N 3.24Å; S30-I44 VanDerWaalsContact O-N 3.14Å; S30-N76 WeakPolarHBondContact CB-OD1 2.81Å; S30-N76 PolarHBondContact OG-OD1 2.65Å
31	L	78.1	Confident	76	Confident	0 Å²	0	78.6 Å²	78.6	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	138.6	-177	-56.9	175.2	0	0	0	108.6	L29 H40 I41 E42 F74 T75 I92	L29-L31 HydrophobicContact CB-CD2 4.47Å; L29-L31 HydrophobicContact CD2-CD2 4.35Å; L31-H40 HydrophobicContact CB-CB 4.07Å; L31-H40 HydrophobicContact CD1-CB 4.12Å; L31-I41 WeakPolarHBondContact CA-O 3.19Å; L31-E42 HydrophobicContact CD2-CB 4.46Å; L31-E42 HydrophobicContact CD2-CG 3.89Å; L31-F74 CarbonylContact O-C 3.57Å; L31-F74 VanDerWaalsContact O-CA 3.25Å; L31-F74 WeakPolarHBondContact O-CA 2.96Å; L31-T75 PolarHBondContact N-O 2.78Å; L31-T75 PolarHBondContact O-N 2.89Å; L31-I92 HydrophobicContact CD1-CD1 3.7Å; L31-I92 HydrophobicContact CD1-CG1 4.27Å
32	R	77.8	Confident	75.1	Confident	131 Å²	131	75 Å²	75	49%	0.494	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.4	172.7	-174.2	179.3	179	-169.9	-0.3	109.5	Q34 I41 H43 F74	R32-Q34 PolarHBondContact O-N 3.3Å; R32-I41 PolarHBondContact N-O 3.12Å; R32-I41 PolarHBondContact O-N 3.15Å; R32-H43 HydrophobicContact CB-CB 4.26Å; R32-F74 HydrophobicContact CB-CD1 4.07Å; R32-F74 HydrophobicContact CB-CE1 4Å; R32-F74 HydrophobicContact CG-CD1 4.33Å; R32-F74 HydrophobicContact CG-CE1 4.04Å; R32-F74 HydrophobicContact CG-CZ 4.48Å
33	W	73.6	Confident	74.5	Confident	91 Å²	91	66.8 Å²	66.8	35%	0.345	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	129.1	172.2	-173.6	-101.2	0	0	0	110.8	N35 N38 H40 G73	W33-N35 PolarHBondContact NE1-OD1 2.78Å; W33-N38 WeakPolarHBondContact CZ2-OD1 3.34Å; W33-H40 AromaticContact CE3-CE1 3.41Å; W33-H40 VanDerWaalsContact CE3-CE1 3.41Å; W33-H40 AromaticContact CE3-ND1 3.59Å; W33-H40 AromaticContact CE3-NE2 3.74Å; W33-H40 AromaticContact CZ3-CE1 3.58Å; W33-H40 AromaticContact CZ3-ND1 3.6Å; W33-G73 PolarHBondContact N-O 3.12Å
34	Q	70.4	Confident	73.9	Confident	74 Å²	74	63.9 Å²	63.9	35%	0.346	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	112	176.4	-156.4	-166.6	41.5	0	0	110.5	R32 E36 S37 N38 K39 I41	R32-Q34 PolarHBondContact O-N 3.3Å; Q34-E36 PolarHBondContact O-N 3.5Å; Q34-S37 PolarHBondContact O-N 3.03Å; Q34-S37 PolarHBondContact OE1-OG 2.96Å; Q34-N38 PolarHBondContact O-N 2.77Å; Q34-K39 PolarHBondContact N-O 3.48Å; Q34-I41 HydrophobicContact CB-CD1 3.9Å; Q34-I41 HydrophobicContact CB-CG1 4.17Å; Q34-I41 HydrophobicContact CG-CD1 4.08Å
35	N	68.2	Low	73.7	Confident	137 Å²	137	63.3 Å²	63.3	73%	0.733	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-28.8	-176.4	-69.9	-21.2	0	0	0	113.7	W33	W33-N35 PolarHBondContact NE1-OD1 2.78Å
36	E	71.6	Confident	73.6	Confident	181 Å²	181	62.4 Å²	62.4	85%	0.846	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-35.7	-177.1	-65.5	176.2	174	0	0	113.3	Q34	Q34-E36 PolarHBondContact O-N 3.5Å
37	S	66.9	Low	73.6	Confident	49 Å²	49	63.3 Å²	63.3	34%	0.343	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103	-7.1	-176.6	59.3	0	0	0	0	113.5	Q34 K39	Q34-S37 PolarHBondContact O-N 3.03Å; Q34-S37 PolarHBondContact OE1-OG 2.96Å; S37-K39 WeakPolarHBondContact O-CG 3.37Å; S37-K39 PolarHBondContact O-N 2.83Å
38	N	68.7	Low	73.5	Confident	113 Å²	113	67 Å²	67	60%	0.604	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	33.4	-177.9	-143.1	32.8	0	0	0	112.8	W33 Q34 N89	W33-N38 WeakPolarHBondContact CZ2-OD1 3.34Å; Q34-N38 PolarHBondContact O-N 2.77Å; N38-N89 PolarHBondContact O-ND2 3.07Å
39	K	67	Low	73.3	Confident	135 Å²	135	71.8 Å²	71.8	59%	0.587	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.1	149.9	-175.9	-73.4	178.8	-178.6	-173.8	0	109.9	Q34 S37	Q34-K39 PolarHBondContact N-O 3.48Å; S37-K39 WeakPolarHBondContact O-CG 3.37Å; S37-K39 PolarHBondContact O-N 2.83Å
40	H	65.9	Low	72.8	Confident	37 Å²	37	72.7 Å²	72.7	17%	0.171	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	130.7	163.9	-75.8	91.5	0	0	0	109.6	L31 W33 T75 N89	L31-H40 HydrophobicContact CB-CB 4.07Å; L31-H40 HydrophobicContact CD1-CB 4.12Å; W33-H40 AromaticContact CE3-CE1 3.41Å; W33-H40 VanDerWaalsContact CE3-CE1 3.41Å; W33-H40 AromaticContact CE3-ND1 3.59Å; W33-H40 AromaticContact CE3-NE2 3.74Å; W33-H40 AromaticContact CZ3-CE1 3.58Å; W33-H40 AromaticContact CZ3-ND1 3.6Å; H40-T75 PolarHBondContact NE2-OG1 3.02Å; H40-N89 PolarHBondContact N-OD1 3.02Å; H40-N89 PolarHBondContact ND1-OD1 3.04Å
41	I	65.7	Low	72.1	Confident	73 Å²	73	74.4 Å²	74.4	37%	0.374	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	129.2	169.5	-63.8	-173.2	0	0	0	108.3	L31 R32 Q34 H43	L31-I41 WeakPolarHBondContact CA-O 3.19Å; R32-I41 PolarHBondContact N-O 3.12Å; R32-I41 PolarHBondContact O-N 3.15Å; Q34-I41 HydrophobicContact CB-CD1 3.9Å; Q34-I41 HydrophobicContact CB-CG1 4.17Å; Q34-I41 HydrophobicContact CG-CD1 4.08Å; I41-H43 PolarHBondContact O-N 3.34Å; I41-H43 VanDerWaalsContact O-N 3.08Å
42	E	66.6	Low	71.4	Confident	53 Å²	53	80 Å²	80	25%	0.248	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	111.4	172	-63.6	170.1	155	0	0	109.3	L31 G86 V87	L31-E42 HydrophobicContact CD2-CB 4.46Å; L31-E42 HydrophobicContact CD2-CG 3.89Å; E42-G86 WeakPolarHBondContact OE1-CA 3.21Å; E42-G86 PolarHBondContact OE1-N 2.73Å; E42-V87 PolarHBondContact OE1-N 3.41Å
43	H	66	Low	70.6	Confident	80 Å²	80	80.7 Å²	80.7	37%	0.37	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-50.9	-177.4	-164.5	-111	0	0	0	109.8	S30 R32 I41 F74	S30-H43 WeakPolarHBondContact O-CA 2.71Å; S30-H43 WeakPolarHBondContact O-CB 3.46Å; S30-H43 PolarHBondContact O-N 3.08Å; R32-H43 HydrophobicContact CB-CB 4.26Å; I41-H43 PolarHBondContact O-N 3.34Å; I41-H43 VanDerWaalsContact O-N 3.08Å; H43-F74 AromaticContact CE1-CE1 3.85Å; H43-F74 AromaticContact ND1-CE1 3.68Å
44	I	67.2	Low	70.1	Confident	61 Å²	61	78.6 Å²	78.6	31%	0.313	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	137.8	-175	-61.8	173.8	0	0	0	108.8	T6 S30	T6-I44 HydrophobicContact CG2-CD1 4.4Å; T6-I44 WeakPolarHBondContact OG1-CG2 2.99Å; S30-I44 PolarHBondContact N-O 3.04Å; S30-I44 PolarHBondContact O-N 3.24Å; S30-I44 VanDerWaalsContact O-N 3.14Å
45	Q	76	Confident	69.7	Low	3 Å²	3	79.2 Å²	79.2	1%	0.014	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	163.1	164.5	-48.4	-179.6	-8.7	0	0	110.1	H4 C5 L28 L29 C84 N85	H4-Q45 CarbonylContact C-O 3.55Å; H4-Q45 HydrophobicContact CB-CB 3.66Å; H4-Q45 HydrophobicContact CB-CG 3.66Å; H4-Q45 CarbonylContact O-C 3.49Å; H4-Q45 WeakPolarHBondContact O-CB 3.41Å; C5-Q45 VanDerWaalsContact CA-O 3.27Å; C5-Q45 WeakPolarHBondContact CA-O 3.01Å; L28-Q45 CarbonylContact O-C 3.57Å; L28-Q45 WeakPolarHBondContact O-CA 3.17Å; L28-Q45 WeakPolarHBondContact O-CB 3.46Å; L29-Q45 HydrophobicContact CB-CG 4.49Å; L29-Q45 HydrophobicContact CD2-CG 4.15Å; L29-Q45 VanDerWaalsContact CD2-NE2 3.34Å; L29-Q45 HydrophobicContact CG-CG 3.9Å; Q45-C84 PolarHBondContact NE2-O 3.34Å; Q45-N85 PolarHBondContact OE1-OD1 2.76Å
46	D	80.7	Confident	69.4	Low	51 Å²	51	77 Å²	77	27%	0.273	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	163.9	170	-155.2	-5.6	0	0	0	111.5	H4 K18 C27 L28	H4-D46 PolarHBondContact O-N 3.28Å; K18-D46 WeakPolarHBondContact CE-OD1 3.3Å; K18-D46 IonicContact NZ-OD1 2.74Å; K18-D46 PolarHBondContact NZ-OD1 3.38Å; K18-D46 IonicContact NZ-OD2 3.41Å; C27-D46 CarbonylContact C-O 3.6Å; C27-D46 WeakPolarHBondContact CA-O 3.09Å; L28-D46 PolarHBondContact N-O 2.93Å; L28-D46 PolarHBondContact O-N 3.48Å
47	C	85.4	Confident	69	Low	21 Å²	21	69.4 Å²	69.4	14%	0.142	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	128.5	174.5	-61.3	0	0	0	0	110.3	K18 C20 V24	K18-C47 WeakPolarHBondContact CE-SG 3.31Å; K18-C47 VanDerWaalsContact CG-SG 3.57Å; C20-C47 WeakPolarHBondContact CA-SG 3.36Å; C20-C47 HydrophobicContact CB-CB 3.76Å; C20-C47 WeakPolarHBondContact CB-SG 3.48Å; C20-C47 WeakPolarHBondContact SG-CB 3.4Å; C20-C47 CovalentContact SG-SG 2.02Å; C20-C47 PolarHBondContact SG-SG 2.86Å; V24-C47 HydrophobicContact CG1-CB 3.78Å
48	W	82.7	Confident	69.1	Low	79 Å²	79	67.1 Å²	67.1	30%	0.299	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.3	-178.5	-164.5	-95.3	0	0	0	112	V24 H26 L28 M106	V24-W48 WeakPolarHBondContact CG1-O 3.37Å; H26-W48 HydrophobicContact CB-CB 4.32Å; H26-W48 PolarHBondContact O-N 2.66Å; L28-W48 HydrophobicContact CB-CB 4.14Å; L28-W48 HydrophobicContact CB-CE3 4.16Å; L28-W48 HydrophobicContact CD2-CE3 3.74Å; L28-W48 HydrophobicContact CD2-CZ3 3.85Å; L28-W48 HydrophobicContact CG-CE3 4.4Å; W48-M106 HydrophobicContact CH2-CG 4.35Å
49	H	78.9	Confident	69.2	Low	115 Å²	115	68.7 Å²	68.7	53%	0.532	35%	0.354	S	S	.	.			trans	-96.2	124.6	176.6	-169.1	-72.4	0	0	0	109.8
50	W	70.9	Confident	69.7	Low	21 Å²	21	67.8 Å²	67.8	8%	0.08	35%	0.352	C	S	.	.			trans	-117.3	136.1	175.1	-144.7	-48.1	0	0	0	109.9	D54 D56 C57 P58 L67 C78 L104	W50-D54 PolarHBondContact NE1-OD2 2.87Å; W50-D56 HydrophobicContact CH2-CB 4.43Å; W50-D56 WeakPolarHBondContact CH2-O 3.26Å; W50-D56 VanDerWaalsContact CZ2-C 3.41Å; W50-D56 HydrophobicContact CZ2-CB 3.81Å; W50-D56 VanDerWaalsContact CZ2-O 3.32Å; W50-D56 WeakPolarHBondContact CZ2-O 3.47Å; W50-C57 HydrophobicContact CD2-CB 3.87Å; W50-C57 HydrophobicContact CG-CB 3.87Å; W50-C57 HydrophobicContact CZ2-CB 4.46Å; W50-P58 VanDerWaalsContact CE3-CD 3.45Å; W50-P58 HydrophobicContact CE3-CG 4.42Å; W50-P58 HydrophobicContact CZ3-CG 3.92Å; W50-L67 HydrophobicContact CH2-CD2 4.43Å; W50-C78 HydrophobicContact CZ3-CB 4.02Å; W50-L104 HydrophobicContact CH2-CD1 4.48Å; W50-L104 HydrophobicContact CZ2-CD1 4.12Å
51	S	66.4	Low	70.2	Confident	58 Å²	58	69.8 Å²	69.8	41%	0.406	37%	0.368	S	S	.	.			trans	-57.7	131.9	167	-174.3	0	0	0	0	110.3	D53 D54	S51-D53 PolarHBondContact O-N 3.4Å; S51-D53 VanDerWaalsContact O-N 3.11Å; S51-D54 PolarHBondContact O-N 2.82Å
52	P	61.9	Low	70.3	Confident	117 Å²	117	67 Å²	67	76%	0.76	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.4	175.7	-21.7	31.2	0	0	0	113.7
53	D	61.6	Low	70.7	Confident	145 Å²	145	66.1 Å²	66.1	78%	0.775	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	0.3	-173.9	-59.3	-41	0	0	0	113.8	S51	S51-D53 PolarHBondContact O-N 3.4Å; S51-D53 VanDerWaalsContact O-N 3.11Å
54	D	63.7	Low	71.1	Confident	48 Å²	48	62.3 Å²	62.3	26%	0.257	34%	0.337	S	S	.	.			trans	-80.6	122.3	-177.4	-165.8	-36.8	0	0	0	111.4	W50 S51 D56 C57	W50-D54 PolarHBondContact NE1-OD2 2.87Å; S51-D54 PolarHBondContact O-N 2.82Å; D54-D56 PolarHBondContact O-N 2.94Å; D54-D56 WeakPolarHBondContact OD1-CB 3.42Å; D54-D56 PolarHBondContact OD1-N 2.87Å; D54-C57 HydrophobicContact CB-CB 4.33Å; D54-C57 WeakPolarHBondContact O-CB 3.25Å; D54-C57 PolarHBondContact O-N 3.02Å
55	P	61.2	Low	71.7	Confident	87 Å²	87	61.7 Å²	61.7	57%	0.565	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-22.9	179.6	25.8	-34.1	0	0	0	113.7	C57	P55-C57 VanDerWaalsContact C-N 3.31Å
56	D	62.7	Low	71.7	Confident	91 Å²	91	63.7 Å²	63.7	49%	0.487	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-1.9	-178.8	-66.1	-32.1	0	0	0	113	W50 D54 P58	W50-D56 HydrophobicContact CH2-CB 4.43Å; W50-D56 WeakPolarHBondContact CH2-O 3.26Å; W50-D56 VanDerWaalsContact CZ2-C 3.41Å; W50-D56 HydrophobicContact CZ2-CB 3.81Å; W50-D56 VanDerWaalsContact CZ2-O 3.32Å; W50-D56 WeakPolarHBondContact CZ2-O 3.47Å; D54-D56 PolarHBondContact O-N 2.94Å; D54-D56 WeakPolarHBondContact OD1-CB 3.42Å; D54-D56 PolarHBondContact OD1-N 2.87Å; D56-P58 WeakPolarHBondContact O-CD 3Å
57	C	62.5	Low	71.5	Confident	21 Å²	21	63.9 Å²	63.9	14%	0.142	34%	0.342	C	S	.	.	S	Bend	trans	-69.7	124.2	-177.2	-178.3	0	0	0	0	112.7	H26 W50 D54 P55 K59	H26-C57 PolarHBondContact CE1-SG 2.71Å; H26-C57 PolarHBondContact NE2-SG 3.36Å; H26-C57 VanDerWaalsContact NE2-SG 3.4Å; W50-C57 HydrophobicContact CD2-CB 3.87Å; W50-C57 HydrophobicContact CG-CB 3.87Å; W50-C57 HydrophobicContact CZ2-CB 4.46Å; D54-C57 HydrophobicContact CB-CB 4.33Å; D54-C57 WeakPolarHBondContact O-CB 3.25Å; D54-C57 PolarHBondContact O-N 3.02Å; P55-C57 VanDerWaalsContact C-N 3.31Å; C57-K59 WeakPolarHBondContact O-CG 3.44Å; C57-K59 PolarHBondContact O-N 2.87Å; C57-K59 VanDerWaalsContact O-N 3.17Å
58	P	69.8	Low	70.9	Confident	0 Å²	0	65 Å²	65	0%	0	35%	0.351	C	S	.	.			trans	-53.6	118.6	172.1	-30.5	37.6	0	0	0	111.6	H26 W50 D56 Y65 C78 K80	H26-P58 PolarHBondContact NE2-O 3.32Å; W50-P58 VanDerWaalsContact CE3-CD 3.45Å; W50-P58 HydrophobicContact CE3-CG 4.42Å; W50-P58 HydrophobicContact CZ3-CG 3.92Å; D56-P58 WeakPolarHBondContact O-CD 3Å; P58-Y65 HydrophobicContact CB-CD2 3.38Å; P58-Y65 HydrophobicContact CB-CE2 3.56Å; P58-Y65 HydrophobicContact CB-CG 4.16Å; P58-Y65 HydrophobicContact CG-CD2 3.6Å; P58-Y65 HydrophobicContact CG-CE2 4.25Å; P58-Y65 HydrophobicContact CG-CG 3.92Å; P58-C78 HydrophobicContact CG-CB 4.03Å; P58-K80 WeakPolarHBondContact O-CD 3.33Å
59	K	71.5	Confident	70.5	Confident	147 Å²	147	67.8 Å²	67.8	64%	0.639	37%	0.367	S	S	*	.			trans	-95.7	-30.5	-177.6	-62.3	-169.7	-178.4	178.2	0	113.2	C57 K80	C57-K59 WeakPolarHBondContact O-CG 3.44Å; C57-K59 PolarHBondContact O-N 2.87Å; C57-K59 VanDerWaalsContact O-N 3.17Å; K59-K80 WeakPolarHBondContact O-CD 3.42Å; K59-K80 PolarHBondContact O-NZ 3.3Å
60	E	75.5	Confident	70.1	Confident	115 Å²	115	63.2 Å²	63.2	54%	0.537	35%	0.348	S	S	.	.	S	Bend	trans	-94.8	126.2	-175.6	-71.3	-174.4	-166.4	0	0	111.4	L63	E60-L63 HydrophobicContact CB-CD1 3.73Å; E60-L63 HydrophobicContact CB-CG 4.47Å; E60-L63 HydrophobicContact CG-CD1 4.49Å; E60-L63 WeakPolarHBondContact OE2-CD1 3.32Å
61	P	76.6	Confident	69.9	Low	79 Å²	79	68.4 Å²	68.4	51%	0.513	37%	0.371	S	S	.	.	B	Isolated β-bridge	trans	-72.8	142	178.6	30.6	-34.6	0	0	0	111.9	L63 K80 L83	P61-L63 VanDerWaalsContact C-N 3.34Å; P61-K80 WeakPolarHBondContact CA-O 3.25Å; P61-K80 WeakPolarHBondContact CB-O 3.21Å; P61-L83 HydrophobicContact CB-CD1 4.31Å
62	G	69.7	Low	69.9	Low	16 Å²	16	71.9 Å²	71.9	17%	0.165	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	84.4	-0.1	-180	0	0	0	0	0	115.5	K80 T91	G62-K80 PolarHBondContact N-O 3.12Å; G62-T91 WeakPolarHBondContact O-CG2 3.35Å
63	L	74.8	Confident	70.2	Confident	33 Å²	33	67.7 Å²	67.7	17%	0.173	36%	0.358	C	S	.	.			trans	-103.6	131.4	173.1	-66.3	174	0	0	0	110.4	E60 P61 Y65 C79 I93	E60-L63 HydrophobicContact CB-CD1 3.73Å; E60-L63 HydrophobicContact CB-CG 4.47Å; E60-L63 HydrophobicContact CG-CD1 4.49Å; E60-L63 WeakPolarHBondContact OE2-CD1 3.32Å; P61-L63 VanDerWaalsContact C-N 3.34Å; L63-Y65 HydrophobicContact CB-CD2 4.5Å; L63-Y65 HydrophobicContact CB-CE2 3.97Å; L63-C79 WeakPolarHBondContact O-CA 3.47Å; L63-C79 WeakPolarHBondContact O-CB 3.15Å; L63-I93 HydrophobicContact CB-CD1 4.03Å; L63-I93 HydrophobicContact CD1-CD1 3.54Å; L63-I93 HydrophobicContact CD2-CD1 3.47Å; L63-I93 VanDerWaalsContact CD2-CD1 3.47Å; L63-I93 HydrophobicContact CD2-CG1 4.12Å; L63-I93 HydrophobicContact CG-CD1 3.84Å
64	C	74.6	Confident	70.8	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	109.9	176.9	-138.8	0	0	0	0	110.3	C77 C78 C79 V87 T91 I92 I93	C64-C77 HydrophobicContact CB-CB 3.81Å; C64-C77 WeakPolarHBondContact CB-SG 3.44Å; C64-C77 WeakPolarHBondContact SG-CB 3.16Å; C64-C77 CovalentContact SG-SG 2.02Å; C64-C77 PolarHBondContact SG-SG 3.06Å; C64-C78 WeakPolarHBondContact CA-O 3.37Å; C64-C79 HydrophobicContact CB-CB 4.47Å; C64-V87 HydrophobicContact CB-CG1 3.81Å; C64-V87 HydrophobicContact CB-CG2 4.48Å; C64-T91 PolarHBondContact N-O 2.77Å; C64-I92 HydrophobicContact CB-CG1 4.5Å; C64-I92 WeakPolarHBondContact O-CA 3.36Å; C64-I93 PolarHBondContact O-N 2.79Å
65	Y	77.8	Confident	71.4	Confident	49 Å²	49	60.4 Å²	60.4	19%	0.192	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	121.4	177.9	-70.8	-101.1	0	0	0	109.7	P58 L63 L67 C77 C78	P58-Y65 HydrophobicContact CB-CD2 3.38Å; P58-Y65 HydrophobicContact CB-CE2 3.56Å; P58-Y65 HydrophobicContact CB-CG 4.16Å; P58-Y65 HydrophobicContact CG-CD2 3.6Å; P58-Y65 HydrophobicContact CG-CE2 4.25Å; P58-Y65 HydrophobicContact CG-CG 3.92Å; L63-Y65 HydrophobicContact CB-CD2 4.5Å; L63-Y65 HydrophobicContact CB-CE2 3.97Å; Y65-L67 PolarHBondContact O-N 2.93Å; Y65-C77 CarbonylContact O-C 3.45Å; Y65-C77 WeakPolarHBondContact O-CA 3.27Å; Y65-C77 VanDerWaalsContact O-CB 3.23Å; Y65-C77 WeakPolarHBondContact O-CB 3.44Å; Y65-C78 PolarHBondContact N-O 3.08Å; Y65-C78 PolarHBondContact O-N 3.11Å
66	L	77.1	Confident	72.3	Confident	44 Å²	44	57.2 Å²	57.2	23%	0.23	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	122.5	-177.8	-163	80.8	0	0	0	111.6	E69 T75 I92 I93	L66-E69 HydrophobicContact CD1-CG 4.21Å; L66-E69 HydrophobicContact CD2-CG 4.35Å; L66-T75 HydrophobicContact CD1-CG2 3.17Å; L66-I92 HydrophobicContact CD1-CG2 4.15Å; L66-I93 PolarHBondContact N-O 2.81Å
67	L	75.5	Confident	73.1	Confident	55 Å²	55	52.9 Å²	52.9	29%	0.288	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-45.9	175.6	-63.5	176.3	0	0	0	111.9	L28 W50 Y65 N76 C78	L28-L67 HydrophobicContact CD1-CD1 3.48Å; L28-L67 VanDerWaalsContact CD1-CD1 3.48Å; W50-L67 HydrophobicContact CH2-CD2 4.43Å; Y65-L67 PolarHBondContact O-N 2.93Å; L67-N76 HydrophobicContact CB-CB 4.34Å; L67-N76 WeakPolarHBondContact CB-O 3.48Å; L67-N76 PolarHBondContact N-O 3.49Å; L67-C78 HydrophobicContact CD1-CB 4.06Å; L67-C78 HydrophobicContact CD2-CB 4.39Å; L67-C78 HydrophobicContact CG-CB 4.28Å
68	S	74.7	Confident	74	Confident	46 Å²	46	51.9 Å²	51.9	32%	0.322	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	155.5	-177.8	67	0	0	0	0	112.1	N76	S68-N76 PolarHBondContact N-O 3.23Å; S68-N76 PolarHBondContact O-N 3.14Å; S68-N76 WeakPolarHBondContact OG-CB 3.32Å; S68-N76 PolarHBondContact OG-ND2 3.28Å
69	E	72.8	Confident	74.5	Confident	136 Å²	136	51.9 Å²	51.9	64%	0.636	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.5	137.5	169.3	-71	177.6	178.6	0	0	109.2	L66 F74 T75	L66-E69 HydrophobicContact CD1-CG 4.21Å; L66-E69 HydrophobicContact CD2-CG 4.35Å; E69-F74 CarbonylContact C-O 3.56Å; E69-F74 WeakPolarHBondContact CA-O 3.44Å; E69-T75 HydrophobicContact CG-CG2 4.14Å
70	S	70.9	Confident	75.1	Confident	19 Å²	19	48.4 Å²	48.4	13%	0.133	25%	0.251	C	S	.	.			trans	-100.1	154.2	176.2	68.3	0	0	0	0	110.9	E72 G73 F74	S70-E72 PolarHBondContact O-N 3.15Å; S70-E72 VanDerWaalsContact O-N 3.16Å; S70-G73 PolarHBondContact O-N 3.3Å; S70-G73 VanDerWaalsContact O-N 3.15Å; S70-F74 PolarHBondContact N-O 3.26Å; S70-F74 WeakPolarHBondContact OG-CA 3.46Å; S70-F74 VanDerWaalsContact OG-CB 3.27Å; S70-F74 WeakPolarHBondContact OG-CB 3.43Å; S70-F74 PolarHBondContact OG-N 3.25Å; S70-F74 PolarHBondContact OG-O 3.36Å; S70-F74 VanDerWaalsContact OG-O 3.13Å
71	K	66.7	Low	75.2	Confident	131 Å²	131	43.4 Å²	43.4	57%	0.57	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-15.5	171.9	-55.4	176.6	-178	167.9	0	113.5	G73 P111 F112	K71-G73 PolarHBondContact O-N 3.29Å; K71-P111 HydrophobicContact CB-CG 3.61Å; K71-P111 HydrophobicContact CD-CB 3.68Å; K71-P111 HydrophobicContact CD-CG 3.6Å; K71-P111 WeakPolarHBondContact CE-O 3.27Å; K71-P111 HydrophobicContact CG-CB 3.95Å; K71-P111 HydrophobicContact CG-CG 3.45Å; K71-P111 VanDerWaalsContact CG-CG 3.45Å; K71-P111 WeakPolarHBondContact CG-O 3.39Å; K71-P111 VanDerWaalsContact N-CD 3.27Å; K71-F112 WeakPolarHBondContact CE-O 3.24Å; K71-F112 PolarHBondContact NZ-O 2.91Å
72	E	66	Low	74.9	Confident	131 Å²	131	43.6 Å²	43.6	61%	0.612	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	2.6	178	-62.5	-171.3	169.8	0	0	112.5	S70 F74	S70-E72 PolarHBondContact O-N 3.15Å; S70-E72 VanDerWaalsContact O-N 3.16Å; E72-F74 HydrophobicContact CB-CD2 3.91Å; E72-F74 HydrophobicContact CB-CE2 4.02Å
73	G	69.7	Low	75	Confident	28 Å²	28	48.5 Å²	48.5	29%	0.289	25%	0.254	S	S	.	.	S	Bend	trans	84.8	19	176.9	0	0	0	0	0	114.1	W33 S70 K71	W33-G73 PolarHBondContact N-O 3.12Å; S70-G73 PolarHBondContact O-N 3.3Å; S70-G73 VanDerWaalsContact O-N 3.15Å; K71-G73 PolarHBondContact O-N 3.29Å
74	F	73.4	Confident	74.7	Confident	31 Å²	31	46.9 Å²	46.9	14%	0.136	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	135.5	168	-60	-87.1	0	0	0	111.5	L31 R32 H43 E69 S70 E72 L109	L31-F74 CarbonylContact O-C 3.57Å; L31-F74 VanDerWaalsContact O-CA 3.25Å; L31-F74 WeakPolarHBondContact O-CA 2.96Å; R32-F74 HydrophobicContact CB-CD1 4.07Å; R32-F74 HydrophobicContact CB-CE1 4Å; R32-F74 HydrophobicContact CG-CD1 4.33Å; R32-F74 HydrophobicContact CG-CE1 4.04Å; R32-F74 HydrophobicContact CG-CZ 4.48Å; H43-F74 AromaticContact CE1-CE1 3.85Å; H43-F74 AromaticContact ND1-CE1 3.68Å; E69-F74 CarbonylContact C-O 3.56Å; E69-F74 WeakPolarHBondContact CA-O 3.44Å; S70-F74 PolarHBondContact N-O 3.26Å; S70-F74 WeakPolarHBondContact OG-CA 3.46Å; S70-F74 VanDerWaalsContact OG-CB 3.27Å; S70-F74 WeakPolarHBondContact OG-CB 3.43Å; S70-F74 PolarHBondContact OG-N 3.25Å; S70-F74 PolarHBondContact OG-O 3.36Å; S70-F74 VanDerWaalsContact OG-O 3.13Å; E72-F74 HydrophobicContact CB-CD2 3.91Å; E72-F74 HydrophobicContact CB-CE2 4.02Å; F74-L109 HydrophobicContact CD2-CD1 4.47Å
75	T	75.8	Confident	74.2	Confident	9 Å²	9	48.7 Å²	48.7	6%	0.055	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	117.1	177.8	-58.2	0	0	0	0	108.4	L31 H40 L66 E69	L31-T75 PolarHBondContact N-O 2.78Å; L31-T75 PolarHBondContact O-N 2.89Å; H40-T75 PolarHBondContact NE2-OG1 3.02Å; L66-T75 HydrophobicContact CD1-CG2 3.17Å; E69-T75 HydrophobicContact CG-CG2 4.14Å
76	N	79.8	Confident	73.6	Confident	21 Å²	21	48.9 Å²	48.9	11%	0.112	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	128.9	175.3	-62.5	-36.1	0	0	0	109.3	L29 S30 L67 S68	L29-N76 CarbonylContact O-C 3.56Å; L29-N76 VanDerWaalsContact O-CA 3.22Å; L29-N76 WeakPolarHBondContact O-CA 3.12Å; S30-N76 WeakPolarHBondContact CB-OD1 2.81Å; S30-N76 PolarHBondContact OG-OD1 2.65Å; L67-N76 HydrophobicContact CB-CB 4.34Å; L67-N76 WeakPolarHBondContact CB-O 3.48Å; L67-N76 PolarHBondContact N-O 3.49Å; S68-N76 PolarHBondContact N-O 3.23Å; S68-N76 PolarHBondContact O-N 3.14Å; S68-N76 WeakPolarHBondContact OG-CB 3.32Å; S68-N76 PolarHBondContact OG-ND2 3.28Å
77	C	79.4	Confident	72.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	153.8	175.9	65.6	0	0	0	0	111.7	L29 C64 Y65	L29-C77 PolarHBondContact N-O 3.15Å; L29-C77 PolarHBondContact O-N 3.44Å; C64-C77 HydrophobicContact CB-CB 3.81Å; C64-C77 WeakPolarHBondContact CB-SG 3.44Å; C64-C77 WeakPolarHBondContact SG-CB 3.16Å; C64-C77 CovalentContact SG-SG 2.02Å; C64-C77 PolarHBondContact SG-SG 3.06Å; Y65-C77 CarbonylContact O-C 3.45Å; Y65-C77 WeakPolarHBondContact O-CA 3.27Å; Y65-C77 VanDerWaalsContact O-CB 3.23Å; Y65-C77 WeakPolarHBondContact O-CB 3.44Å
78	C	81.3	Confident	72.3	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	136.9	179.3	-173.8	0	0	0	0	110	W50 P58 C64 Y65 L67	W50-C78 HydrophobicContact CZ3-CB 4.02Å; P58-C78 HydrophobicContact CG-CB 4.03Å; C64-C78 WeakPolarHBondContact CA-O 3.37Å; Y65-C78 PolarHBondContact N-O 3.08Å; Y65-C78 PolarHBondContact O-N 3.11Å; L67-C78 HydrophobicContact CD1-CB 4.06Å; L67-C78 HydrophobicContact CD2-CB 4.39Å; L67-C78 HydrophobicContact CG-CB 4.28Å
79	C	82.2	Confident	71.4	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	142.6	-177.5	164.9	0	0	0	0	110.5	H26 C27 L29 L63 C64 C84	H26-C79 CarbonylContact C-O 3.51Å; H26-C79 WeakPolarHBondContact CA-O 3.45Å; C27-C79 PolarHBondContact N-O 2.93Å; C27-C79 PolarHBondContact O-N 3.26Å; L29-C79 HydrophobicContact CD1-CB 3.71Å; L63-C79 WeakPolarHBondContact O-CA 3.47Å; L63-C79 WeakPolarHBondContact O-CB 3.15Å; C64-C79 HydrophobicContact CB-CB 4.47Å; C79-C84 VanDerWaalsContact CA-SG 3.6Å; C79-C84 HydrophobicContact CB-CB 3.67Å; C79-C84 WeakPolarHBondContact CB-SG 3.47Å; C79-C84 PolarHBondContact O-SG 2.95Å; C79-C84 VanDerWaalsContact O-SG 3.32Å; C79-C84 VanDerWaalsContact SG-CA 3.52Å; C79-C84 WeakPolarHBondContact SG-CB 3.31Å; C79-C84 CovalentContact SG-SG 2.02Å; C79-C84 PolarHBondContact SG-SG 3.49Å
80	K	83.6	Confident	70.8	Confident	73 Å²	73	50 Å²	50	32%	0.317	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	128	-177.6	-175.2	-177.5	-179.1	173.6	0	111.5	P58 K59 P61 G62	P58-K80 WeakPolarHBondContact O-CD 3.33Å; K59-K80 WeakPolarHBondContact O-CD 3.42Å; K59-K80 PolarHBondContact O-NZ 3.3Å; P61-K80 WeakPolarHBondContact CA-O 3.25Å; P61-K80 WeakPolarHBondContact CB-O 3.21Å; G62-K80 PolarHBondContact N-O 3.12Å
81	G	76.9	Confident	70.5	Confident	11 Å²	11	50.7 Å²	50.7	11%	0.113	28%	0.283	C	S	.	.	S	Bend	trans	82.5	-175.3	172.4	0	0	0	0	0	116	T25 L83 C84	T25-G81 PolarHBondContact O-N 3.32Å; G81-L83 VanDerWaalsContact C-N 3.28Å; G81-L83 PolarHBondContact O-N 3.03Å; G81-C84 PolarHBondContact O-SG 3.02Å
82	P	69.8	Low	70.4	Confident	83 Å²	83	46.4 Å²	46.4	54%	0.539	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-77.7	-7.5	-173.7	30.9	-35.6	0	0	0	114.5	C84 N85	P82-C84 PolarHBondContact O-N 2.68Å; P82-N85 PolarHBondContact O-ND2 3.12Å
83	L	72.8	Confident	70.4	Confident	118 Å²	118	43.2 Å²	43.2	62%	0.618	25%	0.253	S	S	*	.	G	3₁₀ helix	trans	-69.6	-5.3	176.9	-67	176.1	0	0	0	113	P61 G81 N85	P61-L83 HydrophobicContact CB-CD1 4.31Å; G81-L83 VanDerWaalsContact C-N 3.28Å; G81-L83 PolarHBondContact O-N 3.03Å; L83-N85 PolarHBondContact O-N 3.37Å
84	C	68.2	Low	69.7	Low	0 Å²	0	46.1 Å²	46.1	0%	0	27%	0.268	C	S	.	.	G	3₁₀ helix	trans	-78.1	-1.6	-179.6	-48.1	0	0	0	0	113.9	C27 L29 Q45 C79 G81 P82 G86	C27-C84 HydrophobicContact CB-CB 3.99Å; L29-C84 HydrophobicContact CD1-CB 4.11Å; L29-C84 WeakPolarHBondContact CD2-O 3.16Å; Q45-C84 PolarHBondContact NE2-O 3.34Å; C79-C84 VanDerWaalsContact CA-SG 3.6Å; C79-C84 HydrophobicContact CB-CB 3.67Å; C79-C84 WeakPolarHBondContact CB-SG 3.47Å; C79-C84 PolarHBondContact O-SG 2.95Å; C79-C84 VanDerWaalsContact O-SG 3.32Å; C79-C84 VanDerWaalsContact SG-CA 3.52Å; C79-C84 WeakPolarHBondContact SG-CB 3.31Å; C79-C84 CovalentContact SG-SG 2.02Å; C79-C84 PolarHBondContact SG-SG 3.49Å; G81-C84 PolarHBondContact O-SG 3.02Å; P82-C84 PolarHBondContact O-N 2.68Å; C84-G86 PolarHBondContact O-N 2.73Å
85	N	64.4	Low	68.6	Low	37 Å²	37	47.9 Å²	47.9	20%	0.198	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	30.6	-178.7	-64	-62.9	0	0	0	113.2	E2 H4 Q45 P82 L83	E2-N85 PolarHBondContact O-ND2 3.47Å; E2-N85 VanDerWaalsContact O-ND2 3.13Å; H4-N85 PolarHBondContact CD2-OD1 3.26Å; H4-N85 VanDerWaalsContact CD2-OD1 3.3Å; H4-N85 PolarHBondContact N-OD1 2.71Å; Q45-N85 PolarHBondContact OE1-OD1 2.76Å; P82-N85 PolarHBondContact O-ND2 3.12Å; L83-N85 PolarHBondContact O-N 3.37Å
86	G	63.9	Low	66.7	Low	53 Å²	53	51.6 Å²	51.6	55%	0.546	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	180	51.6	-176.1	0	0	0	0	0	113.3	E42 C84	E42-G86 WeakPolarHBondContact OE1-CA 3.21Å; E42-G86 PolarHBondContact OE1-N 2.73Å; C84-G86 PolarHBondContact O-N 2.73Å
87	V	62.4	Low	64.6	Low	13 Å²	13	56.6 Å²	56.6	8%	0.079	34%	0.341	C	S	.	.			trans	-76.4	124	-177.3	-177.2	0	0	0	0	110	L29 E42 C64 T91 I92	L29-V87 HydrophobicContact CD2-CB 4.23Å; L29-V87 HydrophobicContact CD2-CG2 3.47Å; L29-V87 VanDerWaalsContact CD2-CG2 3.47Å; E42-V87 PolarHBondContact OE1-N 3.41Å; C64-V87 HydrophobicContact CB-CG1 3.81Å; C64-V87 HydrophobicContact CB-CG2 4.48Å; V87-T91 VanDerWaalsContact CG1-OG1 3.25Å; V87-T91 WeakPolarHBondContact CG1-OG1 3.36Å; V87-I92 HydrophobicContact CG1-CG1 4.12Å
88	D	63.3	Low	62.5	Low	84 Å²	84	62 Å²	62	45%	0.449	37%	0.374	S	S	.	.			trans	-101.5	169.2	173.1	65.3	2.3	0	0	0	111.6	N90 T91	D88-N90 PolarHBondContact O-N 2.78Å; D88-N90 PolarHBondContact OD1-N 2.75Å; D88-T91 PolarHBondContact N-OG1 3.13Å; D88-T91 PolarHBondContact O-N 3.35Å; D88-T91 PolarHBondContact O-OG1 3.03Å; D88-T91 WeakPolarHBondContact OD1-CB 3.4Å; D88-T91 VanDerWaalsContact OD1-CG2 3.27Å; D88-T91 WeakPolarHBondContact OD1-CG2 3.35Å; D88-T91 PolarHBondContact OD1-N 2.67Å; D88-T91 PolarHBondContact OD1-OG1 3.16Å
89	N	56.3	Low	60.2	Low	63 Å²	63	69.4 Å²	69.4	34%	0.337	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-19.2	-179.3	-77.8	-8.2	0	0	0	113.6	N38 H40	N38-N89 PolarHBondContact O-ND2 3.07Å; H40-N89 PolarHBondContact N-OD1 3.02Å; H40-N89 PolarHBondContact ND1-OD1 3.04Å
90	N	58.9	Low	57.7	Low	146 Å²	146	74.2 Å²	74.2	78%	0.781	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-9.9	-178.7	-69.3	-10.8	0	0	0	113.3	D88	D88-N90 PolarHBondContact O-N 2.78Å; D88-N90 PolarHBondContact OD1-N 2.75Å
91	T	65	Low	55.3	Low	32 Å²	32	78.4 Å²	78.4	20%	0.196	46%	0.464	C	S	.	.	S	Bend	trans	-101.9	-1.8	-179.2	40	0	0	0	0	113	G62 C64 V87 D88	G62-T91 WeakPolarHBondContact O-CG2 3.35Å; C64-T91 PolarHBondContact N-O 2.77Å; V87-T91 VanDerWaalsContact CG1-OG1 3.25Å; V87-T91 WeakPolarHBondContact CG1-OG1 3.36Å; D88-T91 PolarHBondContact N-OG1 3.13Å; D88-T91 PolarHBondContact O-N 3.35Å; D88-T91 PolarHBondContact O-OG1 3.03Å; D88-T91 WeakPolarHBondContact OD1-CB 3.4Å; D88-T91 VanDerWaalsContact OD1-CG2 3.27Å; D88-T91 WeakPolarHBondContact OD1-CG2 3.35Å; D88-T91 PolarHBondContact OD1-N 2.67Å; D88-T91 PolarHBondContact OD1-OG1 3.16Å
92	I	65.3	Low	53.1	Low	41 Å²	41	88.8 Å²	88.8	21%	0.21	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	121.1	174.5	-55.9	173.4	0	0	0	109.5	L31 C64 L66 V87	L31-I92 HydrophobicContact CD1-CD1 3.7Å; L31-I92 HydrophobicContact CD1-CG1 4.27Å; C64-I92 HydrophobicContact CB-CG1 4.5Å; C64-I92 WeakPolarHBondContact O-CA 3.36Å; L66-I92 HydrophobicContact CD1-CG2 4.15Å; V87-I92 HydrophobicContact CG1-CG1 4.12Å
93	I	65.3	Low	51.1	Low	65 Å²	65	87.8 Å²	87.8	33%	0.333	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	132	-178.2	-44.6	-175.6	0	0	0	110.5	L63 C64 L66	L63-I93 HydrophobicContact CB-CD1 4.03Å; L63-I93 HydrophobicContact CD1-CD1 3.54Å; L63-I93 HydrophobicContact CD2-CD1 3.47Å; L63-I93 VanDerWaalsContact CD2-CD1 3.47Å; L63-I93 HydrophobicContact CD2-CG1 4.12Å; L63-I93 HydrophobicContact CG-CD1 3.84Å; C64-I93 PolarHBondContact O-N 2.79Å; L66-I93 PolarHBondContact N-O 2.81Å
94	S	55.3	Low	49	Very low	88 Å²	88	86.5 Å²	86.5	62%	0.615	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-72.3	140.8	168.6	-53.6	0	0	0	0	110.6
95	P	50.6	Low	47.2	Very low	69 Å²	69	89.9 Å²	89.9	45%	0.448	51%	0.508	S	S	.	.	P	Polyproline II helix	trans	-59	146.3	179.4	22.4	-31.4	0	0	0	111.9
96	P	36.7	Very low	45.5	Very low	86 Å²	86	91.3 Å²	91.3	56%	0.558	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-63.2	149.9	-177.4	21.5	-27.2	0	0	0	112.1	T98	P96-T98 PolarHBondContact O-N 2.96Å
97	P	34.7	Very low	43.8	Very low	127 Å²	127	92.5 Å²	92.5	83%	0.825	51%	0.511	S	S	*	.	S	Bend	trans	-80.7	57.3	-170.6	34.5	-35.7	0	0	0	112.4
98	T	34.9	Very low	42.1	Very low	113 Å²	113	94.2 Å²	94.2	69%	0.693	53%	0.532	S	S	*	.	S	Bend	trans	-155.5	113.9	168.2	45.9	0	0	0	0	107.8	P96	P96-T98 PolarHBondContact O-N 2.96Å
99	Q	32.9	Very low	40.4	Very low	155 Å²	155	95.7 Å²	95.7	72%	0.724	54%	0.539	S	S	*	.			trans	103.6	18.8	177.3	-57.3	-165.8	-16.5	0	0	119.6	N101	Q99-N101 PolarHBondContact O-N 3.02Å
100	V	30.5	Very low	39.1	Very low	101 Å²	101	98.4 Å²	98.4	61%	0.612	55%	0.553	S	S	*	*			trans	-81.4	93	178.8	-171.3	0	0	0	0	112	R102	V100-R102 HydrophobicContact CG1-CG 4.25Å
101	N	32.7	Very low	37.8	Very low	161 Å²	161	93.5 Å²	93.5	86%	0.861	53%	0.529	S	S	*	.			trans	-110.1	104.8	155.8	-128.8	2.6	0	0	0	107.9	Q99 S103	Q99-N101 PolarHBondContact O-N 3.02Å; N101-S103 PolarHBondContact O-N 2.8Å
102	R	31	Very low	36	Very low	230 Å²	230	98.4 Å²	98.4	87%	0.868	55%	0.548	S	S	*	.			trans	-60	120	-173.1	-69	172.4	170.3	176.6	-5.5	112.5	V100	V100-R102 HydrophobicContact CG1-CG 4.25Å
103	S	28.4	Very low	34.1	Very low	61 Å²	61	103.9 Å²	103.9	43%	0.427	57%	0.571	S	S	.	*			trans	179.9	81.6	139.4	61.3	0	0	0	0	111.6	N101 R519	N101-S103 PolarHBondContact O-N 2.8Å; S103-R519 PolarHBondContact OG-NH2 3.2Å
104	L	27.8	Very low	32.3	Very low	91 Å²	91	109.1 Å²	109.1	48%	0.476	60%	0.598	S	S	.	*			trans	-110.3	90.6	156.7	-104	152	0	0	0	105.9	W50 M106	W50-L104 HydrophobicContact CH2-CD1 4.48Å; W50-L104 HydrophobicContact CZ2-CD1 4.12Å; L104-M106 PolarHBondContact O-N 3.45Å
105	V	30.3	Very low	30.8	Very low	72 Å²	72	112 Å²	112	44%	0.436	60%	0.602	S	S	.	*			trans	-84.4	99.7	-176.7	177.1	0	0	0	0	107.9	T107	V105-T107 PolarHBondContact O-N 2.89Å
106	M	29	Very low	29.6	Very low	67 Å²	67	115.4 Å²	115.4	33%	0.33	62%	0.616	S	S	.	*			trans	-65.6	117	152.7	-89.9	-148	76.2	0	0	108	L28 W48 L104 G108	L28-M106 HydrophobicContact CD1-SD 3.78Å; L28-M106 HydrophobicContact CD2-CE 3.52Å; L28-M106 HydrophobicContact CD2-SD 3.28Å; L28-M106 WeakPolarHBondContact CD2-SD 3.47Å; L28-M106 HydrophobicContact CG-SD 4.06Å; W48-M106 HydrophobicContact CH2-CG 4.35Å; L104-M106 PolarHBondContact O-N 3.45Å; M106-G108 PolarHBondContact O-N 2.86Å; M106-G108 VanDerWaalsContact O-N 3.1Å
107	T	27.5	Very low	29.1	Very low	78 Å²	78	117.2 Å²	117.2	48%	0.479	63%	0.63	S	S	.	*	S	Bend	trans	-57.9	111.2	168.7	49.3	0	0	0	0	109.6	V105	V105-T107 PolarHBondContact O-N 2.89Å
108	G	27	Very low	28.7	Very low	49 Å²	49	123 Å²	123	51%	0.505	64%	0.636	S	S	.	*	S	Bend	trans	125.5	114.2	168.3	0	0	0	0	0	114.1	M106	M106-G108 PolarHBondContact O-N 2.86Å; M106-G108 VanDerWaalsContact O-N 3.1Å
109	L	28.9	Very low	28.3	Very low	114 Å²	114	123.1 Å²	123.1	60%	0.597	64%	0.638	S	S	*	*			trans	89	81.2	175.9	-50.4	171.6	0	0	0	115.1	F74	F74-L109 HydrophobicContact CD2-CD1 4.47Å
110	D	28.9	Very low	28	Very low	121 Å²	121	123.8 Å²	123.8	65%	0.647	65%	0.646	S	S	*	*			trans	-73	146.6	157.6	-149.9	-8.1	0	0	0	108.1	F112	D110-F112 PolarHBondContact OD1-N 2.81Å
111	P	30.9	Very low	28	Very low	42 Å²	42	122.2 Å²	122.2	27%	0.273	65%	0.651	S	S	.	*				-153.3	132.8	91.3	22.9	3.5	0	0	0	118.2	K71	K71-P111 HydrophobicContact CB-CG 3.61Å; K71-P111 HydrophobicContact CD-CB 3.68Å; K71-P111 HydrophobicContact CD-CG 3.6Å; K71-P111 WeakPolarHBondContact CE-O 3.27Å; K71-P111 HydrophobicContact CG-CB 3.95Å; K71-P111 HydrophobicContact CG-CG 3.45Å; K71-P111 VanDerWaalsContact CG-CG 3.45Å; K71-P111 WeakPolarHBondContact CG-O 3.39Å; K71-P111 VanDerWaalsContact N-CD 3.27Å
112	F	27.1	Very low	27.8	Very low	135 Å²	135	121.2 Å²	121.2	59%	0.592	65%	0.645	S	S	*	*			trans	24.2	123.9	136.2	-90.8	-106.4	0	0	0	123.2	K71 D110	K71-F112 WeakPolarHBondContact CE-O 3.24Å; K71-F112 PolarHBondContact NZ-O 2.91Å; D110-F112 PolarHBondContact OD1-N 2.81Å
113	F	25.5	Very low	27.7	Very low	157 Å²	157	117 Å²	117	69%	0.689	65%	0.646	S	S	*	*			trans	67.2	124.6	148.7	-83	-108.1	0	0	0	120.5
114	I	27.5	Very low	28	Very low	174 Å²	174	119.2 Å²	119.2	89%	0.892	66%	0.658	S	S	*	*				-158.6	141	117.8	-90.6	148	0	0	0	109.5
115	Q	24.9	Very low	28.1	Very low	150 Å²	150	122.6 Å²	122.6	70%	0.701	68%	0.676	S	S	*	*			trans	-71.9	157.6	-179	-74.3	170.1	-43.5	0	0	114.3
116	N	25	Very low	28.3	Very low	140 Å²	140	123.9 Å²	123.9	75%	0.749	69%	0.686	S	S	*	*			trans	53.7	115.4	143.7	-65.9	-14.1	0	0	0	119.2
117	S	26.7	Very low	28.3	Very low	123 Å²	123	125.6 Å²	125.6	86%	0.86	71%	0.705	S	S	*	*				172.7	128.4	108.7	35.6	0	0	0	0	111.5
118	R	25.1	Very low	28.7	Very low	248 Å²	248	131.4 Å²	131.4	94%	0.936	73%	0.726	S	S	*	*			trans	-110.8	130.6	163.3	-94.3	-173.5	179	-179.5	0.1	108.4
119	P	27.9	Very low	28.7	Very low	116 Å²	116	133.8 Å²	133.8	75%	0.753	74%	0.735	S	S	*	*			trans	-95.8	128.3	159.3	17.1	0.2	0	0	0	111.6
120	L	25.8	Very low	28.9	Very low	169 Å²	169	138.5 Å²	138.5	89%	0.885	75%	0.751	S	S	*	*			trans	17.6	137.3	137.3	-74.3	133.1	0	0	0	121.3
121	G	29.5	Very low	28.9	Very low	69 Å²	69	139.6 Å²	139.6	71%	0.711	76%	0.757	S	S	*	*			trans	167.1	73.5	160.2	0	0	0	0	0	111.4
122	N	29.5	Very low	28.9	Very low	139 Å²	139	146.1 Å²	146.1	74%	0.743	79%	0.786	S	S	*	*				62.3	108.7	104.7	-70.6	-8.7	0	0	0	115.4
123	T	29.6	Very low	29	Very low	143 Å²	143	148 Å²	148	88%	0.877	80%	0.797	S	S	*	*				179.6	154.2	102.3	28.7	0	0	0	0	112.2
124	P	33.5	Very low	29.7	Very low	107 Å²	107	149.3 Å²	149.3	70%	0.695	81%	0.805	S	S	*	*			trans	-120.1	176.2	-148.9	40.2	-26.1	0	0	0	114.7
125	L	31.2	Very low	30.2	Very low	161 Å²	161	146 Å²	146	84%	0.843	79%	0.793	S	S	*	*			trans	158.1	154.9	142.8	-85.4	156.1	0	0	0	111.4
126	P	33.6	Very low	31.3	Very low	100 Å²	100	145.1 Å²	145.1	65%	0.649	79%	0.793	S	S	*	*				-134.4	168.4	-73.7	36.3	-16.5	0	0	0	115.4
127	S	29.9	Very low	32.7	Very low	103 Å²	103	143.5 Å²	143.5	72%	0.72	79%	0.792	S	S	*	*			trans	60.7	112.9	145	63.1	0	0	0	0	120.8
128	Q	34.5	Very low	34.1	Very low	199 Å²	199	144.7 Å²	144.7	93%	0.93	78%	0.782	S	S	*	*				-160	131.7	106.9	-104	173.7	12.4	0	0	111.1
129	S	27.5	Very low	35.9	Very low	100 Å²	100	137.8 Å²	137.8	70%	0.699	76%	0.763	S	S	*	*			trans	-82.6	139.6	-174.7	47.7	0	0	0	0	112.5
130	F	32.1	Very low	37.6	Very low	213 Å²	213	136.2 Å²	136.2	93%	0.934	75%	0.752	S	S	*	*			trans	-143	117.4	143	-111	-85	0	0	0	109
131	D	28.8	Very low	39.6	Very low	143 Å²	143	133.3 Å²	133.3	77%	0.765	74%	0.737	S	S	*	*			trans	-64.5	138.3	171.4	-81.1	-53.1	0	0	0	111
132	M	31.1	Very low	41.8	Very low	179 Å²	179	134.8 Å²	134.8	88%	0.882	73%	0.727	S	S	*	*				-163.5	117	126.4	-119.6	166.5	54.9	0	0	112.3
133	Q	30.7	Very low	44	Very low	174 Å²	174	132.9 Å²	132.9	81%	0.813	72%	0.716	S	S	*	*			trans	-50.1	122	175.5	-66.2	151.6	-36.9	0	0	113.1
134	H	38.4	Very low	46.5	Very low	185 Å²	185	128.7 Å²	128.7	86%	0.856	69%	0.69	S	S	*	*			trans	178.9	15.4	139.4	-111.2	-68.1	0	0	0	116.6
135	T	39.3	Very low	48.6	Very low	105 Å²	105	125.5 Å²	125.5	64%	0.644	67%	0.673	S	S	*	*			trans	-101.9	1	-162.8	45.4	0	0	0	0	117.9	S137	T135-S137 PolarHBondContact O-N 2.84Å
136	D	47.9	Very low	51.1	Low	132 Å²	132	121.8 Å²	121.8	71%	0.706	66%	0.658	S	S	*	*	H	α-helix	trans	-81.1	-21.4	-168.7	-67.7	-23.1	0	0	0	114.8	T140	D136-T140 PolarHBondContact O-OG1 2.88Å
137	S	53.7	Low	53.5	Low	105 Å²	105	121.7 Å²	121.7	73%	0.734	65%	0.651	S	S	*	*	H	α-helix	trans	-83.8	-32.1	179.5	-153.6	0	0	0	0	112.8	T135 L141	T135-S137 PolarHBondContact O-N 2.84Å; S137-L141 PolarHBondContact O-N 2.78Å
138	F	56.4	Low	56.2	Low	148 Å²	148	121.9 Å²	121.9	65%	0.649	64%	0.643	S	S	*	*	H	α-helix	trans	-80.6	-37.9	-175.1	-139.6	-95.8	0	0	0	112.5	L141 I142	F138-L141 PolarHBondContact O-N 2.97Å; F138-I142 HydrophobicContact CD1-CD1 3.75Å; F138-I142 HydrophobicContact CD1-CG1 4.31Å; F138-I142 HydrophobicContact CE1-CD1 4.13Å; F138-I142 VanDerWaalsContact O-CG1 3.32Å; F138-I142 WeakPolarHBondContact O-CG1 3.5Å; F138-I142 PolarHBondContact O-N 2.65Å
139	L	62.5	Low	58.8	Low	103 Å²	103	117.2 Å²	117.2	54%	0.539	62%	0.624	S	S	.	*	H	α-helix	trans	-68.9	-37.4	177.5	-167.5	66.6	0	0	0	111.5	L141 I142 I143	L139-L141 VanDerWaalsContact C-N 3.31Å; L139-L141 PolarHBondContact O-N 2.81Å; L139-I142 PolarHBondContact O-N 3.05Å; L139-I143 HydrophobicContact CD1-CD1 4.32Å; L139-I143 HydrophobicContact CG-CD1 3.96Å; L139-I143 WeakPolarHBondContact O-CG1 3.44Å; L139-I143 PolarHBondContact O-N 2.85Å
140	T	65	Low	61.6	Low	83 Å²	83	113.9 Å²	113.9	51%	0.509	61%	0.605	S	S	.	*	H	α-helix	trans	-62.8	-39.6	173.5	-50.1	0	0	0	0	110.8	D136 T144	D136-T140 PolarHBondContact O-OG1 2.88Å; T140-T144 HydrophobicContact CG2-CG2 4.03Å; T140-T144 VanDerWaalsContact O-CB 3.26Å; T140-T144 WeakPolarHBondContact O-CB 3.48Å; T140-T144 WeakPolarHBondContact O-CG2 3.37Å; T140-T144 PolarHBondContact O-N 2.8Å; T140-T144 PolarHBondContact O-OG1 2.84Å
141	L	66.5	Low	64.3	Low	109 Å²	109	108.8 Å²	108.8	57%	0.571	59%	0.587	S	S	*	*	H	α-helix	trans	-66.4	-41	176.1	-156.2	83.2	0	0	0	112.5	S137 F138 L139 I143 A145	S137-L141 PolarHBondContact O-N 2.78Å; F138-L141 PolarHBondContact O-N 2.97Å; L139-L141 VanDerWaalsContact C-N 3.31Å; L139-L141 PolarHBondContact O-N 2.81Å; L141-I143 PolarHBondContact O-N 2.92Å; L141-A145 WeakPolarHBondContact O-CB 3.3Å; L141-A145 PolarHBondContact O-N 2.88Å
142	I	75.3	Confident	67.1	Low	100 Å²	100	108.5 Å²	108.5	51%	0.513	58%	0.579	S	S	.	*	H	α-helix	trans	-67.6	-35.1	179.8	-69.2	170.3	0	0	0	111.8	F138 L139 P146	F138-I142 HydrophobicContact CD1-CD1 3.75Å; F138-I142 HydrophobicContact CD1-CG1 4.31Å; F138-I142 HydrophobicContact CE1-CD1 4.13Å; F138-I142 VanDerWaalsContact O-CG1 3.32Å; F138-I142 WeakPolarHBondContact O-CG1 3.5Å; F138-I142 PolarHBondContact O-N 2.65Å; L139-I142 PolarHBondContact O-N 3.05Å; I142-P146 WeakPolarHBondContact O-CD 3.13Å; I142-P146 WeakPolarHBondContact O-CG 3.4Å
143	I	77.3	Confident	69.8	Low	99 Å²	99	104.7 Å²	104.7	51%	0.508	56%	0.561	S	S	.	*	H	α-helix	trans	-84.5	-37.6	-179.5	-62.5	171	0	0	0	111.6	L139 L141 I147	L139-I143 HydrophobicContact CD1-CD1 4.32Å; L139-I143 HydrophobicContact CG-CD1 3.96Å; L139-I143 WeakPolarHBondContact O-CG1 3.44Å; L139-I143 PolarHBondContact O-N 2.85Å; L141-I143 PolarHBondContact O-N 2.92Å; I143-I147 HydrophobicContact CG2-CD1 4.33Å; I143-I147 WeakPolarHBondContact O-CD1 3.11Å; I143-I147 WeakPolarHBondContact O-CG1 3.39Å
144	T	80.4	Confident	72.3	Confident	55 Å²	55	101.7 Å²	101.7	34%	0.337	55%	0.55	S	S	.	*	H	α-helix	trans	-82	-32.5	-175.8	58.8	0	0	0	0	113.3	T140 I147 I148	T140-T144 HydrophobicContact CG2-CG2 4.03Å; T140-T144 VanDerWaalsContact O-CB 3.26Å; T140-T144 WeakPolarHBondContact O-CB 3.48Å; T140-T144 WeakPolarHBondContact O-CG2 3.37Å; T140-T144 PolarHBondContact O-N 2.8Å; T140-T144 PolarHBondContact O-OG1 2.84Å; T144-I147 PolarHBondContact O-N 3.04Å; T144-I148 WeakPolarHBondContact O-CB 3.12Å; T144-I148 VanDerWaalsContact O-CG1 3.26Å; T144-I148 WeakPolarHBondContact O-CG1 3.26Å; T144-I148 PolarHBondContact O-N 3.13Å
145	A	78.4	Confident	74.5	Confident	40 Å²	40	98 Å²	98	33%	0.331	54%	0.536	S	S	.	.	H	α-helix	trans	-60.8	-46	-178	0	0	0	0	0	113.9	L141 I147 I148 I149	L141-A145 WeakPolarHBondContact O-CB 3.3Å; L141-A145 PolarHBondContact O-N 2.88Å; A145-I147 VanDerWaalsContact C-N 3.31Å; A145-I147 PolarHBondContact O-N 3.15Å; A145-I148 PolarHBondContact O-N 3.27Å; A145-I149 WeakPolarHBondContact O-CB 3.41Å; A145-I149 WeakPolarHBondContact O-CD1 3.23Å; A145-I149 WeakPolarHBondContact O-CG1 3.43Å; A145-I149 PolarHBondContact O-N 2.95Å
146	P	83.6	Confident	76.5	Confident	82 Å²	82	96.3 Å²	96.3	53%	0.532	52%	0.522	S	S	.	.	H	α-helix	trans	-66.1	-33.7	177.8	-18	31.1	0	0	0	112.6	I142 G150	I142-P146 WeakPolarHBondContact O-CD 3.13Å; I142-P146 WeakPolarHBondContact O-CG 3.4Å; P146-G150 PolarHBondContact O-N 2.87Å
147	I	85	Confident	77.8	Confident	99 Å²	99	97.8 Å²	97.8	51%	0.508	52%	0.523	S	S	.	.	H	α-helix	trans	-70.1	-44.3	178.3	-62.5	174	0	0	0	110.1	I143 T144 A145 G150 L151	I143-I147 HydrophobicContact CG2-CD1 4.33Å; I143-I147 WeakPolarHBondContact O-CD1 3.11Å; I143-I147 WeakPolarHBondContact O-CG1 3.39Å; T144-I147 PolarHBondContact O-N 3.04Å; A145-I147 VanDerWaalsContact C-N 3.31Å; A145-I147 PolarHBondContact O-N 3.15Å; I147-G150 PolarHBondContact O-N 2.91Å; I147-L151 HydrophobicContact CG2-CD1 4.05Å; I147-L151 HydrophobicContact CG2-CG 4.47Å; I147-L151 WeakPolarHBondContact O-CB 3.15Å; I147-L151 VanDerWaalsContact O-CG 3.3Å; I147-L151 WeakPolarHBondContact O-CG 2.99Å; I147-L151 PolarHBondContact O-N 3.3Å
148	I	86.3	Confident	78.9	Confident	106 Å²	106	95.1 Å²	95.1	54%	0.544	50%	0.504	S	S	.	.	H	α-helix	trans	-65.3	-42.9	177.1	-66.9	167.4	0	0	0	110.3	T144 A145 L151 F152	T144-I148 WeakPolarHBondContact O-CB 3.12Å; T144-I148 VanDerWaalsContact O-CG1 3.26Å; T144-I148 WeakPolarHBondContact O-CG1 3.26Å; T144-I148 PolarHBondContact O-N 3.13Å; A145-I148 PolarHBondContact O-N 3.27Å; I148-L151 PolarHBondContact O-N 2.88Å; I148-F152 VanDerWaalsContact O-CB 3.26Å; I148-F152 WeakPolarHBondContact O-CB 3.45Å; I148-F152 PolarHBondContact O-N 3.38Å
149	I	88.1	Confident	79.9	Confident	102 Å²	102	91 Å²	91	52%	0.523	49%	0.491	S	S	.	.	H	α-helix	trans	-62.8	-43.9	175.4	-67.5	164.5	0	0	0	110.5	A145 F152 L153	A145-I149 WeakPolarHBondContact O-CB 3.41Å; A145-I149 WeakPolarHBondContact O-CD1 3.23Å; A145-I149 WeakPolarHBondContact O-CG1 3.43Å; A145-I149 PolarHBondContact O-N 2.95Å; I149-F152 PolarHBondContact O-N 3.12Å; I149-L153 HydrophobicContact CG2-CD1 4.05Å; I149-L153 HydrophobicContact CG2-CG 4.41Å; I149-L153 WeakPolarHBondContact O-CB 3.24Å; I149-L153 VanDerWaalsContact O-CG 3.3Å; I149-L153 WeakPolarHBondContact O-CG 3.46Å; I149-L153 PolarHBondContact O-N 3Å
150	G	87.4	Confident	80.2	Confident	29 Å²	29	92.5 Å²	92.5	30%	0.299	49%	0.493	S	S	.	.	H	α-helix	trans	-62.2	-44.9	176.7	0	0	0	0	0	112.8	P146 I147 L153 I154	P146-G150 PolarHBondContact O-N 2.87Å; I147-G150 PolarHBondContact O-N 2.91Å; G150-L153 PolarHBondContact O-N 3.44Å; G150-I154 VanDerWaalsContact O-CG1 3.26Å; G150-I154 WeakPolarHBondContact O-CG1 3.33Å; G150-I154 PolarHBondContact O-N 2.95Å
151	L	88.4	Confident	80.1	Confident	107 Å²	107	91.9 Å²	91.9	56%	0.56	50%	0.497	S	S	*	.	H	α-helix	trans	-64.6	-40	175.2	-72.2	173	0	0	0	111.5	I147 I148 I154 L155	I147-L151 HydrophobicContact CG2-CD1 4.05Å; I147-L151 HydrophobicContact CG2-CG 4.47Å; I147-L151 WeakPolarHBondContact O-CB 3.15Å; I147-L151 VanDerWaalsContact O-CG 3.3Å; I147-L151 WeakPolarHBondContact O-CG 2.99Å; I147-L151 PolarHBondContact O-N 3.3Å; I148-L151 PolarHBondContact O-N 2.88Å; L151-I154 PolarHBondContact O-N 2.95Å; L151-L155 WeakPolarHBondContact O-CB 3.43Å; L151-L155 PolarHBondContact O-N 3.33Å
152	F	88.3	Confident	79.9	Confident	137 Å²	137	93.5 Å²	93.5	60%	0.601	51%	0.505	S	S	*	.	H	α-helix	trans	-66.4	-38.8	177.1	-158.5	-103.3	0	0	0	111.8	I148 I149 L155 I156	I148-F152 VanDerWaalsContact O-CB 3.26Å; I148-F152 WeakPolarHBondContact O-CB 3.45Å; I148-F152 PolarHBondContact O-N 3.38Å; I149-F152 PolarHBondContact O-N 3.12Å; F152-L155 PolarHBondContact O-N 3.12Å; F152-I156 HydrophobicContact CD1-CD1 3.51Å; F152-I156 HydrophobicContact CD1-CG1 4.25Å; F152-I156 HydrophobicContact CE1-CD1 3.56Å; F152-I156 HydrophobicContact CE1-CG1 4.27Å; F152-I156 WeakPolarHBondContact O-CB 3.49Å; F152-I156 VanDerWaalsContact O-CG1 3.26Å; F152-I156 WeakPolarHBondContact O-CG1 3.38Å; F152-I156 PolarHBondContact O-N 3.36Å
153	L	85.9	Confident	79	Confident	98 Å²	98	96.7 Å²	96.7	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-67.2	-39.4	173.7	-71.6	173.2	0	0	0	112.2	I149 G150 L155 I156 F157	I149-L153 HydrophobicContact CG2-CD1 4.05Å; I149-L153 HydrophobicContact CG2-CG 4.41Å; I149-L153 WeakPolarHBondContact O-CB 3.24Å; I149-L153 VanDerWaalsContact O-CG 3.3Å; I149-L153 WeakPolarHBondContact O-CG 3.46Å; I149-L153 PolarHBondContact O-N 3Å; G150-L153 PolarHBondContact O-N 3.44Å; L153-L155 VanDerWaalsContact C-N 3.34Å; L153-I156 PolarHBondContact O-N 3.47Å; L153-F157 WeakPolarHBondContact O-CB 3.26Å; L153-F157 PolarHBondContact O-N 3.45Å
154	I	84.7	Confident	77.5	Confident	112 Å²	112	97.7 Å²	97.7	57%	0.574	52%	0.521	S	S	*	.	H	α-helix	trans	-65	-39.8	173.7	-68.8	165.1	0	0	0	110.5	G150 L151 F157 S158	G150-I154 VanDerWaalsContact O-CG1 3.26Å; G150-I154 WeakPolarHBondContact O-CG1 3.33Å; G150-I154 PolarHBondContact O-N 2.95Å; L151-I154 PolarHBondContact O-N 2.95Å; I154-F157 PolarHBondContact O-N 2.89Å; I154-S158 WeakPolarHBondContact O-CB 3.36Å; I154-S158 PolarHBondContact O-N 2.98Å; I154-S158 PolarHBondContact O-OG 2.66Å
155	L	84.1	Confident	75.5	Confident	108 Å²	108	99.2 Å²	99.2	57%	0.565	53%	0.532	S	S	*	.	H	α-helix	trans	-67.6	-41.5	176.9	-132.3	153	0	0	0	111.2	L151 F152 L153 S158 V159	L151-L155 WeakPolarHBondContact O-CB 3.43Å; L151-L155 PolarHBondContact O-N 3.33Å; F152-L155 PolarHBondContact O-N 3.12Å; L153-L155 VanDerWaalsContact C-N 3.34Å; L155-S158 WeakPolarHBondContact CA-OG 3.48Å; L155-S158 PolarHBondContact O-N 2.69Å; L155-S158 PolarHBondContact O-OG 3.24Å; L155-V159 HydrophobicContact CD2-CG2 3.94Å; L155-V159 VanDerWaalsContact O-CB 3.25Å; L155-V159 WeakPolarHBondContact O-CB 3.37Å; L155-V159 WeakPolarHBondContact O-CG2 3.42Å; L155-V159 PolarHBondContact O-N 3.39Å
156	I	81.9	Confident	73.5	Confident	68 Å²	68	109.4 Å²	109.4	35%	0.349	56%	0.562	S	S	.	*	H	α-helix	trans	-62.3	-44.9	171.8	-71.5	167.8	0	0	0	110.5	F152 L153 V159 F160	F152-I156 HydrophobicContact CD1-CD1 3.51Å; F152-I156 HydrophobicContact CD1-CG1 4.25Å; F152-I156 HydrophobicContact CE1-CD1 3.56Å; F152-I156 HydrophobicContact CE1-CG1 4.27Å; F152-I156 WeakPolarHBondContact O-CB 3.49Å; F152-I156 VanDerWaalsContact O-CG1 3.26Å; F152-I156 WeakPolarHBondContact O-CG1 3.38Å; F152-I156 PolarHBondContact O-N 3.36Å; L153-I156 PolarHBondContact O-N 3.47Å; I156-V159 PolarHBondContact O-N 2.97Å; I156-F160 HydrophobicContact CG2-CD2 3.94Å; I156-F160 HydrophobicContact CG2-CE2 4.39Å; I156-F160 VanDerWaalsContact O-CB 3.31Å; I156-F160 WeakPolarHBondContact O-CB 3.42Å; I156-F160 PolarHBondContact O-N 3.48Å
157	F	75.6	Confident	71	Confident	163 Å²	163	114.3 Å²	114.3	72%	0.715	57%	0.571	S	S	*	*	H	α-helix	trans	-66.8	-37.3	179.1	-114.1	-87.7	0	0	0	112.6	L153 I154 A161	L153-F157 WeakPolarHBondContact O-CB 3.26Å; L153-F157 PolarHBondContact O-N 3.45Å; I154-F157 PolarHBondContact O-N 2.89Å; F157-A161 WeakPolarHBondContact O-CB 3.3Å; F157-A161 PolarHBondContact O-N 3.26Å
158	S	76.8	Confident	68.5	Low	50 Å²	50	120.5 Å²	120.5	35%	0.35	59%	0.588	S	S	.	*	H	α-helix	trans	-75.7	-34.8	177.3	46.2	0	0	0	0	112.1	I154 L155 A161 L162	I154-S158 WeakPolarHBondContact O-CB 3.36Å; I154-S158 PolarHBondContact O-N 2.98Å; I154-S158 PolarHBondContact O-OG 2.66Å; L155-S158 WeakPolarHBondContact CA-OG 3.48Å; L155-S158 PolarHBondContact O-N 2.69Å; L155-S158 PolarHBondContact O-OG 3.24Å; S158-A161 PolarHBondContact O-N 3.12Å; S158-L162 VanDerWaalsContact O-CB 3.26Å; S158-L162 WeakPolarHBondContact O-CB 3.45Å; S158-L162 WeakPolarHBondContact O-CD1 3.49Å; S158-L162 WeakPolarHBondContact O-CG 3.29Å; S158-L162 PolarHBondContact O-N 2.9Å
159	V	75.7	Confident	65.8	Low	60 Å²	60	122.2 Å²	122.2	36%	0.364	60%	0.603	S	S	.	*	H	α-helix	trans	-67.3	-44.3	168.9	172.1	0	0	0	0	110.3	L155 I156 A161 L162 F163	L155-V159 HydrophobicContact CD2-CG2 3.94Å; L155-V159 VanDerWaalsContact O-CB 3.25Å; L155-V159 WeakPolarHBondContact O-CB 3.37Å; L155-V159 WeakPolarHBondContact O-CG2 3.42Å; L155-V159 PolarHBondContact O-N 3.39Å; I156-V159 PolarHBondContact O-N 2.97Å; V159-A161 VanDerWaalsContact C-N 3.32Å; V159-A161 PolarHBondContact O-N 3.31Å; V159-L162 CarbonylContact O-C 3.55Å; V159-L162 PolarHBondContact O-N 3.34Å; V159-L162 VanDerWaalsContact O-N 3.17Å; V159-F163 HydrophobicContact CG1-CD2 3.6Å; V159-F163 HydrophobicContact CG1-CE2 3.99Å; V159-F163 VanDerWaalsContact O-CB 3.26Å; V159-F163 WeakPolarHBondContact O-CB 3.4Å; V159-F163 VanDerWaalsContact O-CD2 3.28Å; V159-F163 WeakPolarHBondContact O-CD2 3.41Å; V159-F163 PolarHBondContact O-N 3.43Å
160	F	68.5	Low	62.9	Low	135 Å²	135	123.3 Å²	123.3	59%	0.592	62%	0.619	S	S	*	*	H	α-helix	trans	-63.5	-35.8	172.7	-102.1	-92.6	0	0	0	112.1	I156 L162 L164	I156-F160 HydrophobicContact CG2-CD2 3.94Å; I156-F160 HydrophobicContact CG2-CE2 4.39Å; I156-F160 VanDerWaalsContact O-CB 3.31Å; I156-F160 WeakPolarHBondContact O-CB 3.42Å; I156-F160 PolarHBondContact O-N 3.48Å; F160-L162 VanDerWaalsContact C-N 3.34Å; F160-L164 WeakPolarHBondContact O-CB 3.22Å; F160-L164 WeakPolarHBondContact O-CG 3.47Å; F160-L164 PolarHBondContact O-N 3.29Å
161	A	64.8	Low	60	Low	70 Å²	70	133.4 Å²	133.4	58%	0.579	65%	0.648	S	S	*	*	H	α-helix	trans	-71.4	-27.6	174.4	0	0	0	0	0	113	F157 S158 V159	F157-A161 WeakPolarHBondContact O-CB 3.3Å; F157-A161 PolarHBondContact O-N 3.26Å; S158-A161 PolarHBondContact O-N 3.12Å; V159-A161 VanDerWaalsContact C-N 3.32Å; V159-A161 PolarHBondContact O-N 3.31Å
162	L	61.4	Low	57.2	Low	144 Å²	144	134.9 Å²	134.9	75%	0.754	66%	0.656	S	S	*	*	H	α-helix	trans	-86.3	-24.1	175.3	-72.7	166.9	0	0	0	113.2	S158 V159 F160	S158-L162 VanDerWaalsContact O-CB 3.26Å; S158-L162 WeakPolarHBondContact O-CB 3.45Å; S158-L162 WeakPolarHBondContact O-CD1 3.49Å; S158-L162 WeakPolarHBondContact O-CG 3.29Å; S158-L162 PolarHBondContact O-N 2.9Å; V159-L162 CarbonylContact O-C 3.55Å; V159-L162 PolarHBondContact O-N 3.34Å; V159-L162 VanDerWaalsContact O-N 3.17Å; F160-L162 VanDerWaalsContact C-N 3.34Å
163	F	57.1	Low	54.3	Low	167 Å²	167	138.3 Å²	138.3	73%	0.732	67%	0.67	S	S	*	*	H	α-helix	trans	-106.9	-4.8	179.8	-78.8	-91.7	0	0	0	114.2	V159 P165	V159-F163 HydrophobicContact CG1-CD2 3.6Å; V159-F163 HydrophobicContact CG1-CE2 3.99Å; V159-F163 VanDerWaalsContact O-CB 3.26Å; V159-F163 WeakPolarHBondContact O-CB 3.4Å; V159-F163 VanDerWaalsContact O-CD2 3.28Å; V159-F163 WeakPolarHBondContact O-CD2 3.41Å; V159-F163 PolarHBondContact O-N 3.43Å; F163-P165 VanDerWaalsContact O-CD 3.24Å; F163-P165 WeakPolarHBondContact O-CD 3.41Å
164	L	45.5	Very low	51.5	Low	120 Å²	120	143.2 Å²	143.2	63%	0.628	69%	0.69	S	S	*	*	S	Bend	trans	-66	110.2	159.2	-85.4	167.3	0	0	0	106.9	F160 R166	F160-L164 WeakPolarHBondContact O-CB 3.22Å; F160-L164 WeakPolarHBondContact O-CG 3.47Å; F160-L164 PolarHBondContact O-N 3.29Å; L164-R166 PolarHBondContact O-N 2.86Å
165	P	39	Very low	48.7	Very low	86 Å²	86	142.4 Å²	142.4	56%	0.558	70%	0.695	S	S	*	*			trans	-66.3	132.2	-169.3	28.9	-33.9	0	0	0	108.8	F163 Y167	F163-P165 VanDerWaalsContact O-CD 3.24Å; F163-P165 WeakPolarHBondContact O-CD 3.41Å; P165-Y167 VanDerWaalsContact C-N 3.3Å; P165-Y167 HydrophobicContact CB-CD2 3.71Å; P165-Y167 HydrophobicContact CB-CE2 3.98Å; P165-Y167 HydrophobicContact CG-CD2 3.88Å; P165-Y167 HydrophobicContact CG-CE2 4.29Å; P165-Y167 PolarHBondContact O-N 3.03Å
166	R	34.9	Very low	46	Very low	254 Å²	254	143.8 Å²	143.8	96%	0.958	70%	0.7	S	S	*	*			trans	-32.2	85.3	160.6	-69	171.9	166.1	160.8	-4.9	112.3	L164	L164-R166 PolarHBondContact O-N 2.86Å
167	Y	31.8	Very low	43.2	Very low	186 Å²	186	152.9 Å²	152.9	73%	0.729	73%	0.73	S	S	*	*			trans	-155.7	116.6	176.4	-81.1	-88.3	0	0	0	106.3	P165	P165-Y167 VanDerWaalsContact C-N 3.3Å; P165-Y167 HydrophobicContact CB-CD2 3.71Å; P165-Y167 HydrophobicContact CB-CE2 3.98Å; P165-Y167 HydrophobicContact CG-CD2 3.88Å; P165-Y167 HydrophobicContact CG-CE2 4.29Å; P165-Y167 PolarHBondContact O-N 3.03Å
168	R	31.7	Very low	40.8	Very low	228 Å²	228	153.2 Å²	153.2	86%	0.86	73%	0.731	S	S	*	*	S	Bend	cis	-144.7	90.3	1.8	-75.4	176.8	168.9	167.4	-3	107.4
169	V	29.8	Very low	38.4	Very low	143 Å²	143	154.9 Å²	154.9	87%	0.867	74%	0.743	S	S	*	*	S	Bend	trans	-126	122.7	158	-177.8	0	0	0	0	104.1
170	C	27.4	Very low	36	Very low	125 Å²	125	164.1 Å²	164.1	85%	0.845	77%	0.772	S	S	*	*	S	Bend	trans	83.8	51.4	-171.6	-59.6	0	0	0	0	118.8
171	R	26.4	Very low	34.1	Very low	240 Å²	240	165.7 Å²	165.7	91%	0.906	78%	0.778	S	S	*	*			trans	-152.4	69.8	144.6	-83.3	-156.6	-164.1	-176.5	5.7	111.7
172	L	29.2	Very low	32.4	Very low	139 Å²	139	170.2 Å²	170.2	73%	0.728	79%	0.787	S	S	*	*	S	Bend	trans	-148.2	41.2	153.4	-120.3	137	0	0	0	109.8	M176	L172-M176 HydrophobicContact CD2-CE 4.27Å
173	K	28.9	Very low	30.8	Very low	208 Å²	208	173 Å²	173	90%	0.904	79%	0.793	S	S	*	*	S	Bend	trans	-115.1	10.1	172.9	-116	-177.7	-178.8	-178.9	0	113.4
174	Q	27	Very low	29.6	Very low	201 Å²	201	169 Å²	169	94%	0.939	78%	0.782	S	S	*	*	S	Bend	trans	-150.6	10.8	-177.3	-109.4	168.6	12.2	0	0	117.4
175	S	25.9	Very low	28.9	Very low	95 Å²	95	165.9 Å²	165.9	66%	0.664	77%	0.77	S	S	*	*	S	Bend	trans	-142.6	48.6	174.5	78.6	0	0	0	0	114.2
176	M	25.9	Very low	28.7	Very low	137 Å²	137	168.5 Å²	168.5	68%	0.675	78%	0.784	S	S	*	*			trans	-133.8	90.2	145.7	-82.5	-153.8	-78.1	0	0	106.4	L172 F178	L172-M176 HydrophobicContact CD2-CE 4.27Å; M176-F178 HydrophobicContact CB-CD2 4.26Å; M176-F178 PolarHBondContact O-N 3.19Å; M176-F178 HydrophobicContact SD-CD2 4.04Å; M176-F178 HydrophobicContact SD-CE2 4.02Å
177	R	24.3	Very low	28.7	Very low	259 Å²	259	163.4 Å²	163.4	98%	0.977	77%	0.771	S	S	*	*			trans	-62.8	74.6	157.1	-76.1	-180	177.9	169.2	-1.2	107	S179	R177-S179 PolarHBondContact O-N 3.36Å
178	F	25.8	Very low	29.1	Very low	170 Å²	170	158.6 Å²	158.6	75%	0.746	76%	0.764	S	S	*	*			trans	-84.7	111.5	159.4	-102.2	-83.9	0	0	0	106.6	M176 W180	M176-F178 HydrophobicContact CB-CD2 4.26Å; M176-F178 PolarHBondContact O-N 3.19Å; M176-F178 HydrophobicContact SD-CD2 4.04Å; M176-F178 HydrophobicContact SD-CE2 4.02Å; F178-W180 PolarHBondContact O-N 3.34Å
179	S	25.8	Very low	29.1	Very low	85 Å²	85	150.4 Å²	150.4	59%	0.594	75%	0.751	S	S	*	*			trans	-46	110.8	178.1	-173.6	0	0	0	0	109.6	R177 K181	R177-S179 PolarHBondContact O-N 3.36Å; S179-K181 PolarHBondContact O-N 2.84Å; S179-K181 WeakPolarHBondContact OG-CG 3.33Å
180	W	25.2	Very low	29.4	Very low	255 Å²	255	152.6 Å²	152.6	97%	0.966	75%	0.748	S	S	*	*			trans	-64.6	79.6	160.1	-76.1	75.3	0	0	0	107	F178	F178-W180 PolarHBondContact O-N 3.34Å
181	K	28.2	Very low	29.6	Very low	168 Å²	168	152.6 Å²	152.6	73%	0.73	74%	0.739	S	S	*	*			trans	-102.8	108.8	163.5	-88.3	-180	-179.1	-172.8	0	106.2	S179 K183	S179-K181 PolarHBondContact O-N 2.84Å; S179-K181 WeakPolarHBondContact OG-CG 3.33Å; K181-K183 PolarHBondContact O-N 2.91Å
182	H	28.8	Very low	29.9	Very low	164 Å²	164	146.7 Å²	146.7	76%	0.759	74%	0.735	S	S	*	*			trans	-24.8	106.1	166.4	-62.6	-77.9	0	0	0	111.9
183	K	27.3	Very low	29.9	Very low	204 Å²	204	146.8 Å²	146.8	89%	0.887	74%	0.736	S	S	*	*			trans	-101.3	96.3	161.5	-76.1	-171	177.8	-177	0	106.9	K181	K181-K183 PolarHBondContact O-N 2.91Å
184	T	33.7	Very low	30	Very low	82 Å²	82	144.6 Å²	144.6	50%	0.503	73%	0.733	S	S	.	*			trans	-52.6	139.4	163.3	39.2	0	0	0	0	109.2	T186	T184-T186 PolarHBondContact O-N 3.26Å
185	C	29.7	Very low	30	Very low	55 Å²	55	144.9 Å²	144.9	37%	0.372	73%	0.732	S	S	.	*			trans	-51.6	107.6	161.2	173.2	0	0	0	0	107.5	H187 C188 G189	C185-H187 PolarHBondContact O-N 3.45Å; C185-C188 HydrophobicContact CB-CB 4.29Å; C185-C188 WeakPolarHBondContact CB-SG 3.12Å; C185-C188 PolarHBondContact O-N 3.36Å; C185-C188 WeakPolarHBondContact SG-CB 3.38Å; C185-C188 PolarHBondContact SG-N 2.72Å; C185-C188 CovalentContact SG-SG 2.06Å; C185-C188 PolarHBondContact SG-SG 2.79Å; C185-G189 PolarHBondContact O-N 3.45Å; C185-G189 VanDerWaalsContact O-N 3.1Å
186	T	34.8	Very low	30.1	Very low	140 Å²	140	146.5 Å²	146.5	86%	0.859	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.5	-5	179.6	47.1	0	0	0	0	112.9	T184	T184-T186 PolarHBondContact O-N 3.26Å
187	H	34.6	Very low	30.2	Very low	147 Å²	147	146 Å²	146	68%	0.681	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.5	-15.2	-179.3	-114.8	-74.6	0	0	0	115.2	C185 H208	C185-H187 PolarHBondContact O-N 3.45Å; H187-H208 AromaticContact CE1-CD2 3.87Å
188	C	40.3	Very low	30.5	Very low	85 Å²	85	141.2 Å²	141.2	57%	0.574	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.9	-8.6	-168.8	65.5	0	0	0	0	116.2	C185 K190	C185-C188 HydrophobicContact CB-CB 4.29Å; C185-C188 WeakPolarHBondContact CB-SG 3.12Å; C185-C188 PolarHBondContact O-N 3.36Å; C185-C188 WeakPolarHBondContact SG-CB 3.38Å; C185-C188 PolarHBondContact SG-N 2.72Å; C185-C188 CovalentContact SG-SG 2.06Å; C185-C188 PolarHBondContact SG-SG 2.79Å; C188-K190 PolarHBondContact O-N 2.73Å
189	G	33	Very low	30.6	Very low	57 Å²	57	141.2 Å²	141.2	59%	0.588	74%	0.735	S	S	*	*			trans	61.1	2.1	162	0	0	0	0	0	118.6	C185	C185-G189 PolarHBondContact O-N 3.45Å; C185-G189 VanDerWaalsContact O-N 3.1Å
190	K	35.8	Very low	30.6	Very low	188 Å²	188	142.4 Å²	142.4	82%	0.817	74%	0.742	S	S	*	*			trans	-104.2	127	-178.4	-73.4	-175.2	177.6	-179	0	112.2	C188	C188-K190 PolarHBondContact O-N 2.73Å
191	L	30.1	Very low	30.8	Very low	125 Å²	125	141 Å²	141	65%	0.654	74%	0.743	S	S	*	*			trans	-89.3	133.6	164.6	-81.2	99.7	0	0	0	108.7
192	S	33.3	Very low	30.9	Very low	116 Å²	116	137.5 Å²	137.5	81%	0.811	74%	0.74	S	S	*	*			trans	-152.1	113.4	158.7	58	0	0	0	0	111.5
193	D	28.9	Very low	31	Very low	141 Å²	141	136.3 Å²	136.3	75%	0.754	74%	0.744	S	S	*	*			trans	-61.6	155	164.6	-60.7	-63.2	0	0	0	112
194	L	32.2	Very low	31	Very low	162 Å²	162	132.4 Å²	132.4	85%	0.848	74%	0.74	S	S	*	*			trans	119.5	94.6	162.5	-68.7	147.9	0	0	0	115.6
195	F	27.5	Very low	30.7	Very low	208 Å²	208	132.8 Å²	132.8	91%	0.912	74%	0.743	S	S	*	*			trans	22	104.6	133.6	-81.8	-94.5	0	0	0	118.8
196	N	27.7	Very low	30.7	Very low	129 Å²	129	141.6 Å²	141.6	69%	0.69	77%	0.769	S	S	*	*				-172.7	124.8	119.8	-141.3	-13.3	0	0	0	109.9	L198	N196-L198 PolarHBondContact O-N 3.4Å
197	P	28	Very low	30.3	Very low	127 Å²	127	137.5 Å²	137.5	83%	0.825	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	11.7	-171.5	-8.7	25.2	0	0	0	115.9
198	L	29.9	Very low	30.1	Very low	157 Å²	157	137.7 Å²	137.7	82%	0.822	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.3	17	-168.3	-87.2	160.1	0	0	0	114.6	N196	N196-L198 PolarHBondContact O-N 3.4Å
199	H	27.8	Very low	29.4	Very low	171 Å²	171	138.8 Å²	138.8	79%	0.792	76%	0.759	S	S	*	*			trans	-146.9	65.7	-172.8	-132	-76.8	0	0	0	113.8
200	C	26.2	Very low	29.2	Very low	109 Å²	109	141.8 Å²	141.8	74%	0.736	77%	0.766	S	S	*	*			trans	-165	74.2	158.5	-142.9	0	0	0	0	111.9
201	F	28.4	Very low	28.7	Very low	227 Å²	227	141.6 Å²	141.6	100%	0.996	77%	0.765	S	S	*	*			trans	-121.5	69.5	155.4	-97.4	-84.3	0	0	0	107.4
202	S	30.1	Very low	28.7	Very low	93 Å²	93	142.2 Å²	142.2	65%	0.65	77%	0.769	S	S	*	*			trans	-145.5	118	161	59.3	0	0	0	0	109.2
203	V	30.9	Very low	28.4	Very low	140 Å²	140	144 Å²	144	85%	0.848	77%	0.77	S	S	*	*			trans	64.6	109.9	154.8	-166.9	0	0	0	0	118.2
204	C	27.3	Very low	28.6	Very low	121 Å²	121	145 Å²	145	82%	0.818	77%	0.773	S	S	*	*				-171.4	111.3	113.4	-169.4	0	0	0	0	110.9
205	T	28.3	Very low	28.6	Very low	91 Å²	91	141.9 Å²	141.9	56%	0.558	77%	0.765	S	S	*	*			trans	-80.4	121.8	174	40.9	0	0	0	0	110.7
206	R	29.3	Very low	28.6	Very low	240 Å²	240	139 Å²	139	91%	0.906	76%	0.759	S	S	*	*			trans	-176.6	112.5	151.9	-102.8	161.9	-165.9	-161.7	4.2	110.2
207	G	27.7	Very low	28.7	Very low	54 Å²	54	142.5 Å²	142.5	56%	0.557	77%	0.768	S	S	*	*			trans	-82.9	155.9	178.5	0	0	0	0	0	113.5
208	H	28.9	Very low	28.8	Very low	150 Å²	150	142.2 Å²	142.2	69%	0.694	77%	0.769	S	S	*	*			trans	-144.8	122.2	155.3	-80.9	-81.1	0	0	0	109.6	H187	H187-H208 AromaticContact CE1-CD2 3.87Å
209	T	26.5	Very low	28.7	Very low	109 Å²	109	140.9 Å²	140.9	67%	0.669	77%	0.767	S	S	*	*			trans	-71.1	125.5	168.9	43.6	0	0	0	0	110.1
210	V	28.4	Very low	28.8	Very low	120 Å²	120	137.2 Å²	137.2	73%	0.727	77%	0.767	S	S	*	*			trans	-85.9	110.7	167.5	179.1	0	0	0	0	108.3
211	K	25.8	Very low	28.9	Very low	183 Å²	183	139.3 Å²	139.3	80%	0.796	77%	0.765	S	S	*	*			trans	-80.1	106.7	161.4	-85.6	179.5	172.6	176.8	0	107.4
212	D	30.2	Very low	28.9	Very low	139 Å²	139	134.2 Å²	134.2	74%	0.743	75%	0.749	S	S	*	*			trans	-102	103.5	161.3	-76.3	-27.9	0	0	0	109.3	I214	D212-I214 PolarHBondContact O-N 3.48Å
213	N	26.1	Very low	28.8	Very low	154 Å²	154	135.7 Å²	135.7	82%	0.824	75%	0.745	S	S	*	*			trans	-66.5	107.8	166.2	-76.1	-36.3	0	0	0	108.9
214	I	32.8	Very low	28.6	Very low	160 Å²	160	133.8 Å²	133.8	82%	0.821	72%	0.724	S	S	*	*			trans	-126.9	110	156.1	-60.6	-178.5	0	0	0	108.5	D212	D212-I214 PolarHBondContact O-N 3.48Å
215	S	33.4	Very low	28.7	Very low	97 Å²	97	134.7 Å²	134.7	68%	0.678	71%	0.714	S	S	*	*			trans	-59.5	139.3	178.1	51.2	0	0	0	0	114.3
216	N	27.5	Very low	28.5	Very low	149 Å²	149	133.9 Å²	133.9	80%	0.797	72%	0.724	S	S	*	*			trans	43.3	107.6	141.2	-66.6	-17.7	0	0	0	118.4
217	K	30.3	Very low	28.4	Very low	202 Å²	202	131.6 Å²	131.6	88%	0.878	73%	0.726	S	S	*	*				-177.8	141.9	112	-98	166	-177.2	-177.2	0	113.3
218	S	29.9	Very low	28.3	Very low	121 Å²	121	135.9 Å²	135.9	85%	0.846	74%	0.736	S	S	*	*			trans	68.7	93.9	161.8	55.6	0	0	0	0	120.1
219	V	28	Very low	28.1	Very low	129 Å²	129	134 Å²	134	78%	0.782	74%	0.739	S	S	*	*			trans	-71	138.2	150.9	169.6	0	0	0	0	110.3	Q221	V219-Q221 HydrophobicContact CG1-CG 4.09Å
220	A	29	Very low	27.9	Very low	94 Å²	94	134.9 Å²	134.9	78%	0.777	74%	0.74	S	S	*	*			trans	-161.3	89.7	150.3	0	0	0	0	0	106.8
221	Q	28.6	Very low	27.8	Very low	152 Å²	152	132.7 Å²	132.7	71%	0.71	73%	0.73	S	S	*	*				51.2	116.8	89.7	-79.9	-174	-25.1	0	0	115.4	V219	V219-Q221 HydrophobicContact CG1-CG 4.09Å
222	N	27.9	Very low	27.9	Very low	121 Å²	121	130.8 Å²	130.8	65%	0.647	72%	0.721	S	S	*	*			trans	179.3	85	137.5	-85.4	-19.4	0	0	0	107.7	S680	N222-S680 VanDerWaalsContact C-OG 3.24Å; N222-S680 WeakPolarHBondContact O-CB 3.46Å; N222-S680 PolarHBondContact O-OG 3.03Å
223	E	27.8	Very low	27.7	Very low	124 Å²	124	130.7 Å²	130.7	58%	0.579	72%	0.716	S	S	*	*				63.9	92.1	88.8	-73.3	-160.9	158.5	0	0	116.5	F225 S680	E223-F225 HydrophobicContact CG-CD2 4.44Å; E223-F225 HydrophobicContact CG-CE2 4.35Å; E223-S680 PolarHBondContact O-OG 2.99Å
224	Y	26.8	Very low	27.7	Very low	99 Å²	99	128.5 Å²	128.5	39%	0.388	71%	0.71	S	S	.	*			trans	-128.4	105	134.6	-99.7	-70.5	0	0	0	114.2	R677 N678 S680	Y224-R677 VanDerWaalsContact CD1-C 3.49Å; Y224-R677 HydrophobicContact CD1-CB 4.46Å; Y224-R677 WeakPolarHBondContact CD1-O 3.46Å; Y224-R677 HydrophobicContact CE1-CB 3.93Å; Y224-R677 WeakPolarHBondContact CE1-O 3.3Å; Y224-N678 HydrophobicContact CD1-CB 4.35Å; Y224-N678 WeakPolarHBondContact CD1-O 3.33Å; Y224-N678 WeakPolarHBondContact CD2-O 3.34Å; Y224-N678 HydrophobicContact CE1-CB 3.22Å; Y224-N678 WeakPolarHBondContact CE1-O 3.41Å; Y224-N678 HydrophobicContact CE2-CB 4.21Å; Y224-N678 WeakPolarHBondContact CE2-O 3.46Å; Y224-N678 VanDerWaalsContact CG-C 3.46Å; Y224-N678 VanDerWaalsContact CZ-O 3.27Å; Y224-N678 WeakPolarHBondContact OH-CB 3.29Å; Y224-N678 PolarHBondContact OH-ND2 3.27Å; Y224-N678 PolarHBondContact OH-OD1 3.29Å; Y224-S680 WeakPolarHBondContact CD2-OG 3.43Å
225	F	29.4	Very low	27.5	Very low	141 Å²	141	124.1 Å²	124.1	62%	0.618	69%	0.688	S	S	*	*			trans	-76.9	140.1	169.7	-89	-93.7	0	0	0	111.3	E223	E223-F225 HydrophobicContact CG-CD2 4.44Å; E223-F225 HydrophobicContact CG-CE2 4.35Å
226	G	24	Very low	27.1	Very low	74 Å²	74	125.3 Å²	125.3	76%	0.763	69%	0.691	S	S	*	*			trans	174.1	-5.1	166	0	0	0	0	0	122.2
227	M	27.7	Very low	27.1	Very low	191 Å²	191	120.7 Å²	120.7	94%	0.941	68%	0.679	S	S	*	*			trans	-142	93.2	160.3	-79.2	-151.2	93.1	0	0	109.7
228	N	24.5	Very low	26.8	Very low	145 Å²	145	118.9 Å²	118.9	78%	0.775	68%	0.678	S	S	*	*			trans	-75.4	140.5	165	-84.3	-23	0	0	0	109.6
229	S	24.8	Very low	26.8	Very low	110 Å²	110	119.8 Å²	119.8	77%	0.769	66%	0.663	S	S	*	*	S	Bend	trans	98.2	64.5	167.5	-163	0	0	0	0	117.7
230	L	24.2	Very low	27.1	Very low	128 Å²	128	119.9 Å²	119.9	67%	0.67	65%	0.649	S	S	*	*				175.1	91.2	126.7	-99.9	140.3	0	0	0	109.3	K232 S288	L230-K232 HydrophobicContact CD2-CG 4.47Å; L230-K232 PolarHBondContact O-N 3.18Å; L230-S288 WeakPolarHBondContact CD2-OG 3.28Å
231	S	24.8	Very low	27.4	Very low	74 Å²	74	120 Å²	120	52%	0.517	64%	0.636	S	S	.	*			trans	-65.3	99.6	161.7	56.6	0	0	0	0	108.9
232	K	28.4	Very low	27.7	Very low	142 Å²	142	114.7 Å²	114.7	62%	0.617	62%	0.616	S	S	*	*			trans	-108	69.9	157.8	-76.8	-173.1	177.1	-175.4	0	107.9	L230 P234 S288	L230-K232 HydrophobicContact CD2-CG 4.47Å; L230-K232 PolarHBondContact O-N 3.18Å; K232-P234 WeakPolarHBondContact O-CD 3.26Å; K232-S288 VanDerWaalsContact CE-O 3.28Å; K232-S288 WeakPolarHBondContact CE-O 3.19Å; K232-S288 WeakPolarHBondContact CE-OG 3.47Å; K232-S288 VanDerWaalsContact CG-OG 3.26Å; K232-S288 WeakPolarHBondContact CG-OG 3.47Å
233	H	27	Very low	28.1	Very low	138 Å²	138	114 Å²	114	64%	0.639	61%	0.612	S	S	*	*			trans	-82.6	116	155.4	-70.2	-63.2	0	0	0	106.2	I235	H233-I235 PolarHBondContact O-N 3.33Å
234	P	25.8	Very low	28.6	Very low	107 Å²	107	114.8 Å²	114.8	70%	0.695	62%	0.616	S	S	*	*			trans	-63.4	124.6	156.8	-6	22.8	0	0	0	106.5	K232 T236	K232-P234 WeakPolarHBondContact O-CD 3.26Å; P234-T236 PolarHBondContact O-N 3.4Å; P234-T236 VanDerWaalsContact O-N 3.12Å
235	I	28.6	Very low	29.6	Very low	69 Å²	69	113.7 Å²	113.7	35%	0.354	62%	0.622	S	S	.	*			trans	-48.2	113.2	174.1	-68	155.5	0	0	0	109.3	H233 L282 Q286 L287	H233-I235 PolarHBondContact O-N 3.33Å; I235-L282 HydrophobicContact CD1-CD2 4.26Å; I235-Q286 HydrophobicContact CD1-CB 3.89Å; I235-Q286 HydrophobicContact CG1-CB 3.88Å; I235-L287 HydrophobicContact CD1-CD1 4.12Å
236	T	25	Very low	30.8	Very low	121 Å²	121	109.1 Å²	109.1	74%	0.742	60%	0.603	S	S	*	*			trans	24.1	127.4	144.5	59.3	0	0	0	0	119	P234	P234-T236 PolarHBondContact O-N 3.4Å; P234-T236 VanDerWaalsContact O-N 3.12Å
237	G	26.7	Very low	32.7	Very low	53 Å²	53	111.1 Å²	111.1	55%	0.546	59%	0.593	S	S	.	*	S	Bend		84.9	136.2	117.3	0	0	0	0	0	117.3	R239	G237-R239 VanDerWaalsContact C-N 3.32Å; G237-R239 PolarHBondContact O-N 2.81Å
238	L	25.1	Very low	35	Very low	163 Å²	163	102.7 Å²	102.7	85%	0.853	55%	0.552	S	S	*	*	S	Bend	trans	6.4	76.3	134	-73.6	158.6	0	0	0	115.1
239	R	28.8	Very low	37.6	Very low	140 Å²	140	97.6 Å²	97.6	53%	0.528	53%	0.527	S	S	.	.			trans	-176	140.6	153.3	-103.8	144.8	174.5	-149	-17.7	106.3	G237 N243	G237-R239 VanDerWaalsContact C-N 3.32Å; G237-R239 PolarHBondContact O-N 2.81Å; R239-N243 WeakPolarHBondContact CD-OD1 3.4Å; R239-N243 WeakPolarHBondContact CG-OD1 3.4Å; R239-N243 PolarHBondContact NE-OD1 3.11Å; R239-N243 PolarHBondContact NH1-OD1 2.85Å; R239-N243 VanDerWaalsContact NH2-CG 3.31Å; R239-N243 PolarHBondContact NH2-ND2 3.27Å; R239-N243 VanDerWaalsContact NH2-ND2 3.15Å; R239-N243 PolarHBondContact NH2-OD1 3.02Å; R239-N243 VanDerWaalsContact NH2-OD1 3.13Å
240	W	34.1	Very low	40	Very low	131 Å²	131	96.1 Å²	96.1	50%	0.496	52%	0.517	S	S	.	.			trans	-50.5	171.5	168.3	-62.8	61	0	0	0	108.4	S242 E244 C245 I246	W240-S242 CarbonylContact C-O 3.43Å; W240-S242 VanDerWaalsContact C-O 3.29Å; W240-S242 VanDerWaalsContact CB-O 3.29Å; W240-S242 WeakPolarHBondContact CB-O 3.33Å; W240-S242 PolarHBondContact N-O 3.35Å; W240-S242 CarbonylContact O-C 3.42Å; W240-S242 WeakPolarHBondContact O-CA 3.24Å; W240-S242 PolarHBondContact O-N 3.29Å; W240-E244 WeakPolarHBondContact CB-O 3.41Å; W240-C245 HydrophobicContact CD2-CB 4.41Å; W240-C245 HydrophobicContact CE3-CB 4.17Å; W240-C245 HydrophobicContact CH2-CB 4.16Å; W240-C245 HydrophobicContact CZ2-CB 4.41Å; W240-C245 HydrophobicContact CZ3-CB 4.02Å; W240-I246 WeakPolarHBondContact CZ3-O 3.24Å
241	L	36.7	Very low	42.7	Very low	98 Å²	98	92.1 Å²	92.1	51%	0.513	49%	0.494	S	S	.	.	S	Bend	trans	-51.8	-2.9	172.9	-77.6	159.9	0	0	0	114.5	I246 L248 F251 F271	L241-I246 HydrophobicContact CB-CD1 4.31Å; L241-L248 HydrophobicContact CD1-CD2 3.74Å; L241-F251 HydrophobicContact CD1-CD2 4.26Å; L241-F271 HydrophobicContact CD1-CD2 4.5Å; L241-F271 HydrophobicContact CD1-CE2 3.44Å; L241-F271 VanDerWaalsContact CD1-CE2 3.44Å; L241-F271 HydrophobicContact CD1-CZ 3.76Å; L241-F271 HydrophobicContact CD2-CE2 4.26Å; L241-F271 HydrophobicContact CD2-CZ 3.74Å; L241-F271 HydrophobicContact CG-CZ 4.42Å
242	S	33.2	Very low	45.7	Very low	40 Å²	40	88.9 Å²	88.9	28%	0.28	47%	0.471	S	S	.	.	S	Bend	trans	-154.4	-167.9	152.9	68	0	0	0	0	110	W240 E244 I246	W240-S242 CarbonylContact C-O 3.43Å; W240-S242 VanDerWaalsContact C-O 3.29Å; W240-S242 VanDerWaalsContact CB-O 3.29Å; W240-S242 WeakPolarHBondContact CB-O 3.33Å; W240-S242 PolarHBondContact N-O 3.35Å; W240-S242 CarbonylContact O-C 3.42Å; W240-S242 WeakPolarHBondContact O-CA 3.24Å; W240-S242 PolarHBondContact O-N 3.29Å; S242-E244 PolarHBondContact O-N 3.25Å; S242-E244 VanDerWaalsContact O-N 3.12Å; S242-E244 WeakPolarHBondContact OG-CB 3.42Å; S242-E244 PolarHBondContact OG-N 3.47Å; S242-I246 WeakPolarHBondContact OG-CD1 3.42Å
243	N	36	Very low	48.6	Very low	106 Å²	106	89 Å²	89	57%	0.567	47%	0.471	S	S	*	.	S	Bend	trans	-68.7	0.8	167.1	-70.3	-15.4	0	0	0	113.9	R239	R239-N243 WeakPolarHBondContact CD-OD1 3.4Å; R239-N243 WeakPolarHBondContact CG-OD1 3.4Å; R239-N243 PolarHBondContact NE-OD1 3.11Å; R239-N243 PolarHBondContact NH1-OD1 2.85Å; R239-N243 VanDerWaalsContact NH2-CG 3.31Å; R239-N243 PolarHBondContact NH2-ND2 3.27Å; R239-N243 VanDerWaalsContact NH2-ND2 3.15Å; R239-N243 PolarHBondContact NH2-OD1 3.02Å; R239-N243 VanDerWaalsContact NH2-OD1 3.13Å
244	E	38.6	Very low	51.6	Low	140 Å²	140	85.9 Å²	85.9	65%	0.654	46%	0.456	S	S	*	.	S	Bend	trans	-107.1	140.6	-176.7	-52.6	-175.7	158.3	0	0	108.5	W240 S242 I246	W240-E244 WeakPolarHBondContact CB-O 3.41Å; S242-E244 PolarHBondContact O-N 3.25Å; S242-E244 VanDerWaalsContact O-N 3.12Å; S242-E244 WeakPolarHBondContact OG-CB 3.42Å; S242-E244 PolarHBondContact OG-N 3.47Å; E244-I246 VanDerWaalsContact C-N 3.3Å; E244-I246 HydrophobicContact CB-CG1 4.37Å; E244-I246 PolarHBondContact O-N 2.83Å
245	C	48.9	Very low	54.7	Low	76 Å²	76	84.1 Å²	84.1	51%	0.514	44%	0.443	S	S	.	.			trans	-66.9	94.5	171.7	-71.5	0	0	0	0	107.6	W240	W240-C245 HydrophobicContact CD2-CB 4.41Å; W240-C245 HydrophobicContact CE3-CB 4.17Å; W240-C245 HydrophobicContact CH2-CB 4.16Å; W240-C245 HydrophobicContact CZ2-CB 4.41Å; W240-C245 HydrophobicContact CZ3-CB 4.02Å
246	I	54.6	Low	57.8	Low	46 Å²	46	85.3 Å²	85.3	24%	0.236	45%	0.447	C	S	.	.			trans	-98.6	130	174	-41.1	165.5	0	0	0	109	W240 L241 S242 E244 L248 F251	W240-I246 WeakPolarHBondContact CZ3-O 3.24Å; L241-I246 HydrophobicContact CB-CD1 4.31Å; S242-I246 WeakPolarHBondContact OG-CD1 3.42Å; E244-I246 VanDerWaalsContact C-N 3.3Å; E244-I246 HydrophobicContact CB-CG1 4.37Å; E244-I246 PolarHBondContact O-N 2.83Å; I246-L248 PolarHBondContact O-N 2.79Å; I246-F251 HydrophobicContact CB-CE2 3.97Å; I246-F251 HydrophobicContact CD1-CE2 4.18Å; I246-F251 HydrophobicContact CG2-CD2 4.16Å; I246-F251 HydrophobicContact CG2-CE2 3.17Å; I246-F251 HydrophobicContact CG2-CZ 3.7Å
247	E	64.4	Low	61	Low	116 Å²	116	82.5 Å²	82.5	54%	0.542	43%	0.427	S	S	.	.			trans	-61.7	117.6	175.3	-62.3	176.5	175.8	0	0	109.5	C249 S250	E247-C249 PolarHBondContact O-N 3.39Å; E247-S250 VanDerWaalsContact O-CB 3.3Å; E247-S250 WeakPolarHBondContact O-CB 3.25Å; E247-S250 PolarHBondContact O-N 3.1Å; E247-S250 VanDerWaalsContact O-N 3.08Å
248	L	75.5	Confident	64.1	Low	14 Å²	14	84 Å²	84	7%	0.073	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-63.4	-32.7	179.8	-71.5	173.4	0	0	0	111	L241 I246 S250 F251 I252 D335 V353	L241-L248 HydrophobicContact CD1-CD2 3.74Å; I246-L248 PolarHBondContact O-N 2.79Å; L248-S250 PolarHBondContact O-N 2.79Å; L248-S250 VanDerWaalsContact O-N 3.15Å; L248-F251 PolarHBondContact O-N 3.07Å; L248-I252 HydrophobicContact CB-CD1 4.12Å; L248-I252 HydrophobicContact CD2-CD1 4.37Å; L248-I252 WeakPolarHBondContact O-CB 3.45Å; L248-I252 WeakPolarHBondContact O-CG1 3.4Å; L248-I252 PolarHBondContact O-N 3.35Å; L248-D335 HydrophobicContact CB-CB 4.15Å; L248-D335 HydrophobicContact CD1-CB 4.35Å; L248-D335 PolarHBondContact N-OD2 3.5Å; L248-V353 HydrophobicContact CD1-CB 4.5Å; L248-V353 HydrophobicContact CD1-CG2 3.96Å
249	C	77.8	Confident	67	Low	38 Å²	38	78.3 Å²	78.3	26%	0.257	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-60.1	-21.3	175.9	69.2	0	0	0	0	113.2	E247 F251 D335 V337 W351	E247-C249 PolarHBondContact O-N 3.39Å; C249-F251 VanDerWaalsContact C-N 3.34Å; C249-D335 PolarHBondContact N-OD2 3.37Å; C249-V337 HydrophobicContact CB-CG1 4.05Å; C249-V337 HydrophobicContact CB-CG2 3.64Å; C249-W351 HydrophobicContact CB-CH2 4.16Å; C249-W351 HydrophobicContact CB-CZ3 4.18Å
250	S	76.4	Confident	69.6	Low	79 Å²	79	78.2 Å²	78.2	55%	0.552	40%	0.4	S	S	*	.	G	3₁₀ helix	trans	-73.6	-22.3	175.5	-69.8	0	0	0	0	113.5	E247 L248	E247-S250 VanDerWaalsContact O-CB 3.3Å; E247-S250 WeakPolarHBondContact O-CB 3.25Å; E247-S250 PolarHBondContact O-N 3.1Å; E247-S250 VanDerWaalsContact O-N 3.08Å; L248-S250 PolarHBondContact O-N 2.79Å; L248-S250 VanDerWaalsContact O-N 3.15Å
251	F	81.2	Confident	71.6	Confident	43 Å²	43	73.6 Å²	73.6	19%	0.189	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.7	-12.7	-177	-57.5	-63.9	0	0	0	114.5	L241 I246 L248 C249 F271 S272 P274	L241-F251 HydrophobicContact CD1-CD2 4.26Å; I246-F251 HydrophobicContact CB-CE2 3.97Å; I246-F251 HydrophobicContact CD1-CE2 4.18Å; I246-F251 HydrophobicContact CG2-CD2 4.16Å; I246-F251 HydrophobicContact CG2-CE2 3.17Å; I246-F251 HydrophobicContact CG2-CZ 3.7Å; L248-F251 PolarHBondContact O-N 3.07Å; C249-F251 VanDerWaalsContact C-N 3.34Å; F251-F271 HydrophobicContact CB-CD2 3.78Å; F251-F271 HydrophobicContact CB-CE2 3.48Å; F251-F271 VanDerWaalsContact CB-CE2 3.48Å; F251-F271 HydrophobicContact CB-CZ 4.47Å; F251-F271 HydrophobicContact CD2-CE2 4.4Å; F251-F271 HydrophobicContact CG-CE2 4.14Å; F251-F271 WeakPolarHBondContact O-CA 3.5Å; F251-S272 PolarHBondContact O-N 3.24Å; F251-S272 VanDerWaalsContact O-N 3.07Å; F251-P274 HydrophobicContact CD1-CG 4.48Å; F251-P274 HydrophobicContact CE1-CB 3.87Å; F251-P274 HydrophobicContact CE1-CG 3.86Å; F251-P274 HydrophobicContact CZ-CB 4.45Å; F251-P274 HydrophobicContact CZ-CG 4.11Å
252	I	86.7	Confident	73.5	Confident	7 Å²	7	74.1 Å²	74.1	4%	0.036	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	121.5	-176	-59.3	175.8	0	0	0	109.7	L248 R270 F271 V298 I300 W351 V353	L248-I252 HydrophobicContact CB-CD1 4.12Å; L248-I252 HydrophobicContact CD2-CD1 4.37Å; L248-I252 WeakPolarHBondContact O-CB 3.45Å; L248-I252 WeakPolarHBondContact O-CG1 3.4Å; L248-I252 PolarHBondContact O-N 3.35Å; I252-R270 WeakPolarHBondContact CA-O 3.23Å; I252-F271 HydrophobicContact CD1-CD2 4.42Å; I252-F271 HydrophobicContact CG1-CB 4.22Å; I252-F271 HydrophobicContact CG1-CD2 3.73Å; I252-F271 HydrophobicContact CG1-CG 4.48Å; I252-V298 HydrophobicContact CD1-CG2 4.4Å; I252-V298 HydrophobicContact CG2-CG2 3.8Å; I252-I300 HydrophobicContact CG2-CD1 3.41Å; I252-I300 VanDerWaalsContact CG2-CD1 3.41Å; I252-I300 HydrophobicContact CG2-CG1 3.88Å; I252-W351 HydrophobicContact CB-CZ3 4.4Å; I252-W351 HydrophobicContact CG2-CZ3 4.39Å; I252-V353 HydrophobicContact CD1-CB 4.28Å; I252-V353 HydrophobicContact CD1-CG1 3.61Å; I252-V353 HydrophobicContact CD1-CG2 3.79Å
253	K	89	Confident	75.5	Confident	145 Å²	145	73.6 Å²	73.6	63%	0.63	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	131.6	173.2	-64.7	177.1	-177.4	171	0	110.2	G269 R270	K253-G269 CarbonylContact O-C 3.51Å; K253-G269 WeakPolarHBondContact O-CA 3.41Å; K253-R270 PolarHBondContact N-O 3.29Å; K253-R270 PolarHBondContact O-N 3.39Å
254	K	90.3	Very high	77.5	Confident	72 Å²	72	69 Å²	69	31%	0.313	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	130	167.5	-58.5	-177.4	-162.9	177.1	0	108.8	W267 I300 I302 E349 W351	K254-W267 HydrophobicContact CB-CD2 4.4Å; K254-W267 HydrophobicContact CB-CE3 3.9Å; K254-W267 HydrophobicContact CB-CZ3 4.4Å; K254-W267 HydrophobicContact CD-CD2 4.23Å; K254-W267 HydrophobicContact CD-CE3 4.4Å; K254-I300 HydrophobicContact CG-CD1 3.95Å; K254-I302 HydrophobicContact CD-CD1 3.73Å; K254-I302 VanDerWaalsContact NZ-CD1 3.26Å; K254-E349 IonicContact NZ-OE1 2.94Å; K254-E349 PolarHBondContact NZ-OE1 3.33Å; K254-E349 IonicContact NZ-OE2 3.4Å; K254-E349 PolarHBondContact NZ-OE2 3.32Å; K254-W351 HydrophobicContact CD-CZ2 4.26Å; K254-W351 HydrophobicContact CG-CH2 4.09Å; K254-W351 HydrophobicContact CG-CZ2 4.29Å
255	V	92.4	Very high	80	Confident	70 Å²	70	65 Å²	65	42%	0.424	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-57.7	-178	-178.4	0	0	0	0	111.1	L268 R270	V255-L268 WeakPolarHBondContact CA-O 3.17Å; V255-L268 HydrophobicContact CB-CD2 4.44Å; V255-L268 HydrophobicContact CB-CG 4.18Å; V255-L268 WeakPolarHBondContact CB-O 3.43Å; V255-L268 HydrophobicContact CG1-CD2 4.33Å; V255-L268 PolarHBondContact N-O 2.79Å; V255-R270 HydrophobicContact CG2-CB 3.8Å
256	E	92.8	Very high	82	Confident	94 Å²	94	63.2 Å²	63.2	44%	0.439	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	134.4	-171.2	-170.9	-167.7	144.7	0	0	110.5	K258 W267 L268	E256-K258 VanDerWaalsContact CD-CE 3.45Å; E256-K258 PolarHBondContact O-N 2.93Å; E256-K258 WeakPolarHBondContact OE1-CE 3.42Å; E256-K258 IonicContact OE1-NZ 3.36Å; E256-K258 PolarHBondContact OE1-NZ 3.14Å; E256-K258 WeakPolarHBondContact OE2-CE 3.49Å; E256-K258 IonicContact OE2-NZ 3.75Å; E256-K258 PolarHBondContact OE2-NZ 2.85Å; E256-W267 CarbonylContact O-C 3.55Å; E256-W267 VanDerWaalsContact O-CA 3.3Å; E256-W267 WeakPolarHBondContact O-CA 3.32Å; E256-L268 HydrophobicContact CB-CB 4.28Å; E256-L268 PolarHBondContact N-O 3.31Å; E256-L268 PolarHBondContact O-N 3.44Å
257	L	91.8	Very high	83.9	Confident	61 Å²	61	64 Å²	64	32%	0.319	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	119.5	172	178.2	65.8	0	0	0	109.5	Q265 W267	L257-Q265 HydrophobicContact CD1-CB 3.72Å; L257-Q265 HydrophobicContact CD1-CG 4.1Å; L257-W267 HydrophobicContact CB-CD2 4.15Å; L257-W267 HydrophobicContact CB-CE3 4.2Å; L257-W267 HydrophobicContact CB-CH2 4.22Å; L257-W267 HydrophobicContact CB-CZ2 4.16Å; L257-W267 HydrophobicContact CB-CZ3 4.24Å; L257-W267 HydrophobicContact CD1-CD2 4.23Å; L257-W267 HydrophobicContact CD1-CG 4.3Å; L257-W267 HydrophobicContact CD1-CZ2 4.28Å
258	K	91.2	Very high	85.4	Confident	85 Å²	85	59 Å²	59	37%	0.37	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-38.7	-176.4	-68.5	-66.6	179.7	-172.9	0	113.4	E256 V266 L268 Y356	E256-K258 VanDerWaalsContact CD-CE 3.45Å; E256-K258 PolarHBondContact O-N 2.93Å; E256-K258 WeakPolarHBondContact OE1-CE 3.42Å; E256-K258 IonicContact OE1-NZ 3.36Å; E256-K258 PolarHBondContact OE1-NZ 3.14Å; E256-K258 WeakPolarHBondContact OE2-CE 3.49Å; E256-K258 IonicContact OE2-NZ 3.75Å; E256-K258 PolarHBondContact OE2-NZ 2.85Å; K258-V266 PolarHBondContact N-O 2.88Å; K258-L268 HydrophobicContact CG-CB 3.98Å; K258-Y356 VanDerWaalsContact CE-OH 3.26Å; K258-Y356 WeakPolarHBondContact CE-OH 3.19Å; K258-Y356 HydrophobicContact CG-CE2 4.2Å
259	A	86.6	Confident	86.2	Confident	44 Å²	44	58.3 Å²	58.3	36%	0.364	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	157.5	-178.2	0	0	0	0	0	112.7	V266	A259-V266 HydrophobicContact CB-CB 4.33Å; A259-V266 PolarHBondContact N-O 3.35Å; A259-V266 VanDerWaalsContact N-O 3.16Å; A259-V266 PolarHBondContact O-N 3.27Å
260	H	84.8	Confident	86.9	Confident	138 Å²	138	60.6 Å²	60.6	64%	0.639	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.9	108.9	162.1	-65.5	83.7	0	0	0	107.1	Q265	H260-Q265 PolarHBondContact NE2-NE2 3Å
261	G	75.3	Confident	87.4	Confident	34 Å²	34	58.1 Å²	58.1	35%	0.351	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-179.4	173.3	0	0	0	0	0	111.7	F263 G264	G261-F263 VanDerWaalsContact C-N 3.27Å; G261-F263 PolarHBondContact O-N 3.16Å; G261-G264 WeakPolarHBondContact CA-O 3.23Å; G261-G264 PolarHBondContact N-O 3.48Å
262	R	76.3	Confident	87.4	Confident	108 Å²	108	57.7 Å²	57.7	41%	0.408	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-32.9	179.6	-177.7	175.3	178.6	129.2	10.4	113.7	D406 G445	R262-D406 IonicContact CZ-OD2 2.93Å; R262-D406 IonicContact NH1-OD2 3.92Å; R262-D406 PolarHBondContact NH1-OD2 3.27Å; R262-G445 VanDerWaalsContact NH1-C 3.32Å; R262-G445 PolarHBondContact NH1-O 3.44Å; R262-G445 VanDerWaalsContact NH1-O 3.14Å
263	F	75.5	Confident	86.3	Confident	29 Å²	29	60.9 Å²	60.9	13%	0.127	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.5	18.3	-171.7	-53	-69.7	0	0	0	113.2	G261 F303 E307 S310 L427	G261-F263 VanDerWaalsContact C-N 3.27Å; G261-F263 PolarHBondContact O-N 3.16Å; F263-F303 HydrophobicContact CB-CD1 3.84Å; F263-F303 HydrophobicContact CB-CE1 3.78Å; F263-F303 WeakPolarHBondContact O-CD1 3.46Å; F263-E307 WeakPolarHBondContact CA-OE1 3.4Å; F263-E307 HydrophobicContact CB-CB 4.41Å; F263-E307 HydrophobicContact CB-CG 4.47Å; F263-S310 WeakPolarHBondContact CD1-OG 2.93Å; F263-S310 WeakPolarHBondContact CE1-OG 3.5Å; F263-S310 WeakPolarHBondContact CG-OG 3.22Å; F263-L427 HydrophobicContact CE2-CD2 4.22Å; F263-L427 HydrophobicContact CE2-CG 3.92Å; F263-L427 HydrophobicContact CZ-CD1 4.26Å; F263-L427 HydrophobicContact CZ-CD2 3.64Å; F263-L427 HydrophobicContact CZ-CG 3.76Å
264	G	78.4	Confident	84.8	Confident	10 Å²	10	57.4 Å²	57.4	10%	0.103	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.5	179.9	-176.2	0	0	0	0	0	114.4	G261 I302	G261-G264 WeakPolarHBondContact CA-O 3.23Å; G261-G264 PolarHBondContact N-O 3.48Å; G264-I302 CarbonylContact C-O 3.41Å; G264-I302 WeakPolarHBondContact CA-O 3.43Å
265	Q	89.4	Confident	83.1	Confident	56 Å²	56	59.4 Å²	59.4	26%	0.262	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	137.1	178.2	-70.9	179.7	-21.5	0	0	110.7	L257 H260 K301 I302	L257-Q265 HydrophobicContact CD1-CB 3.72Å; L257-Q265 HydrophobicContact CD1-CG 4.1Å; H260-Q265 PolarHBondContact NE2-NE2 3Å; Q265-K301 CarbonylContact O-C 3.52Å; Q265-K301 WeakPolarHBondContact O-CA 3.39Å; Q265-I302 PolarHBondContact N-O 3.48Å; Q265-I302 PolarHBondContact O-N 2.95Å
266	V	92.2	Very high	80.7	Confident	38 Å²	38	63.8 Å²	63.8	23%	0.23	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	118.8	175.3	-176.6	0	0	0	0	109.2	K258 A259 A299 I300 K301	K258-V266 PolarHBondContact N-O 2.88Å; A259-V266 HydrophobicContact CB-CB 4.33Å; A259-V266 PolarHBondContact N-O 3.35Å; A259-V266 VanDerWaalsContact N-O 3.16Å; A259-V266 PolarHBondContact O-N 3.27Å; V266-A299 HydrophobicContact CG1-CB 4.43Å; V266-I300 CarbonylContact C-O 3.47Å; V266-I300 WeakPolarHBondContact CA-O 3.34Å; V266-K301 HydrophobicContact CG2-CB 4.42Å; V266-K301 HydrophobicContact CG2-CG 4.14Å
267	W	94.7	Very high	78.1	Confident	62 Å²	62	67.7 Å²	67.7	24%	0.235	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	141.1	178.8	-67.6	72.2	0	0	0	110.4	K254 E256 L257 G269 A299 I300 I302	K254-W267 HydrophobicContact CB-CD2 4.4Å; K254-W267 HydrophobicContact CB-CE3 3.9Å; K254-W267 HydrophobicContact CB-CZ3 4.4Å; K254-W267 HydrophobicContact CD-CD2 4.23Å; K254-W267 HydrophobicContact CD-CE3 4.4Å; E256-W267 CarbonylContact O-C 3.55Å; E256-W267 VanDerWaalsContact O-CA 3.3Å; E256-W267 WeakPolarHBondContact O-CA 3.32Å; L257-W267 HydrophobicContact CB-CD2 4.15Å; L257-W267 HydrophobicContact CB-CE3 4.2Å; L257-W267 HydrophobicContact CB-CH2 4.22Å; L257-W267 HydrophobicContact CB-CZ2 4.16Å; L257-W267 HydrophobicContact CB-CZ3 4.24Å; L257-W267 HydrophobicContact CD1-CD2 4.23Å; L257-W267 HydrophobicContact CD1-CG 4.3Å; L257-W267 HydrophobicContact CD1-CZ2 4.28Å; W267-G269 PolarHBondContact O-N 3.41Å; W267-A299 CarbonylContact O-C 3.58Å; W267-A299 WeakPolarHBondContact O-CA 3.24Å; W267-I300 HydrophobicContact CB-CB 4.3Å; W267-I300 PolarHBondContact N-O 2.94Å; W267-I300 PolarHBondContact O-N 3.4Å; W267-I302 HydrophobicContact CG-CD1 4.19Å
268	L	95.1	Very high	75.3	Confident	12 Å²	12	71.8 Å²	71.8	6%	0.063	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	123	154.2	173.5	61.3	0	0	0	107.6	V255 E256 K258 D297 Y356	V255-L268 WeakPolarHBondContact CA-O 3.17Å; V255-L268 HydrophobicContact CB-CD2 4.44Å; V255-L268 HydrophobicContact CB-CG 4.18Å; V255-L268 WeakPolarHBondContact CB-O 3.43Å; V255-L268 HydrophobicContact CG1-CD2 4.33Å; V255-L268 PolarHBondContact N-O 2.79Å; E256-L268 HydrophobicContact CB-CB 4.28Å; E256-L268 PolarHBondContact N-O 3.31Å; E256-L268 PolarHBondContact O-N 3.44Å; K258-L268 HydrophobicContact CG-CB 3.98Å; L268-D297 HydrophobicContact CD1-CB 3.83Å; L268-Y356 HydrophobicContact CB-CE2 4.42Å; L268-Y356 HydrophobicContact CD1-CD1 3.64Å; L268-Y356 HydrophobicContact CD1-CD2 3.9Å; L268-Y356 HydrophobicContact CD1-CE1 3.76Å; L268-Y356 HydrophobicContact CD1-CE2 4.05Å; L268-Y356 HydrophobicContact CD1-CG 3.72Å
269	G	93.4	Very high	72.3	Confident	0 Å²	0	75.3 Å²	75.3	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	162.6	171.7	0	0	0	0	0	111.1	K253 W267 D297 V298	K253-G269 CarbonylContact O-C 3.51Å; K253-G269 WeakPolarHBondContact O-CA 3.41Å; W267-G269 PolarHBondContact O-N 3.41Å; G269-D297 WeakPolarHBondContact O-CA 3.3Å; G269-V298 WeakPolarHBondContact CA-O 3.29Å; G269-V298 PolarHBondContact N-O 2.91Å; G269-V298 PolarHBondContact O-N 2.89Å
270	R	91.7	Very high	69.8	Low	85 Å²	85	82 Å²	82	32%	0.321	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	116.7	174.1	-161.3	163.5	-73.2	162.7	-12	110.1	I252 K253 V255 E295 D297	I252-R270 WeakPolarHBondContact CA-O 3.23Å; K253-R270 PolarHBondContact N-O 3.29Å; K253-R270 PolarHBondContact O-N 3.39Å; V255-R270 HydrophobicContact CG2-CB 3.8Å; R270-E295 VanDerWaalsContact CD-CD 3.47Å; R270-E295 WeakPolarHBondContact CD-OE2 3.23Å; R270-E295 HydrophobicContact CG-CB 3.65Å; R270-E295 HydrophobicContact CG-CG 4.14Å; R270-E295 IonicContact NE-OE2 3.23Å; R270-E295 IonicContact NH1-OE2 2.74Å; R270-D297 IonicContact CZ-OD1 3.93Å; R270-D297 IonicContact NE-OD1 3.63Å; R270-D297 PolarHBondContact NE-OD1 2.71Å; R270-D297 IonicContact NH2-OD1 3.88Å; R270-D297 PolarHBondContact NH2-OD1 2.75Å
271	F	86.8	Confident	67	Low	28 Å²	28	82.6 Å²	82.6	12%	0.123	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	125.9	177	176.8	-100.9	0	0	0	109.5	L241 F251 I252 E295 I296 V298	L241-F271 HydrophobicContact CD1-CD2 4.5Å; L241-F271 HydrophobicContact CD1-CE2 3.44Å; L241-F271 VanDerWaalsContact CD1-CE2 3.44Å; L241-F271 HydrophobicContact CD1-CZ 3.76Å; L241-F271 HydrophobicContact CD2-CE2 4.26Å; L241-F271 HydrophobicContact CD2-CZ 3.74Å; L241-F271 HydrophobicContact CG-CZ 4.42Å; F251-F271 HydrophobicContact CB-CD2 3.78Å; F251-F271 HydrophobicContact CB-CE2 3.48Å; F251-F271 VanDerWaalsContact CB-CE2 3.48Å; F251-F271 HydrophobicContact CB-CZ 4.47Å; F251-F271 HydrophobicContact CD2-CE2 4.4Å; F251-F271 HydrophobicContact CG-CE2 4.14Å; F251-F271 WeakPolarHBondContact O-CA 3.5Å; I252-F271 HydrophobicContact CD1-CD2 4.42Å; I252-F271 HydrophobicContact CG1-CB 4.22Å; I252-F271 HydrophobicContact CG1-CD2 3.73Å; I252-F271 HydrophobicContact CG1-CG 4.48Å; F271-E295 WeakPolarHBondContact O-CA 3.41Å; F271-I296 HydrophobicContact CB-CB 4.47Å; F271-I296 HydrophobicContact CD1-CD1 4.45Å; F271-I296 PolarHBondContact N-O 3.2Å; F271-I296 PolarHBondContact O-N 2.96Å; F271-V298 HydrophobicContact CB-CG1 4.03Å
272	S	80.3	Confident	65.1	Low	33 Å²	33	86.5 Å²	86.5	23%	0.231	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	122.5	170.8	-57.6	0	0	0	0	108.7	F251	F251-S272 PolarHBondContact O-N 3.24Å; F251-S272 VanDerWaalsContact O-N 3.07Å
273	S	63.6	Low	62.9	Low	75 Å²	75	88 Å²	88	52%	0.524	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-60.9	137.4	172.5	-173.4	0	0	0	0	109.1	D275	S273-D275 PolarHBondContact O-N 3.38Å
274	P	59	Low	60.7	Low	71 Å²	71	92.4 Å²	92.4	46%	0.461	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-53.3	126.2	165.6	18.7	-26.6	0	0	0	108.4	F251 D276	F251-P274 HydrophobicContact CD1-CG 4.48Å; F251-P274 HydrophobicContact CE1-CB 3.87Å; F251-P274 HydrophobicContact CE1-CG 3.86Å; F251-P274 HydrophobicContact CZ-CB 4.45Å; F251-P274 HydrophobicContact CZ-CG 4.11Å; P274-D276 PolarHBondContact O-N 2.85Å
275	D	52.9	Low	58.6	Low	114 Å²	114	96.1 Å²	96.1	61%	0.61	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-54.1	138	178	-79.1	-51.9	0	0	0	109.7	S273 Q277 K294	S273-D275 PolarHBondContact O-N 3.38Å; D275-Q277 VanDerWaalsContact C-N 3.25Å; D275-Q277 PolarHBondContact O-N 2.93Å; D275-K294 IonicContact OD1-NZ 2.73Å; D275-K294 PolarHBondContact OD1-NZ 3.29Å
276	D	42.8	Very low	55.9	Low	162 Å²	162	97.5 Å²	97.5	87%	0.866	52%	0.522	S	S	*	.	S	Bend	trans	-55.2	78.8	176.4	-72.9	-45.5	0	0	0	112.2	P274	P274-D276 PolarHBondContact O-N 2.85Å
277	Q	38.2	Very low	53.1	Low	177 Å²	177	101.2 Å²	101.2	83%	0.827	54%	0.54	S	S	*	.			trans	-107.1	5.7	168.2	-78.1	-157.5	1.8	0	0	113.8	D275	D275-Q277 VanDerWaalsContact C-N 3.25Å; D275-Q277 PolarHBondContact O-N 2.93Å
278	N	33.4	Very low	50	Low	147 Å²	147	100.6 Å²	100.6	79%	0.786	55%	0.545	S	S	*	.	S	Bend	trans	-143.7	124.7	169.5	-81.9	-44.8	0	0	0	111.8	F280	N278-F280 PolarHBondContact O-N 3.11Å
279	D	28	Very low	47.2	Very low	158 Å²	158	104 Å²	104	85%	0.845	56%	0.562	S	S	*	*			trans	-41.2	94.3	171.7	-92	-40.7	0	0	0	112.5
280	F	33.5	Very low	44.4	Very low	184 Å²	184	110.4 Å²	110.4	81%	0.807	60%	0.597	S	S	*	*			trans	-127.3	96.8	157.5	-109.7	-90.7	0	0	0	107.7	N278 L282	N278-F280 PolarHBondContact O-N 3.11Å; F280-L282 PolarHBondContact O-N 3.45Å
281	N	26.5	Very low	41.8	Very low	151 Å²	151	116.6 Å²	116.6	81%	0.807	63%	0.626	S	S	*	*			trans	-60.9	82.1	167.8	-84.7	-48.5	0	0	0	109.6
282	L	35.8	Very low	39.8	Very low	117 Å²	117	122.4 Å²	122.4	61%	0.613	66%	0.658	S	S	*	*			trans	-83.3	114.9	161.7	-138.7	82.6	0	0	0	106.8	I235 F280 S284	I235-L282 HydrophobicContact CD1-CD2 4.26Å; F280-L282 PolarHBondContact O-N 3.45Å; L282-S284 PolarHBondContact O-N 3.35Å
283	N	28.7	Very low	38.5	Very low	138 Å²	138	126.6 Å²	126.6	74%	0.738	68%	0.678	S	S	*	*			trans	-41.8	111.5	-176.3	-71.9	-33.7	0	0	0	112.1	S285	N283-S285 PolarHBondContact O-N 3.27Å
284	S	29.5	Very low	38.7	Very low	123 Å²	123	130.6 Å²	130.6	86%	0.86	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	36.2	-166.6	-40.7	0	0	0	0	115	L282	L282-S284 PolarHBondContact O-N 3.35Å
285	S	34.2	Very low	39.7	Very low	88 Å²	88	131.4 Å²	131.4	62%	0.615	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.5	4.2	-176.2	55.1	0	0	0	0	115.4	N283	N283-S285 PolarHBondContact O-N 3.27Å
286	Q	34.1	Very low	41.4	Very low	84 Å²	84	128.8 Å²	128.8	39%	0.393	67%	0.669	S	S	.	*	S	Bend	trans	-124	-3.4	-175.6	-66.2	-174	1.1	0	0	116.1	I235	I235-Q286 HydrophobicContact CD1-CB 3.89Å; I235-Q286 HydrophobicContact CG1-CB 3.88Å
287	L	33.8	Very low	43.7	Very low	117 Å²	117	124.2 Å²	124.2	61%	0.613	65%	0.645	S	S	*	*			trans	-101	84.4	164.1	-85.5	84.9	0	0	0	109.7	I235 L289	I235-L287 HydrophobicContact CD1-CD1 4.12Å; L287-L289 HydrophobicContact CB-CB 4.42Å; L287-L289 HydrophobicContact CB-CD1 4.39Å; L287-L289 HydrophobicContact CD2-CB 4.46Å; L287-L289 HydrophobicContact CD2-CD1 3.39Å; L287-L289 HydrophobicContact CD2-CG 4.45Å; L287-L289 HydrophobicContact CG-CD1 3.83Å; L287-L289 PolarHBondContact O-N 3.03Å
288	S	28.1	Very low	46.4	Very low	48 Å²	48	116 Å²	116	34%	0.336	61%	0.606	S	S	.	*			trans	-77.6	51.5	152.5	57	0	0	0	0	109.4	L230 K232	L230-S288 WeakPolarHBondContact CD2-OG 3.28Å; K232-S288 VanDerWaalsContact CE-O 3.28Å; K232-S288 WeakPolarHBondContact CE-O 3.19Å; K232-S288 WeakPolarHBondContact CE-OG 3.47Å; K232-S288 VanDerWaalsContact CG-OG 3.26Å; K232-S288 WeakPolarHBondContact CG-OG 3.47Å
289	L	36.1	Very low	49.4	Very low	83 Å²	83	109.4 Å²	109.4	44%	0.435	57%	0.573	S	S	.	*	S	Bend	trans	-80.6	126.6	158.6	-86.7	153.9	0	0	0	105	L287 K291 I296	L287-L289 HydrophobicContact CB-CB 4.42Å; L287-L289 HydrophobicContact CB-CD1 4.39Å; L287-L289 HydrophobicContact CD2-CB 4.46Å; L287-L289 HydrophobicContact CD2-CD1 3.39Å; L287-L289 HydrophobicContact CD2-CG 4.45Å; L287-L289 HydrophobicContact CG-CD1 3.83Å; L287-L289 PolarHBondContact O-N 3.03Å; L289-K291 PolarHBondContact O-N 2.72Å; L289-I296 HydrophobicContact CD1-CD1 3.86Å; L289-I296 HydrophobicContact CD2-CD1 4.41Å; L289-I296 HydrophobicContact CD2-CG1 4.38Å
290	N	34.8	Very low	52.5	Low	136 Å²	136	101.9 Å²	101.9	73%	0.727	53%	0.532	S	S	*	.			trans	-42.1	114.5	170.6	-89.3	-27.2	0	0	0	107.8	N292 N293	N290-N292 PolarHBondContact O-N 3.35Å; N290-N293 PolarHBondContact O-N 2.92Å; N290-N293 VanDerWaalsContact O-N 3.09Å
291	K	38.8	Very low	55.4	Low	214 Å²	214	93.8 Å²	93.8	93%	0.93	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	5.7	176.9	-86.9	-178.8	171.2	179.5	0	114.2	L289	L289-K291 PolarHBondContact O-N 2.72Å
292	N	44.6	Very low	58.5	Low	150 Å²	150	87 Å²	87	80%	0.802	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	-6.9	-179.2	-66	-5.3	0	0	0	114.5	N290	N290-N292 PolarHBondContact O-N 3.35Å
293	N	53	Low	61.1	Low	122 Å²	122	81.4 Å²	81.4	65%	0.652	43%	0.431	S	S	*	.			trans	-115.4	103.7	173	-91	10.7	0	0	0	110.3	N290 E295	N290-N293 PolarHBondContact O-N 2.92Å; N290-N293 VanDerWaalsContact O-N 3.09Å; N293-E295 PolarHBondContact O-N 2.93Å
294	K	67.6	Low	63.9	Low	158 Å²	158	78.8 Å²	78.8	69%	0.687	42%	0.416	S	S	*	.			trans	-69.3	-6.3	171.6	-80.2	-167.4	171.9	-162.4	0	113.6	D275	D275-K294 IonicContact OD1-NZ 2.73Å; D275-K294 PolarHBondContact OD1-NZ 3.29Å
295	E	79.8	Confident	66.6	Low	89 Å²	89	76.8 Å²	76.8	42%	0.416	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	133.6	-171.7	-66.7	-177.2	155.1	0	0	110.7	R270 F271 N293	R270-E295 VanDerWaalsContact CD-CD 3.47Å; R270-E295 WeakPolarHBondContact CD-OE2 3.23Å; R270-E295 HydrophobicContact CG-CB 3.65Å; R270-E295 HydrophobicContact CG-CG 4.14Å; R270-E295 IonicContact NE-OE2 3.23Å; R270-E295 IonicContact NH1-OE2 2.74Å; F271-E295 WeakPolarHBondContact O-CA 3.41Å; N293-E295 PolarHBondContact O-N 2.93Å
296	I	87.5	Confident	69	Low	59 Å²	59	77.8 Å²	77.8	30%	0.303	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	126.3	176.9	-59.1	173.7	0	0	0	108	F271 L289 V298	F271-I296 HydrophobicContact CB-CB 4.47Å; F271-I296 HydrophobicContact CD1-CD1 4.45Å; F271-I296 PolarHBondContact N-O 3.2Å; F271-I296 PolarHBondContact O-N 2.96Å; L289-I296 HydrophobicContact CD1-CD1 3.86Å; L289-I296 HydrophobicContact CD2-CD1 4.41Å; L289-I296 HydrophobicContact CD2-CG1 4.38Å; I296-V298 HydrophobicContact CG2-CG1 4.37Å
297	D	92.6	Very high	71.4	Confident	65 Å²	65	76 Å²	76	35%	0.348	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	131.7	173.4	-71.5	-23.8	0	0	0	110	L268 G269 R270 Y356	L268-D297 HydrophobicContact CD1-CB 3.83Å; G269-D297 WeakPolarHBondContact O-CA 3.3Å; R270-D297 IonicContact CZ-OD1 3.93Å; R270-D297 IonicContact NE-OD1 3.63Å; R270-D297 PolarHBondContact NE-OD1 2.71Å; R270-D297 IonicContact NH2-OD1 3.88Å; R270-D297 PolarHBondContact NH2-OD1 2.75Å; D297-Y356 HydrophobicContact CB-CD1 4.03Å; D297-Y356 HydrophobicContact CB-CG 4.5Å
298	V	94.3	Very high	74	Confident	4 Å²	4	74.1 Å²	74.1	2%	0.024	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	156.8	-177.8	-60.5	0	0	0	0	110.2	I252 G269 F271 I296 I300 Y332 V353	I252-V298 HydrophobicContact CD1-CG2 4.4Å; I252-V298 HydrophobicContact CG2-CG2 3.8Å; G269-V298 WeakPolarHBondContact CA-O 3.29Å; G269-V298 PolarHBondContact N-O 2.91Å; G269-V298 PolarHBondContact O-N 2.89Å; F271-V298 HydrophobicContact CB-CG1 4.03Å; I296-V298 HydrophobicContact CG2-CG1 4.37Å; V298-I300 HydrophobicContact CG2-CG1 4.34Å; V298-Y332 HydrophobicContact CB-CD2 4.49Å; V298-Y332 HydrophobicContact CG1-CD2 3.98Å; V298-Y332 HydrophobicContact CG1-CE2 3.85Å; V298-V353 HydrophobicContact CB-CG1 3.99Å; V298-V353 HydrophobicContact CG1-CG1 4.48Å; V298-V353 HydrophobicContact CG2-CG1 4.08Å
299	A	95.2	Very high	76.8	Confident	9 Å²	9	81.1 Å²	81.1	7%	0.074	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	125.9	172.5	0	0	0	0	0	109.5	V266 W267 V353 T354 Y356	V266-A299 HydrophobicContact CG1-CB 4.43Å; W267-A299 CarbonylContact O-C 3.58Å; W267-A299 WeakPolarHBondContact O-CA 3.24Å; A299-V353 CarbonylContact O-C 3.29Å; A299-V353 WeakPolarHBondContact O-CA 3.03Å; A299-T354 WeakPolarHBondContact CB-OG1 3.16Å; A299-T354 PolarHBondContact N-O 3.46Å; A299-T354 PolarHBondContact O-N 3.37Å; A299-T354 PolarHBondContact O-OG1 3.41Å; A299-Y356 HydrophobicContact CB-CD2 4.27Å
300	I	94.3	Very high	79.2	Confident	0 Å²	0	78 Å²	78	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	108.6	178.1	-44.8	166.8	0	0	0	108.3	I252 K254 V266 W267 V298 I302 W351	I252-I300 HydrophobicContact CG2-CD1 3.41Å; I252-I300 VanDerWaalsContact CG2-CD1 3.41Å; I252-I300 HydrophobicContact CG2-CG1 3.88Å; K254-I300 HydrophobicContact CG-CD1 3.95Å; V266-I300 CarbonylContact C-O 3.47Å; V266-I300 WeakPolarHBondContact CA-O 3.34Å; W267-I300 HydrophobicContact CB-CB 4.3Å; W267-I300 PolarHBondContact N-O 2.94Å; W267-I300 PolarHBondContact O-N 3.4Å; V298-I300 HydrophobicContact CG2-CG1 4.34Å; I300-I302 HydrophobicContact CG2-CD1 4.31Å; I300-I302 HydrophobicContact CG2-CG1 3.84Å; I300-W351 HydrophobicContact CD1-CE3 4.4Å; I300-W351 HydrophobicContact CD1-CZ3 4.07Å; I300-W351 HydrophobicContact CG2-CB 4.19Å; I300-W351 HydrophobicContact CG2-CD2 3.62Å; I300-W351 HydrophobicContact CG2-CE3 3.52Å; I300-W351 HydrophobicContact CG2-CG 3.92Å; I300-W351 HydrophobicContact CG2-CZ3 4.21Å
301	K	94	Very high	81.9	Confident	15 Å²	15	72.7 Å²	72.7	7%	0.065	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	120.1	171	-168.9	176.7	-179.3	-173.7	0	108.8	Q265 V266 F303 E314 W351 L352 D424	Q265-K301 CarbonylContact O-C 3.52Å; Q265-K301 WeakPolarHBondContact O-CA 3.39Å; V266-K301 HydrophobicContact CG2-CB 4.42Å; V266-K301 HydrophobicContact CG2-CG 4.14Å; K301-F303 HydrophobicContact CB-CE2 4.01Å; K301-F303 HydrophobicContact CD-CE1 4.3Å; K301-F303 HydrophobicContact CD-CE2 3.73Å; K301-F303 HydrophobicContact CD-CZ 3.41Å; K301-F303 VanDerWaalsContact CD-CZ 3.41Å; K301-F303 HydrophobicContact CG-CD2 4.29Å; K301-F303 HydrophobicContact CG-CE2 3.54Å; K301-F303 HydrophobicContact CG-CZ 3.71Å; K301-E314 IonicContact NZ-OE1 3.6Å; K301-E314 PolarHBondContact NZ-OE1 3Å; K301-E314 IonicContact NZ-OE2 2.7Å; K301-E314 PolarHBondContact NZ-OE2 2.96Å; K301-W351 CarbonylContact O-C 3.59Å; K301-W351 WeakPolarHBondContact O-CA 3.48Å; K301-L352 HydrophobicContact CB-CB 4.32Å; K301-L352 PolarHBondContact N-O 3.4Å; K301-L352 PolarHBondContact O-N 3.28Å; K301-D424 VanDerWaalsContact NZ-CG 3.29Å; K301-D424 IonicContact NZ-OD1 2.67Å; K301-D424 PolarHBondContact NZ-OD1 3.42Å; K301-D424 IonicContact NZ-OD2 3.53Å
302	I	92.5	Very high	84.3	Confident	8 Å²	8	66.7 Å²	66.7	4%	0.041	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	117.9	-174	-53.6	-176.4	0	0	0	108.8	K254 G264 Q265 W267 I300 E349 Y350 W351	K254-I302 HydrophobicContact CD-CD1 3.73Å; K254-I302 VanDerWaalsContact NZ-CD1 3.26Å; G264-I302 CarbonylContact C-O 3.41Å; G264-I302 WeakPolarHBondContact CA-O 3.43Å; Q265-I302 PolarHBondContact N-O 3.48Å; Q265-I302 PolarHBondContact O-N 2.95Å; W267-I302 HydrophobicContact CG-CD1 4.19Å; I300-I302 HydrophobicContact CG2-CD1 4.31Å; I300-I302 HydrophobicContact CG2-CG1 3.84Å; I302-E349 HydrophobicContact CG2-CB 3.89Å; I302-E349 HydrophobicContact CG2-CG 3.94Å; I302-Y350 WeakPolarHBondContact CA-O 3.22Å; I302-W351 HydrophobicContact CG1-CG 4.49Å
303	F	90.6	Very high	86.4	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	141.2	179	-55.7	-110.3	0	0	0	109.5	F263 K301 E307 W311 E314 Y350 L352	F263-F303 HydrophobicContact CB-CD1 3.84Å; F263-F303 HydrophobicContact CB-CE1 3.78Å; F263-F303 WeakPolarHBondContact O-CD1 3.46Å; K301-F303 HydrophobicContact CB-CE2 4.01Å; K301-F303 HydrophobicContact CD-CE1 4.3Å; K301-F303 HydrophobicContact CD-CE2 3.73Å; K301-F303 HydrophobicContact CD-CZ 3.41Å; K301-F303 VanDerWaalsContact CD-CZ 3.41Å; K301-F303 HydrophobicContact CG-CD2 4.29Å; K301-F303 HydrophobicContact CG-CE2 3.54Å; K301-F303 HydrophobicContact CG-CZ 3.71Å; F303-E307 HydrophobicContact CB-CB 4.07Å; F303-E307 HydrophobicContact CD1-CB 4.17Å; F303-W311 HydrophobicContact CB-CB 4.18Å; F303-W311 HydrophobicContact CD1-CB 4Å; F303-W311 HydrophobicContact CD2-CB 3.84Å; F303-W311 AromaticContact CD2-CD1 3.6Å; F303-W311 HydrophobicContact CD2-CG 4.08Å; F303-W311 HydrophobicContact CE1-CB 4.31Å; F303-W311 HydrophobicContact CE2-CB 4.16Å; F303-W311 AromaticContact CE2-CD1 3.73Å; F303-W311 HydrophobicContact CE2-CG 4.37Å; F303-W311 HydrophobicContact CG-CB 3.77Å; F303-W311 HydrophobicContact CG-CG 4.44Å; F303-W311 HydrophobicContact CZ-CB 4.37Å; F303-E314 WeakPolarHBondContact CZ-OE2 3.43Å; F303-Y350 WeakPolarHBondContact CD2-O 3.23Å; F303-Y350 PolarHBondContact N-O 2.94Å; F303-Y350 PolarHBondContact O-N 3.13Å; F303-L352 HydrophobicContact CE2-CB 3.98Å
304	M	87.3	Confident	88.3	Confident	83 Å²	83	56.1 Å²	56.1	41%	0.409	28%	0.277	S	S	.	.			trans	-78.6	166.3	171	-55.1	-156.2	-163.4	0	0	110.7	T306 E307 K308	M304-T306 PolarHBondContact O-N 3.3Å; M304-T306 VanDerWaalsContact O-N 3.14Å; M304-E307 PolarHBondContact N-OE2 3.04Å; M304-E307 CarbonylContact O-C 3.49Å; M304-E307 WeakPolarHBondContact O-CA 3.44Å; M304-E307 PolarHBondContact O-N 3.11Å; M304-K308 PolarHBondContact O-N 3.05Å
305	S	84.9	Confident	89.4	Confident	80 Å²	80	49.7 Å²	49.7	56%	0.559	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	-55.9	-30.7	177.5	55.4	0	0	0	0	113.8	E307 K308	S305-E307 PolarHBondContact O-N 2.99Å; S305-K308 WeakPolarHBondContact O-CB 3.25Å; S305-K308 PolarHBondContact O-N 3Å
306	T	85.2	Confident	89.9	Confident	110 Å²	110	47.4 Å²	47.4	68%	0.675	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-65	-24	173.3	49.1	0	0	0	0	113.5	M304	M304-T306 PolarHBondContact O-N 3.3Å; M304-T306 VanDerWaalsContact O-N 3.14Å
307	E	85.4	Confident	90.1	Very high	45 Å²	45	44.7 Å²	44.7	21%	0.21	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-107	7.9	-174.3	-62.4	164.2	135.5	0	0	112.1	F263 F303 M304 S305 R309 S310 W311	F263-E307 WeakPolarHBondContact CA-OE1 3.4Å; F263-E307 HydrophobicContact CB-CB 4.41Å; F263-E307 HydrophobicContact CB-CG 4.47Å; F303-E307 HydrophobicContact CB-CB 4.07Å; F303-E307 HydrophobicContact CD1-CB 4.17Å; M304-E307 PolarHBondContact N-OE2 3.04Å; M304-E307 CarbonylContact O-C 3.49Å; M304-E307 WeakPolarHBondContact O-CA 3.44Å; M304-E307 PolarHBondContact O-N 3.11Å; S305-E307 PolarHBondContact O-N 2.99Å; E307-R309 PolarHBondContact O-N 3.35Å; E307-R309 VanDerWaalsContact O-N 3.11Å; E307-S310 WeakPolarHBondContact O-CB 3.5Å; E307-S310 PolarHBondContact O-N 2.75Å; E307-W311 PolarHBondContact O-N 2.93Å
308	K	87.9	Confident	90.1	Very high	78 Å²	78	42.3 Å²	42.3	34%	0.339	22%	0.22	S	C	.	.	H	α-helix	trans	-48.8	-41.3	-178.9	-176.3	-172.1	-172.9	-165.8	0	113.2	M304 S305 S310 W311 E312 Y350	M304-K308 PolarHBondContact O-N 3.05Å; S305-K308 WeakPolarHBondContact O-CB 3.25Å; S305-K308 PolarHBondContact O-N 3Å; K308-S310 VanDerWaalsContact C-N 3.3Å; K308-S310 PolarHBondContact O-N 2.87Å; K308-W311 WeakPolarHBondContact O-CB 3.44Å; K308-W311 PolarHBondContact O-N 3.23Å; K308-E312 WeakPolarHBondContact CE-OE1 3.14Å; K308-E312 HydrophobicContact CG-CG 4.32Å; K308-E312 IonicContact NZ-OE1 3.61Å; K308-E312 WeakPolarHBondContact O-CG 3.23Å; K308-E312 PolarHBondContact O-N 3.13Å; K308-Y350 HydrophobicContact CB-CE2 4.25Å; K308-Y350 HydrophobicContact CD-CE1 4.05Å; K308-Y350 WeakPolarHBondContact CD-OH 3.28Å; K308-Y350 WeakPolarHBondContact CE-OH 3.37Å; K308-Y350 HydrophobicContact CG-CD1 4.34Å; K308-Y350 HydrophobicContact CG-CE1 3.79Å; K308-Y350 HydrophobicContact CG-CE2 4.25Å
309	R	86.9	Confident	90	Very high	196 Å²	196	46.3 Å²	46.3	74%	0.74	24%	0.241	S	C	*	.	H	α-helix	trans	-62.3	-36.8	180	-175.5	175.7	-179.8	160.7	0.4	112.5	E307 T313	E307-R309 PolarHBondContact O-N 3.35Å; E307-R309 VanDerWaalsContact O-N 3.11Å; R309-T313 WeakPolarHBondContact O-CB 3.49Å; R309-T313 PolarHBondContact O-N 3.36Å; R309-T313 PolarHBondContact O-OG1 3.25Å
310	S	86.9	Confident	89.8	Confident	17 Å²	17	46.1 Å²	46.1	12%	0.119	24%	0.239	C	C	.	.	H	α-helix	trans	-68.4	-42.1	176.1	-58.9	0	0	0	0	110.6	F263 E307 K308 T313 E314	F263-S310 WeakPolarHBondContact CD1-OG 2.93Å; F263-S310 WeakPolarHBondContact CE1-OG 3.5Å; F263-S310 WeakPolarHBondContact CG-OG 3.22Å; E307-S310 WeakPolarHBondContact O-CB 3.5Å; E307-S310 PolarHBondContact O-N 2.75Å; K308-S310 VanDerWaalsContact C-N 3.3Å; K308-S310 PolarHBondContact O-N 2.87Å; S310-T313 PolarHBondContact O-N 3.38Å; S310-E314 WeakPolarHBondContact O-CB 3.18Å; S310-E314 PolarHBondContact O-N 2.9Å
311	W	91.4	Very high	89.6	Confident	24 Å²	24	49.7 Å²	49.7	9%	0.091	26%	0.262	C	S	.	.	H	α-helix	trans	-59.9	-47.9	172.6	175.4	82.1	0	0	0	112	F303 E307 K308 T313 E314 V315 A334 Q336 Y350 W351	F303-W311 HydrophobicContact CB-CB 4.18Å; F303-W311 HydrophobicContact CD1-CB 4Å; F303-W311 HydrophobicContact CD2-CB 3.84Å; F303-W311 AromaticContact CD2-CD1 3.6Å; F303-W311 HydrophobicContact CD2-CG 4.08Å; F303-W311 HydrophobicContact CE1-CB 4.31Å; F303-W311 HydrophobicContact CE2-CB 4.16Å; F303-W311 AromaticContact CE2-CD1 3.73Å; F303-W311 HydrophobicContact CE2-CG 4.37Å; F303-W311 HydrophobicContact CG-CB 3.77Å; F303-W311 HydrophobicContact CG-CG 4.44Å; F303-W311 HydrophobicContact CZ-CB 4.37Å; E307-W311 PolarHBondContact O-N 2.93Å; K308-W311 WeakPolarHBondContact O-CB 3.44Å; K308-W311 PolarHBondContact O-N 3.23Å; W311-T313 VanDerWaalsContact C-N 3.31Å; W311-T313 PolarHBondContact O-N 3.4Å; W311-E314 PolarHBondContact O-N 2.9Å; W311-V315 HydrophobicContact CD2-CG2 4.09Å; W311-V315 HydrophobicContact CG-CG2 4.28Å; W311-V315 HydrophobicContact CZ2-CG2 4.15Å; W311-V315 WeakPolarHBondContact O-CB 3.35Å; W311-V315 VanDerWaalsContact O-CG2 3.24Å; W311-V315 WeakPolarHBondContact O-CG2 3.47Å; W311-V315 PolarHBondContact O-N 2.85Å; W311-A334 HydrophobicContact CZ2-CB 3.84Å; W311-Q336 HydrophobicContact CH2-CG 3.97Å; W311-Q336 HydrophobicContact CZ2-CG 4.34Å; W311-Y350 AromaticContact CD2-CD1 3.83Å; W311-Y350 HydrophobicContact CD2-CD1 3.83Å; W311-Y350 HydrophobicContact CD2-CG 4.17Å; W311-Y350 AromaticContact CE3-CD1 3.53Å; W311-Y350 HydrophobicContact CE3-CD1 3.53Å; W311-Y350 HydrophobicContact CE3-CE1 4.24Å; W311-Y350 HydrophobicContact CE3-CG 4.25Å; W311-Y350 HydrophobicContact CG-CG 4.43Å; W311-Y350 HydrophobicContact CH2-CD1 4.09Å; W311-Y350 HydrophobicContact CZ2-CD1 4.31Å; W311-Y350 AromaticContact CZ3-CD1 3.69Å; W311-Y350 HydrophobicContact CZ3-CD1 3.69Å; W311-Y350 HydrophobicContact CZ3-CE1 4.17Å; W311-W351 PolarHBondContact NE1-O 2.76Å
312	E	89.4	Confident	89.5	Confident	88 Å²	88	49.5 Å²	49.5	41%	0.411	27%	0.265	S	S	.	.	H	α-helix	trans	-59.4	-42	177.3	-73	172.8	162.5	0	0	111.8	K308 A316	K308-E312 WeakPolarHBondContact CE-OE1 3.14Å; K308-E312 HydrophobicContact CG-CG 4.32Å; K308-E312 IonicContact NZ-OE1 3.61Å; K308-E312 WeakPolarHBondContact O-CG 3.23Å; K308-E312 PolarHBondContact O-N 3.13Å; E312-A316 WeakPolarHBondContact O-CB 3.3Å; E312-A316 PolarHBondContact O-N 2.7Å
313	T	87.7	Confident	89.6	Confident	46 Å²	46	49.3 Å²	49.3	28%	0.282	26%	0.264	S	S	.	.	H	α-helix	trans	-63.2	-47.7	178.5	-58.7	0	0	0	0	111.1	R309 S310 W311 A316 L317	R309-T313 WeakPolarHBondContact O-CB 3.49Å; R309-T313 PolarHBondContact O-N 3.36Å; R309-T313 PolarHBondContact O-OG1 3.25Å; S310-T313 PolarHBondContact O-N 3.38Å; W311-T313 VanDerWaalsContact C-N 3.31Å; W311-T313 PolarHBondContact O-N 3.4Å; T313-A316 PolarHBondContact O-N 2.93Å; T313-L317 WeakPolarHBondContact O-CB 3.22Å; T313-L317 PolarHBondContact O-N 3.27Å
314	E	92.2	Very high	89.6	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.019	29%	0.289	C	S	.	.	H	α-helix	trans	-68.8	-45.1	-177.5	-164.6	166.9	-175	0	0	111.6	K301 F303 S310 W311 A316 L317 F318 L352 F425	K301-E314 IonicContact NZ-OE1 3.6Å; K301-E314 PolarHBondContact NZ-OE1 3Å; K301-E314 IonicContact NZ-OE2 2.7Å; K301-E314 PolarHBondContact NZ-OE2 2.96Å; F303-E314 WeakPolarHBondContact CZ-OE2 3.43Å; S310-E314 WeakPolarHBondContact O-CB 3.18Å; S310-E314 PolarHBondContact O-N 2.9Å; W311-E314 PolarHBondContact O-N 2.9Å; E314-A316 PolarHBondContact O-N 2.82Å; E314-L317 PolarHBondContact O-N 3.36Å; E314-L317 VanDerWaalsContact O-N 3.12Å; E314-F318 HydrophobicContact CG-CD2 3.98Å; E314-F318 HydrophobicContact CG-CE2 3.64Å; E314-F318 VanDerWaalsContact O-CD2 3.27Å; E314-F318 WeakPolarHBondContact O-CD2 3.36Å; E314-F318 PolarHBondContact O-N 3.15Å; E314-L352 HydrophobicContact CB-CD1 3.94Å; E314-L352 HydrophobicContact CG-CD1 3.61Å; E314-F425 HydrophobicContact CG-CB 4.13Å; E314-F425 PolarHBondContact OE1-N 3.01Å
315	V	91.9	Very high	90	Very high	23 Å²	23	53.7 Å²	53.7	14%	0.139	28%	0.283	C	S	.	.	H	α-helix	trans	-60.2	-45.8	173.7	171.5	0	0	0	0	111	W311 L317 F318 N319 A334 L352	W311-V315 HydrophobicContact CD2-CG2 4.09Å; W311-V315 HydrophobicContact CG-CG2 4.28Å; W311-V315 HydrophobicContact CZ2-CG2 4.15Å; W311-V315 WeakPolarHBondContact O-CB 3.35Å; W311-V315 VanDerWaalsContact O-CG2 3.24Å; W311-V315 WeakPolarHBondContact O-CG2 3.47Å; W311-V315 PolarHBondContact O-N 2.85Å; V315-L317 PolarHBondContact O-N 3.07Å; V315-F318 PolarHBondContact O-N 3.1Å; V315-N319 PolarHBondContact O-N 3.25Å; V315-N319 PolarHBondContact O-ND2 3.45Å; V315-A334 HydrophobicContact CG1-CB 4.26Å; V315-A334 HydrophobicContact CG2-CB 3.47Å; V315-A334 VanDerWaalsContact CG2-CB 3.47Å; V315-L352 HydrophobicContact CG2-CD1 4.01Å
316	A	90.9	Very high	90.6	Very high	42 Å²	42	54.7 Å²	54.7	35%	0.347	28%	0.281	S	S	.	.	H	α-helix	trans	-58.3	-43.5	177.1	0	0	0	0	0	109.7	E312 T313 E314 N319 R430	E312-A316 WeakPolarHBondContact O-CB 3.3Å; E312-A316 PolarHBondContact O-N 2.7Å; T313-A316 PolarHBondContact O-N 2.93Å; E314-A316 PolarHBondContact O-N 2.82Å; A316-N319 PolarHBondContact O-N 2.81Å; A316-R430 VanDerWaalsContact CB-NH2 3.26Å; A316-R430 PolarHBondContact O-NH2 3.3Å
317	L	91.5	Very high	91.2	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.01	25%	0.25	C	C	.	.	H	α-helix	trans	-67	-45.7	-175	-168.7	149.1	0	0	0	111.1	T313 E314 V315 N319 V320 L323 I402 F425 A428	T313-L317 WeakPolarHBondContact O-CB 3.22Å; T313-L317 PolarHBondContact O-N 3.27Å; E314-L317 PolarHBondContact O-N 3.36Å; E314-L317 VanDerWaalsContact O-N 3.12Å; V315-L317 PolarHBondContact O-N 3.07Å; L317-N319 PolarHBondContact O-N 3.2Å; L317-N319 VanDerWaalsContact O-N 3.12Å; L317-V320 VanDerWaalsContact O-CB 3.3Å; L317-V320 WeakPolarHBondContact O-CB 3.32Å; L317-V320 VanDerWaalsContact O-CG2 3.26Å; L317-V320 WeakPolarHBondContact O-CG2 3.48Å; L317-V320 PolarHBondContact O-N 3.24Å; L317-L323 HydrophobicContact CD2-CD1 4.31Å; L317-L323 HydrophobicContact CD2-CD2 3.39Å; L317-L323 HydrophobicContact CG-CD2 4.43Å; L317-L323 WeakPolarHBondContact O-CD2 3.48Å; L317-I402 HydrophobicContact CD1-CG2 3.81Å; L317-I402 HydrophobicContact CG-CD1 4.35Å; L317-F425 HydrophobicContact CB-CB 4.42Å; L317-F425 HydrophobicContact CD1-CB 3.89Å; L317-F425 HydrophobicContact CD1-CD1 4.41Å; L317-F425 HydrophobicContact CD1-CG 4.39Å; L317-F425 HydrophobicContact CD2-CB 3.81Å; L317-F425 HydrophobicContact CD2-CD1 3.8Å; L317-F425 HydrophobicContact CD2-CD2 4.03Å; L317-F425 HydrophobicContact CD2-CE1 4.4Å; L317-F425 HydrophobicContact CD2-CG 3.6Å; L317-F425 HydrophobicContact CG-CB 4.27Å; L317-A428 HydrophobicContact CD1-CB 3.38Å
318	F	92.9	Very high	91.8	Very high	14 Å²	14	47.6 Å²	47.6	6%	0.061	24%	0.241	C	C	.	.	H	α-helix	trans	-57.8	-26	174.5	-78.8	-58.4	0	0	0	113.9	E314 V315 V320 L323 L329 Y331 L352 T354 F425	E314-F318 HydrophobicContact CG-CD2 3.98Å; E314-F318 HydrophobicContact CG-CE2 3.64Å; E314-F318 VanDerWaalsContact O-CD2 3.27Å; E314-F318 WeakPolarHBondContact O-CD2 3.36Å; E314-F318 PolarHBondContact O-N 3.15Å; V315-F318 PolarHBondContact O-N 3.1Å; F318-V320 VanDerWaalsContact C-N 3.33Å; F318-L323 HydrophobicContact CD1-CD2 4.34Å; F318-L329 WeakPolarHBondContact CE1-O 3.48Å; F318-Y331 HydrophobicContact CB-CD1 3.66Å; F318-Y331 HydrophobicContact CB-CD2 3.97Å; F318-Y331 HydrophobicContact CB-CE1 4.1Å; F318-Y331 HydrophobicContact CB-CE2 4.38Å; F318-Y331 HydrophobicContact CB-CG 3.58Å; F318-Y331 VanDerWaalsContact CD1-CB 3.46Å; F318-Y331 HydrophobicContact CD1-CG 4.09Å; F318-Y331 AromaticContact CD2-CD2 3.71Å; F318-Y331 HydrophobicContact CD2-CD2 3.71Å; F318-Y331 HydrophobicContact CD2-CE2 4.28Å; F318-Y331 HydrophobicContact CD2-CG 4.04Å; F318-Y331 HydrophobicContact CE2-CD2 4.28Å; F318-Y331 HydrophobicContact CG-CD1 4.27Å; F318-Y331 AromaticContact CG-CD2 3.84Å; F318-Y331 HydrophobicContact CG-CD2 3.84Å; F318-Y331 AromaticContact CG-CG 3.66Å; F318-Y331 HydrophobicContact CG-CG 3.66Å; F318-L352 HydrophobicContact CD2-CD1 4.02Å; F318-L352 HydrophobicContact CE2-CD1 3.98Å; F318-L352 HydrophobicContact CE2-CD2 3.98Å; F318-L352 HydrophobicContact CE2-CG 4.49Å; F318-T354 HydrophobicContact CE2-CG2 4.45Å; F318-T354 HydrophobicContact CZ-CG2 4.26Å; F318-F425 HydrophobicContact CD1-CD2 4.44Å; F318-F425 HydrophobicContact CD1-CE2 4.41Å; F318-F425 AromaticContact CE1-CD2 3.73Å; F318-F425 HydrophobicContact CE1-CD2 3.73Å; F318-F425 AromaticContact CE1-CE2 3.5Å; F318-F425 HydrophobicContact CE1-CE2 3.5Å; F318-F425 HydrophobicContact CE2-CD2 4.02Å; F318-F425 AromaticContact CZ-CD2 3.5Å; F318-F425 HydrophobicContact CZ-CD2 3.5Å; F318-F425 VanDerWaalsContact CZ-CD2 3.5Å; F318-F425 AromaticContact CZ-CE2 3.59Å; F318-F425 HydrophobicContact CZ-CE2 3.59Å
319	N	91.3	Very high	92.2	Very high	89 Å²	89	44.5 Å²	44.5	48%	0.476	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	4.6	176.6	-71.4	-56.6	0	0	0	114.4	V315 A316 L317 P321	V315-N319 PolarHBondContact O-N 3.25Å; V315-N319 PolarHBondContact O-ND2 3.45Å; A316-N319 PolarHBondContact O-N 2.81Å; L317-N319 PolarHBondContact O-N 3.2Å; L317-N319 VanDerWaalsContact O-N 3.12Å; N319-P321 WeakPolarHBondContact O-CD 3.47Å
320	V	90.7	Very high	92.6	Very high	5 Å²	5	38 Å²	38	3%	0.03	21%	0.206	C	C	.	.	S	Bend	trans	-68.6	124	173	173.8	0	0	0	0	109.1	L317 F318 G322 L323 K399 R430	L317-V320 VanDerWaalsContact O-CB 3.3Å; L317-V320 WeakPolarHBondContact O-CB 3.32Å; L317-V320 VanDerWaalsContact O-CG2 3.26Å; L317-V320 WeakPolarHBondContact O-CG2 3.48Å; L317-V320 PolarHBondContact O-N 3.24Å; F318-V320 VanDerWaalsContact C-N 3.33Å; V320-G322 PolarHBondContact O-N 2.95Å; V320-L323 HydrophobicContact CB-CB 4.32Å; V320-L323 VanDerWaalsContact O-CB 3.26Å; V320-L323 WeakPolarHBondContact O-CB 3.5Å; V320-L323 PolarHBondContact O-N 3.29Å; V320-K399 HydrophobicContact CG1-CB 4.46Å; V320-K399 HydrophobicContact CG1-CG 3.78Å; V320-R430 VanDerWaalsContact CG2-NE 3.3Å
321	P	90.9	Very high	92.8	Very high	74 Å²	74	39.1 Å²	39.1	48%	0.481	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	136.7	179.6	-16.4	28.1	0	0	0	111.9	N319 L323 L397 K399	N319-P321 WeakPolarHBondContact O-CD 3.47Å; P321-L323 VanDerWaalsContact C-N 3.28Å; P321-L323 PolarHBondContact O-N 2.94Å; P321-L397 WeakPolarHBondContact CB-O 3.43Å; P321-K399 WeakPolarHBondContact O-CB 3.49Å
322	G	92	Very high	92.7	Very high	12 Å²	12	43.1 Å²	43.1	12%	0.124	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.7	7.5	-179.5	0	0	0	0	0	114.2	V320 E324 H389 K399	V320-G322 PolarHBondContact O-N 2.95Å; G322-E324 VanDerWaalsContact C-N 3.3Å; G322-E324 PolarHBondContact N-OE2 3.05Å; G322-H389 PolarHBondContact O-CE1 3.49Å; G322-H389 PolarHBondContact O-NE2 3.15Å; G322-K399 VanDerWaalsContact O-CD 3.31Å; G322-K399 WeakPolarHBondContact O-CD 3.35Å
323	L	93.5	Very high	92.6	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.016	21%	0.208	C	C	.	.			trans	-71	-27.6	172.5	-176.6	67.4	0	0	0	112.2	L317 F318 V320 P321 H325 I328 H389 L390 I402	L317-L323 HydrophobicContact CD2-CD1 4.31Å; L317-L323 HydrophobicContact CD2-CD2 3.39Å; L317-L323 HydrophobicContact CG-CD2 4.43Å; L317-L323 WeakPolarHBondContact O-CD2 3.48Å; F318-L323 HydrophobicContact CD1-CD2 4.34Å; V320-L323 HydrophobicContact CB-CB 4.32Å; V320-L323 VanDerWaalsContact O-CB 3.26Å; V320-L323 WeakPolarHBondContact O-CB 3.5Å; V320-L323 PolarHBondContact O-N 3.29Å; P321-L323 VanDerWaalsContact C-N 3.28Å; P321-L323 PolarHBondContact O-N 2.94Å; L323-H325 PolarHBondContact O-N 3.47Å; L323-I328 HydrophobicContact CG-CG2 4.34Å; L323-H389 PolarHBondContact O-CD2 2.8Å; L323-H389 PolarHBondContact O-NE2 2.95Å; L323-L390 HydrophobicContact CD1-CD2 3.58Å; L323-I402 HydrophobicContact CD1-CD1 3.91Å
324	E	91.6	Very high	92.7	Very high	112 Å²	112	38 Å²	38	52%	0.523	20%	0.201	S	C	.	.			trans	-58.6	125.2	-176.1	-57.4	90	160.7	0	0	111.8	G322	G322-E324 VanDerWaalsContact C-N 3.3Å; G322-E324 PolarHBondContact N-OE2 3.05Å
325	H	95.5	Very high	92.5	Very high	64 Å²	64	38.7 Å²	38.7	30%	0.296	21%	0.206	S	C	.	.			trans	-160.9	149.7	-177.6	-174.2	-98.9	0	0	0	110.5	L323 N327 I328 H389	L323-H325 PolarHBondContact O-N 3.47Å; H325-N327 PolarHBondContact CE1-OD1 3.2Å; H325-N327 PolarHBondContact ND1-N 2.73Å; H325-N327 VanDerWaalsContact ND1-N 3.15Å; H325-N327 PolarHBondContact O-N 3.3Å; H325-N327 VanDerWaalsContact O-N 3.13Å; H325-I328 HydrophobicContact CB-CB 4.21Å; H325-I328 HydrophobicContact CB-CG1 3.85Å; H325-I328 PolarHBondContact O-N 3.48Å; H325-H389 VanDerWaalsContact CB-CD2 3.48Å; H325-H389 WeakPolarHBondContact CB-CD2 3.34Å; H325-H389 AromaticContact CD2-CG 3.95Å; H325-H389 AromaticContact CD2-ND1 3.95Å; H325-H389 AromaticContact CG-CD2 3.91Å; H325-H389 AromaticContact CG-CG 3.86Å
326	I	96.3	Very high	92.4	Very high	101 Å²	101	42.4 Å²	42.4	52%	0.518	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-31.3	-177.1	-169.8	171.6	0	0	0	113	K415 T419	I326-K415 WeakPolarHBondContact O-CE 3.23Å; I326-K415 PolarHBondContact O-NZ 3.46Å; I326-T419 HydrophobicContact CG1-CG2 4.34Å
327	N	98.5	Very high	92.1	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.011	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	18.2	177.9	-51.4	109.2	0	0	0	113.9	H325 G382 Q385 T419 A420 C421 I422	H325-N327 PolarHBondContact CE1-OD1 3.2Å; H325-N327 PolarHBondContact ND1-N 2.73Å; H325-N327 VanDerWaalsContact ND1-N 3.15Å; H325-N327 PolarHBondContact O-N 3.3Å; H325-N327 VanDerWaalsContact O-N 3.13Å; N327-G382 WeakPolarHBondContact CB-O 3.48Å; N327-G382 VanDerWaalsContact ND2-CA 3.26Å; N327-G382 WeakPolarHBondContact ND2-CA 3.3Å; N327-G382 PolarHBondContact ND2-O 2.98Å; N327-Q385 WeakPolarHBondContact OD1-CB 3.44Å; N327-Q385 PolarHBondContact OD1-OE1 3.38Å; N327-T419 WeakPolarHBondContact ND2-CG2 3.26Å; N327-A420 WeakPolarHBondContact CA-O 3.16Å; N327-A420 WeakPolarHBondContact CB-O 3.37Å; N327-A420 PolarHBondContact ND2-O 2.64Å; N327-C421 CarbonylContact O-C 3.49Å; N327-C421 VanDerWaalsContact O-CA 3.24Å; N327-C421 WeakPolarHBondContact O-CA 3.45Å; N327-I422 PolarHBondContact O-N 3.14Å
328	I	97.7	Very high	91.7	Very high	4 Å²	4	46.1 Å²	46.1	2%	0.021	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-120.7	136	170.1	-61.4	-60.2	0	0	0	107.5	L323 H325 Q330 L390 I422 F425	L323-I328 HydrophobicContact CG-CG2 4.34Å; H325-I328 HydrophobicContact CB-CB 4.21Å; H325-I328 HydrophobicContact CB-CG1 3.85Å; H325-I328 PolarHBondContact O-N 3.48Å; I328-Q330 PolarHBondContact O-N 3.16Å; I328-L390 HydrophobicContact CD1-CD1 3.88Å; I328-L390 HydrophobicContact CD1-CD2 3.89Å; I328-L390 HydrophobicContact CD1-CG 3.64Å; I328-I422 HydrophobicContact CD1-CB 4.1Å; I328-I422 HydrophobicContact CD1-CD1 4.42Å; I328-F425 HydrophobicContact CD1-CZ 4.42Å; I328-F425 HydrophobicContact CG2-CE2 4.24Å; I328-F425 HydrophobicContact CG2-CZ 3.86Å
329	L	96.8	Very high	91.1	Very high	12 Å²	12	47.5 Å²	47.5	6%	0.063	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-56.4	128.4	-178.7	178.8	59.2	0	0	0	110.5	F318 Y331 T354 E355 L413 I422 A423	F318-L329 WeakPolarHBondContact CE1-O 3.48Å; L329-Y331 PolarHBondContact O-N 3.06Å; L329-T354 HydrophobicContact CD2-CG2 3.78Å; L329-T354 HydrophobicContact CG-CG2 3.99Å; L329-E355 HydrophobicContact CD1-CB 4.45Å; L329-L413 HydrophobicContact CD1-CD1 3.96Å; L329-L413 HydrophobicContact CD2-CD1 4.07Å; L329-I422 WeakPolarHBondContact CB-O 3.37Å; L329-I422 PolarHBondContact N-O 3.43Å; L329-A423 HydrophobicContact CB-CB 4.14Å; L329-A423 HydrophobicContact CD2-CB 3.74Å
330	Q	94.1	Very high	90	Very high	60 Å²	60	49.5 Å²	49.5	28%	0.28	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-72.6	123.2	-179.4	-179.6	64.2	48.8	0	0	110.3	I328 Y332 T354 E355	I328-Q330 PolarHBondContact O-N 3.16Å; Q330-Y332 HydrophobicContact CG-CD1 4.22Å; Q330-Y332 HydrophobicContact CG-CE1 3.69Å; Q330-T354 CarbonylContact O-C 3.49Å; Q330-T354 WeakPolarHBondContact O-CA 3.4Å; Q330-T354 VanDerWaalsContact O-CB 3.25Å; Q330-T354 WeakPolarHBondContact O-CB 3.25Å; Q330-E355 HydrophobicContact CB-CB 3.93Å; Q330-E355 PolarHBondContact O-N 3Å
331	Y	92.2	Very high	88.5	Confident	41 Å²	41	52.6 Å²	52.6	16%	0.161	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	139.8	175.1	171.7	-109.7	0	0	0	111	F318 L329 G333 A334 L352 T354	F318-Y331 HydrophobicContact CB-CD1 3.66Å; F318-Y331 HydrophobicContact CB-CD2 3.97Å; F318-Y331 HydrophobicContact CB-CE1 4.1Å; F318-Y331 HydrophobicContact CB-CE2 4.38Å; F318-Y331 HydrophobicContact CB-CG 3.58Å; F318-Y331 VanDerWaalsContact CD1-CB 3.46Å; F318-Y331 HydrophobicContact CD1-CG 4.09Å; F318-Y331 AromaticContact CD2-CD2 3.71Å; F318-Y331 HydrophobicContact CD2-CD2 3.71Å; F318-Y331 HydrophobicContact CD2-CE2 4.28Å; F318-Y331 HydrophobicContact CD2-CG 4.04Å; F318-Y331 HydrophobicContact CE2-CD2 4.28Å; F318-Y331 HydrophobicContact CG-CD1 4.27Å; F318-Y331 AromaticContact CG-CD2 3.84Å; F318-Y331 HydrophobicContact CG-CD2 3.84Å; F318-Y331 AromaticContact CG-CG 3.66Å; F318-Y331 HydrophobicContact CG-CG 3.66Å; L329-Y331 PolarHBondContact O-N 3.06Å; Y331-G333 WeakPolarHBondContact CE2-O 3.37Å; Y331-G333 WeakPolarHBondContact OH-CA 3.23Å; Y331-A334 HydrophobicContact CE2-CB 4.28Å; Y331-A334 VanDerWaalsContact OH-CB 3.3Å; Y331-A334 WeakPolarHBondContact OH-CB 3.2Å; Y331-A334 PolarHBondContact OH-N 2.99Å; Y331-A334 VanDerWaalsContact OH-N 3.15Å; Y331-L352 HydrophobicContact CD2-CD2 4.45Å; Y331-L352 HydrophobicContact CD2-CG 4.31Å; Y331-L352 HydrophobicContact CE2-CG 4.09Å; Y331-T354 HydrophobicContact CD2-CG2 4.5Å
332	Y	88.6	Confident	86.9	Confident	107 Å²	107	55.5 Å²	55.5	42%	0.42	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	-33.7	177	-63	-36.9	0	0	0	112.8	V298 Q330 V353 T354 E355	V298-Y332 HydrophobicContact CB-CD2 4.49Å; V298-Y332 HydrophobicContact CG1-CD2 3.98Å; V298-Y332 HydrophobicContact CG1-CE2 3.85Å; Q330-Y332 HydrophobicContact CG-CD1 4.22Å; Q330-Y332 HydrophobicContact CG-CE1 3.69Å; Y332-V353 HydrophobicContact CD2-CG1 4.13Å; Y332-V353 PolarHBondContact N-O 3Å; Y332-T354 VanDerWaalsContact CD2-C 3.46Å; Y332-T354 WeakPolarHBondContact CD2-O 3.38Å; Y332-T354 VanDerWaalsContact CE2-C 3.46Å; Y332-T354 WeakPolarHBondContact CE2-O 3.21Å; Y332-E355 HydrophobicContact CE2-CB 4.17Å
333	G	87.4	Confident	85.4	Confident	9 Å²	9	62 Å²	62	9%	0.093	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.9	178.4	-179.7	0	0	0	0	0	113.1	Y331 V353	Y331-G333 WeakPolarHBondContact CE2-O 3.37Å; Y331-G333 WeakPolarHBondContact OH-CA 3.23Å; G333-V353 PolarHBondContact N-O 3.45Å; G333-V353 PolarHBondContact O-N 3.09Å
334	A	90.5	Very high	83.6	Confident	17 Å²	17	65.1 Å²	65.1	14%	0.14	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	151.5	178.4	0	0	0	0	0	109.6	W311 V315 Y331 W351	W311-A334 HydrophobicContact CZ2-CB 3.84Å; V315-A334 HydrophobicContact CG1-CB 4.26Å; V315-A334 HydrophobicContact CG2-CB 3.47Å; V315-A334 VanDerWaalsContact CG2-CB 3.47Å; Y331-A334 HydrophobicContact CE2-CB 4.28Å; Y331-A334 VanDerWaalsContact OH-CB 3.3Å; Y331-A334 WeakPolarHBondContact OH-CB 3.2Å; Y331-A334 PolarHBondContact OH-N 2.99Å; Y331-A334 VanDerWaalsContact OH-N 3.15Å; A334-W351 CarbonylContact C-O 3.55Å; A334-W351 WeakPolarHBondContact CA-O 3.31Å; A334-W351 VanDerWaalsContact CB-O 3.31Å; A334-W351 WeakPolarHBondContact CB-O 3.28Å
335	D	87.8	Confident	82.1	Confident	20 Å²	20	66.8 Å²	66.8	11%	0.107	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	159.4	-174	-152.2	-5.8	0	0	0	111.7	L248 C249 V337 W351	L248-D335 HydrophobicContact CB-CB 4.15Å; L248-D335 HydrophobicContact CD1-CB 4.35Å; L248-D335 PolarHBondContact N-OD2 3.5Å; C249-D335 PolarHBondContact N-OD2 3.37Å; D335-V337 HydrophobicContact CB-CG2 4.29Å; D335-W351 HydrophobicContact CB-CB 4.31Å; D335-W351 PolarHBondContact N-O 3.35Å; D335-W351 PolarHBondContact O-N 3.5Å
336	Q	89.1	Confident	80.8	Confident	100 Å²	100	69.4 Å²	69.4	47%	0.467	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	112.3	171.8	-65.7	-177.3	13.8	0	0	107.9	W311 L348 Y350	W311-Q336 HydrophobicContact CH2-CG 3.97Å; W311-Q336 HydrophobicContact CZ2-CG 4.34Å; Q336-L348 HydrophobicContact CB-CD1 4.33Å; Q336-Y350 HydrophobicContact CG-CD1 3.74Å; Q336-Y350 HydrophobicContact CG-CE1 3.87Å
337	V	85.6	Confident	80.1	Confident	16 Å²	16	68.3 Å²	68.3	10%	0.097	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	123.4	-170.8	-174.3	0	0	0	0	109.4	C249 D335 V339 E349 W351	C249-V337 HydrophobicContact CB-CG1 4.05Å; C249-V337 HydrophobicContact CB-CG2 3.64Å; D335-V337 HydrophobicContact CB-CG2 4.29Å; V337-V339 HydrophobicContact CG1-CG2 4.3Å; V337-E349 PolarHBondContact N-O 2.93Å; V337-E349 PolarHBondContact O-N 2.88Å; V337-W351 HydrophobicContact CB-CZ2 4.37Å; V337-W351 HydrophobicContact CG1-CZ2 4.14Å; V337-W351 HydrophobicContact CG2-CD2 3.72Å; V337-W351 HydrophobicContact CG2-CE3 4.33Å; V337-W351 HydrophobicContact CG2-CG 3.83Å; V337-W351 HydrophobicContact CG2-CZ2 4.08Å
338	I	82.9	Confident	79.5	Confident	107 Å²	107	71 Å²	71	55%	0.549	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	122.5	171.5	-60.4	171.2	0	0	0	107.6	D346 L348	I338-D346 HydrophobicContact CG2-CB 3.84Å; I338-L348 HydrophobicContact CG1-CD1 3.97Å
339	V	79	Confident	79.1	Confident	42 Å²	42	72 Å²	72	26%	0.255	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	113.1	176.6	-177.5	0	0	0	0	108.9	V337 N341 K347 E349	V337-V339 HydrophobicContact CG1-CG2 4.3Å; V339-N341 PolarHBondContact O-N 3.09Å; V339-N341 VanDerWaalsContact O-N 3.13Å; V339-K347 PolarHBondContact N-O 2.64Å; V339-K347 PolarHBondContact O-N 2.91Å; V339-E349 HydrophobicContact CG2-CB 4.5Å; V339-E349 HydrophobicContact CG2-CG 3.88Å
340	D	68.8	Low	78.8	Confident	131 Å²	131	72 Å²	72	70%	0.701	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.9	106.7	174.5	-62.8	-7.1	0	0	0	109.1
341	N	60.4	Low	78.7	Confident	70 Å²	70	69.8 Å²	69.8	37%	0.374	38%	0.379	S	S	.	.			trans	-84.9	142.1	169.2	-70	-35.6	0	0	0	109.4	V339 I343 G344 K347	V339-N341 PolarHBondContact O-N 3.09Å; V339-N341 VanDerWaalsContact O-N 3.13Å; N341-I343 PolarHBondContact O-N 3.31Å; N341-G344 PolarHBondContact O-N 3.04Å; N341-K347 WeakPolarHBondContact ND2-CB 3.17Å
342	S	56.7	Low	78.7	Confident	136 Å²	136	68 Å²	68	95%	0.951	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	2.5	177.3	33.6	0	0	0	0	115.3
343	I	61.3	Low	78.9	Confident	149 Å²	149	62.9 Å²	62.9	76%	0.764	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-3.4	177.2	-56.2	172.6	0	0	0	111.4	N341	N341-I343 PolarHBondContact O-N 3.31Å
344	G	53.9	Low	79.2	Confident	67 Å²	67	62.9 Å²	62.9	69%	0.691	35%	0.35	S	S	*	.	S	Bend	trans	82.4	12.3	175.5	0	0	0	0	0	114.9	N341	N341-G344 PolarHBondContact O-N 3.04Å
345	E	61.7	Low	79.3	Confident	148 Å²	148	64.8 Å²	64.8	69%	0.692	36%	0.356	S	S	*	.			trans	-108.7	111.3	169.9	-70.2	-177	178.3	0	0	109.5	K347	E345-K347 PolarHBondContact O-N 2.99Å; E345-K347 VanDerWaalsContact O-N 3.16Å
346	D	68.5	Low	79.7	Confident	118 Å²	118	66 Å²	66	63%	0.631	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.2	112.8	173.3	-68	-2.5	0	0	0	109.3	I338	I338-D346 HydrophobicContact CG2-CB 3.84Å
347	K	80	Confident	80	Confident	79 Å²	79	61.9 Å²	61.9	34%	0.343	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	118.2	176.3	-174.8	-179.9	-179.8	-173.6	0	109.3	V339 N341 E345	V339-K347 PolarHBondContact N-O 2.64Å; V339-K347 PolarHBondContact O-N 2.91Å; N341-K347 WeakPolarHBondContact ND2-CB 3.17Å; E345-K347 PolarHBondContact O-N 2.99Å; E345-K347 VanDerWaalsContact O-N 3.16Å
348	L	85.9	Confident	80.4	Confident	59 Å²	59	65.6 Å²	65.6	31%	0.309	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	118.9	174.3	-169.8	63.5	0	0	0	110.7	Q336 I338 Y350	Q336-L348 HydrophobicContact CB-CD1 4.33Å; I338-L348 HydrophobicContact CG1-CD1 3.97Å; L348-Y350 HydrophobicContact CD2-CE1 4.34Å; L348-Y350 HydrophobicContact CD2-CE2 3.97Å; L348-Y350 WeakPolarHBondContact CD2-OH 3.41Å; L348-Y350 HydrophobicContact CG-CE2 4.01Å
349	E	89.5	Confident	81	Confident	23 Å²	23	63 Å²	63	11%	0.107	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	139.5	172	-68.8	-172.4	166.2	0	0	110.3	K254 I302 V337 V339 W351	K254-E349 IonicContact NZ-OE1 2.94Å; K254-E349 PolarHBondContact NZ-OE1 3.33Å; K254-E349 IonicContact NZ-OE2 3.4Å; K254-E349 PolarHBondContact NZ-OE2 3.32Å; I302-E349 HydrophobicContact CG2-CB 3.89Å; I302-E349 HydrophobicContact CG2-CG 3.94Å; V337-E349 PolarHBondContact N-O 2.93Å; V337-E349 PolarHBondContact O-N 2.88Å; V339-E349 HydrophobicContact CG2-CB 4.5Å; V339-E349 HydrophobicContact CG2-CG 3.88Å; E349-W351 PolarHBondContact OE2-NE1 3.02Å
350	Y	91	Very high	81.8	Confident	14 Å²	14	61.9 Å²	61.9	6%	0.055	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	117.9	174.1	-60.9	-98.1	0	0	0	108.6	I302 F303 K308 W311 Q336 L348	I302-Y350 WeakPolarHBondContact CA-O 3.22Å; F303-Y350 WeakPolarHBondContact CD2-O 3.23Å; F303-Y350 PolarHBondContact N-O 2.94Å; F303-Y350 PolarHBondContact O-N 3.13Å; K308-Y350 HydrophobicContact CB-CE2 4.25Å; K308-Y350 HydrophobicContact CD-CE1 4.05Å; K308-Y350 WeakPolarHBondContact CD-OH 3.28Å; K308-Y350 WeakPolarHBondContact CE-OH 3.37Å; K308-Y350 HydrophobicContact CG-CD1 4.34Å; K308-Y350 HydrophobicContact CG-CE1 3.79Å; K308-Y350 HydrophobicContact CG-CE2 4.25Å; W311-Y350 AromaticContact CD2-CD1 3.83Å; W311-Y350 HydrophobicContact CD2-CD1 3.83Å; W311-Y350 HydrophobicContact CD2-CG 4.17Å; W311-Y350 AromaticContact CE3-CD1 3.53Å; W311-Y350 HydrophobicContact CE3-CD1 3.53Å; W311-Y350 HydrophobicContact CE3-CE1 4.24Å; W311-Y350 HydrophobicContact CE3-CG 4.25Å; W311-Y350 HydrophobicContact CG-CG 4.43Å; W311-Y350 HydrophobicContact CH2-CD1 4.09Å; W311-Y350 HydrophobicContact CZ2-CD1 4.31Å; W311-Y350 AromaticContact CZ3-CD1 3.69Å; W311-Y350 HydrophobicContact CZ3-CD1 3.69Å; W311-Y350 HydrophobicContact CZ3-CE1 4.17Å; Q336-Y350 HydrophobicContact CG-CD1 3.74Å; Q336-Y350 HydrophobicContact CG-CE1 3.87Å; L348-Y350 HydrophobicContact CD2-CE1 4.34Å; L348-Y350 HydrophobicContact CD2-CE2 3.97Å; L348-Y350 WeakPolarHBondContact CD2-OH 3.41Å; L348-Y350 HydrophobicContact CG-CE2 4.01Å
351	W	92.8	Very high	83.1	Confident	13 Å²	13	55.9 Å²	55.9	5%	0.049	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	140.4	-176.8	-71.8	26.8	0	0	0	110.5	C249 I252 K254 I300 K301 I302 W311 A334 D335 V337 E349	C249-W351 HydrophobicContact CB-CH2 4.16Å; C249-W351 HydrophobicContact CB-CZ3 4.18Å; I252-W351 HydrophobicContact CB-CZ3 4.4Å; I252-W351 HydrophobicContact CG2-CZ3 4.39Å; K254-W351 HydrophobicContact CD-CZ2 4.26Å; K254-W351 HydrophobicContact CG-CH2 4.09Å; K254-W351 HydrophobicContact CG-CZ2 4.29Å; I300-W351 HydrophobicContact CD1-CE3 4.4Å; I300-W351 HydrophobicContact CD1-CZ3 4.07Å; I300-W351 HydrophobicContact CG2-CB 4.19Å; I300-W351 HydrophobicContact CG2-CD2 3.62Å; I300-W351 HydrophobicContact CG2-CE3 3.52Å; I300-W351 HydrophobicContact CG2-CG 3.92Å; I300-W351 HydrophobicContact CG2-CZ3 4.21Å; K301-W351 CarbonylContact O-C 3.59Å; K301-W351 WeakPolarHBondContact O-CA 3.48Å; I302-W351 HydrophobicContact CG1-CG 4.49Å; W311-W351 PolarHBondContact NE1-O 2.76Å; A334-W351 CarbonylContact C-O 3.55Å; A334-W351 WeakPolarHBondContact CA-O 3.31Å; A334-W351 VanDerWaalsContact CB-O 3.31Å; A334-W351 WeakPolarHBondContact CB-O 3.28Å; D335-W351 HydrophobicContact CB-CB 4.31Å; D335-W351 PolarHBondContact N-O 3.35Å; D335-W351 PolarHBondContact O-N 3.5Å; V337-W351 HydrophobicContact CB-CZ2 4.37Å; V337-W351 HydrophobicContact CG1-CZ2 4.14Å; V337-W351 HydrophobicContact CG2-CD2 3.72Å; V337-W351 HydrophobicContact CG2-CE3 4.33Å; V337-W351 HydrophobicContact CG2-CG 3.83Å; V337-W351 HydrophobicContact CG2-CZ2 4.08Å; E349-W351 PolarHBondContact OE2-NE1 3.02Å
352	L	91.8	Very high	84.9	Confident	2 Å²	2	52.6 Å²	52.6	1%	0.01	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	123.3	167.6	-177.9	151.3	0	0	0	107.8	K301 F303 E314 V315 F318 Y331 T354	K301-L352 HydrophobicContact CB-CB 4.32Å; K301-L352 PolarHBondContact N-O 3.4Å; K301-L352 PolarHBondContact O-N 3.28Å; F303-L352 HydrophobicContact CE2-CB 3.98Å; E314-L352 HydrophobicContact CB-CD1 3.94Å; E314-L352 HydrophobicContact CG-CD1 3.61Å; V315-L352 HydrophobicContact CG2-CD1 4.01Å; F318-L352 HydrophobicContact CD2-CD1 4.02Å; F318-L352 HydrophobicContact CE2-CD1 3.98Å; F318-L352 HydrophobicContact CE2-CD2 3.98Å; F318-L352 HydrophobicContact CE2-CG 4.49Å; Y331-L352 HydrophobicContact CD2-CD2 4.45Å; Y331-L352 HydrophobicContact CD2-CG 4.31Å; Y331-L352 HydrophobicContact CE2-CG 4.09Å; L352-T354 HydrophobicContact CD2-CG2 3.52Å
353	V	92.9	Very high	86.8	Confident	1 Å²	1	48.3 Å²	48.3	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.8	-171.7	-171.9	0	0	0	0	109.7	L248 I252 V298 A299 Y332 G333	L248-V353 HydrophobicContact CD1-CB 4.5Å; L248-V353 HydrophobicContact CD1-CG2 3.96Å; I252-V353 HydrophobicContact CD1-CB 4.28Å; I252-V353 HydrophobicContact CD1-CG1 3.61Å; I252-V353 HydrophobicContact CD1-CG2 3.79Å; V298-V353 HydrophobicContact CB-CG1 3.99Å; V298-V353 HydrophobicContact CG1-CG1 4.48Å; V298-V353 HydrophobicContact CG2-CG1 4.08Å; A299-V353 CarbonylContact O-C 3.29Å; A299-V353 WeakPolarHBondContact O-CA 3.03Å; Y332-V353 HydrophobicContact CD2-CG1 4.13Å; Y332-V353 PolarHBondContact N-O 3Å; G333-V353 PolarHBondContact N-O 3.45Å; G333-V353 PolarHBondContact O-N 3.09Å
354	T	93.5	Very high	88.4	Confident	8 Å²	8	45 Å²	45	5%	0.049	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	171.8	-176.9	49.6	0	0	0	0	111.4	A299 F318 L329 Q330 Y331 Y332 L352	A299-T354 WeakPolarHBondContact CB-OG1 3.16Å; A299-T354 PolarHBondContact N-O 3.46Å; A299-T354 PolarHBondContact O-N 3.37Å; A299-T354 PolarHBondContact O-OG1 3.41Å; F318-T354 HydrophobicContact CE2-CG2 4.45Å; F318-T354 HydrophobicContact CZ-CG2 4.26Å; L329-T354 HydrophobicContact CD2-CG2 3.78Å; L329-T354 HydrophobicContact CG-CG2 3.99Å; Q330-T354 CarbonylContact O-C 3.49Å; Q330-T354 WeakPolarHBondContact O-CA 3.4Å; Q330-T354 VanDerWaalsContact O-CB 3.25Å; Q330-T354 WeakPolarHBondContact O-CB 3.25Å; Y331-T354 HydrophobicContact CD2-CG2 4.5Å; Y332-T354 VanDerWaalsContact CD2-C 3.46Å; Y332-T354 WeakPolarHBondContact CD2-O 3.38Å; Y332-T354 VanDerWaalsContact CE2-C 3.46Å; Y332-T354 WeakPolarHBondContact CE2-O 3.21Å; L352-T354 HydrophobicContact CD2-CG2 3.52Å
355	E	92.7	Very high	90.5	Very high	58 Å²	58	43 Å²	43	27%	0.271	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	135.3	169.5	-171.8	176.5	-170.2	0	0	111.2	L329 Q330 Y332 H357	L329-E355 HydrophobicContact CD1-CB 4.45Å; Q330-E355 HydrophobicContact CB-CB 3.93Å; Q330-E355 PolarHBondContact O-N 3Å; Y332-E355 HydrophobicContact CE2-CB 4.17Å; E355-H357 IonicContact OE1-CE1 2.67Å; E355-H357 IonicContact OE2-CE1 3.6Å; E355-H357 PolarHBondContact OE2-CE1 3.32Å; E355-H357 IonicContact OE2-NE2 3.74Å
356	Y	95	Very high	92.2	Very high	46 Å²	46	36 Å²	36	18%	0.18	19%	0.185	C	C	.	.			trans	-88.2	134.8	174.1	-178	-111.6	0	0	0	111	K258 L268 D297 A299 P358	K258-Y356 VanDerWaalsContact CE-OH 3.26Å; K258-Y356 WeakPolarHBondContact CE-OH 3.19Å; K258-Y356 HydrophobicContact CG-CE2 4.2Å; L268-Y356 HydrophobicContact CB-CE2 4.42Å; L268-Y356 HydrophobicContact CD1-CD1 3.64Å; L268-Y356 HydrophobicContact CD1-CD2 3.9Å; L268-Y356 HydrophobicContact CD1-CE1 3.76Å; L268-Y356 HydrophobicContact CD1-CE2 4.05Å; L268-Y356 HydrophobicContact CD1-CG 3.72Å; D297-Y356 HydrophobicContact CB-CD1 4.03Å; D297-Y356 HydrophobicContact CB-CG 4.5Å; A299-Y356 HydrophobicContact CB-CD2 4.27Å; Y356-P358 HydrophobicContact CD1-CG 4.1Å; Y356-P358 HydrophobicContact CE1-CB 4.16Å; Y356-P358 HydrophobicContact CE1-CG 3.85Å
357	H	95.5	Very high	93.4	Very high	12 Å²	12	34.4 Å²	34.4	6%	0.056	17%	0.174	C	C	.	.			trans	-120.8	108	177.5	-69.6	-34.5	0	0	0	110.2	E355 L359 G360 L414	E355-H357 IonicContact OE1-CE1 2.67Å; E355-H357 IonicContact OE2-CE1 3.6Å; E355-H357 PolarHBondContact OE2-CE1 3.32Å; E355-H357 IonicContact OE2-NE2 3.74Å; H357-L359 VanDerWaalsContact C-N 3.27Å; H357-L359 PolarHBondContact O-N 3.12Å; H357-G360 PolarHBondContact O-N 3.43Å; H357-L414 WeakPolarHBondContact CB-O 3.46Å
358	P	93.8	Very high	94.1	Very high	94 Å²	94	35.4 Å²	35.4	61%	0.61	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.3	-26.1	-174.1	-25.5	33.7	0	0	0	115.3	Y356 G360	Y356-P358 HydrophobicContact CD1-CG 4.1Å; Y356-P358 HydrophobicContact CE1-CB 4.16Å; Y356-P358 HydrophobicContact CE1-CG 3.85Å; P358-G360 PolarHBondContact O-N 2.88Å
359	L	95.8	Very high	94.5	Very high	52 Å²	52	38.1 Å²	38.1	27%	0.272	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-10	176	-62.8	-175.6	0	0	0	112.8	H357 Y365 L414 K415 L418	H357-L359 VanDerWaalsContact C-N 3.27Å; H357-L359 PolarHBondContact O-N 3.12Å; L359-Y365 HydrophobicContact CB-CD2 4.31Å; L359-Y365 HydrophobicContact CD1-CD2 4.4Å; L359-Y365 HydrophobicContact CD1-CE2 4.22Å; L359-Y365 HydrophobicContact CD2-CD2 4.48Å; L359-Y365 HydrophobicContact CD2-CE2 4.41Å; L359-L414 HydrophobicContact CB-CB 4.01Å; L359-L414 HydrophobicContact CD1-CB 4.23Å; L359-K415 VanDerWaalsContact CD1-O 3.29Å; L359-K415 WeakPolarHBondContact CD1-O 3.37Å; L359-L418 HydrophobicContact CD1-CD2 3.58Å
360	G	95.5	Very high	94.6	Very high	19 Å²	19	40.5 Å²	40.5	20%	0.196	21%	0.207	C	C	.	.			trans	69.7	-151.8	178.8	0	0	0	0	0	112.8	H357 P358 L413 L414	H357-G360 PolarHBondContact O-N 3.43Å; P358-G360 PolarHBondContact O-N 2.88Å; G360-L413 WeakPolarHBondContact O-CA 3.35Å; G360-L414 PolarHBondContact O-N 2.92Å
361	S	97.3	Very high	94.7	Very high	5 Å²	5	39.9 Å²	39.9	4%	0.035	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-79	162.3	176.7	68.2	0	0	0	0	112.3	Y363 D364 Y365 R410 V412	S361-Y363 PolarHBondContact O-N 3.24Å; S361-Y363 WeakPolarHBondContact OG-CB 3.46Å; S361-D364 WeakPolarHBondContact CB-OD2 3.49Å; S361-D364 PolarHBondContact N-OD2 2.9Å; S361-D364 PolarHBondContact O-N 3.5Å; S361-D364 VanDerWaalsContact O-N 3.09Å; S361-D364 PolarHBondContact OG-N 2.77Å; S361-D364 VanDerWaalsContact OG-N 3.13Å; S361-D364 PolarHBondContact OG-OD2 3.12Å; S361-Y365 WeakPolarHBondContact O-CB 3.43Å; S361-Y365 PolarHBondContact O-N 2.83Å; S361-R410 VanDerWaalsContact CB-O 3.23Å; S361-R410 WeakPolarHBondContact CB-O 3.38Å; S361-V412 CarbonylContact C-O 2.97Å; S361-V412 VanDerWaalsContact CA-O 3.22Å; S361-V412 WeakPolarHBondContact CA-O 3.34Å
362	V	98.2	Very high	94.7	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-54.6	-40.9	169.4	168.9	0	0	0	0	109.6	D364 Y365 L366 I379 S409 V412 L414 L481	V362-D364 PolarHBondContact O-N 3.02Å; V362-Y365 PolarHBondContact O-N 3.36Å; V362-L366 HydrophobicContact CG1-CD1 3.78Å; V362-L366 HydrophobicContact CG1-CG 3.99Å; V362-L366 WeakPolarHBondContact O-CB 3.2Å; V362-L366 WeakPolarHBondContact O-CG 3.24Å; V362-L366 PolarHBondContact O-N 2.96Å; V362-I379 HydrophobicContact CG2-CG2 4.22Å; V362-S409 WeakPolarHBondContact CB-O 3.44Å; V362-S409 PolarHBondContact N-O 3.22Å; V362-V412 HydrophobicContact CB-CB 4.44Å; V362-V412 HydrophobicContact CG2-CB 3.88Å; V362-V412 HydrophobicContact CG2-CG1 3.68Å; V362-V412 PolarHBondContact N-O 2.91Å; V362-L414 HydrophobicContact CG2-CD1 4.32Å; V362-L414 HydrophobicContact CG2-CD2 3.76Å; V362-L414 HydrophobicContact CG2-CG 3.93Å; V362-L481 HydrophobicContact CG1-CD2 3.72Å; V362-L481 HydrophobicContact CG1-CG 4.27Å
363	Y	96.9	Very high	94.8	Very high	47 Å²	47	44.1 Å²	44.1	18%	0.184	22%	0.224	C	C	.	.	H	α-helix	trans	-54.3	-53	173.6	178.6	-86.4	0	0	0	111.5	S361 Y365 L366 H367 S409 R410 Y500	S361-Y363 PolarHBondContact O-N 3.24Å; S361-Y363 WeakPolarHBondContact OG-CB 3.46Å; Y363-Y365 PolarHBondContact O-N 3.42Å; Y363-L366 PolarHBondContact O-N 2.94Å; Y363-H367 AromaticContact CD1-CE1 3.81Å; Y363-H367 AromaticContact CD1-ND1 3.98Å; Y363-H367 AromaticContact CD2-CE1 3.74Å; Y363-H367 AromaticContact CE1-CE1 3.34Å; Y363-H367 WeakPolarHBondContact CE1-CE1 3.45Å; Y363-H367 AromaticContact CE1-ND1 3.81Å; Y363-H367 AromaticContact CE1-NE2 3.81Å; Y363-H367 AromaticContact CE2-CE1 3.26Å; Y363-H367 WeakPolarHBondContact CE2-CE1 3.4Å; Y363-H367 AromaticContact CE2-NE2 3.92Å; Y363-H367 AromaticContact CG-CE1 3.98Å; Y363-H367 AromaticContact CZ-CE1 3.01Å; Y363-H367 AromaticContact CZ-ND1 3.93Å; Y363-H367 AromaticContact CZ-NE2 3.36Å; Y363-H367 PolarHBondContact O-N 2.75Å; Y363-H367 PolarHBondContact O-ND1 3.21Å; Y363-H367 PolarHBondContact OH-CE1 3.25Å; Y363-H367 PolarHBondContact OH-NE2 2.95Å; Y363-S409 PolarHBondContact N-O 3.09Å; Y363-R410 HydrophobicContact CD1-CG 4.23Å; Y363-R410 HydrophobicContact CD2-CG 4.05Å; Y363-R410 VanDerWaalsContact CE1-CZ 3.43Å; Y363-R410 VanDerWaalsContact CE2-NH2 3.28Å; Y363-R410 HydrophobicContact CG-CG 3.71Å; Y363-R410 PolarHBondContact OH-NH2 3.27Å; Y363-Y500 HydrophobicContact CD2-CE1 4.12Å; Y363-Y500 HydrophobicContact CD2-CE2 4.33Å; Y363-Y500 AromaticContact CD2-CZ 3.66Å; Y363-Y500 VanDerWaalsContact CD2-OH 3.26Å; Y363-Y500 WeakPolarHBondContact CD2-OH 3.5Å; Y363-Y500 AromaticContact CE2-CE1 3.63Å; Y363-Y500 HydrophobicContact CE2-CE1 3.63Å; Y363-Y500 AromaticContact CE2-CZ 3.65Å; Y363-Y500 WeakPolarHBondContact CE2-OH 3.43Å
364	D	95.4	Very high	94.9	Very high	78 Å²	78	45.8 Å²	45.8	42%	0.417	23%	0.233	S	C	.	.	H	α-helix	trans	-63.2	-43	-178.6	-55.3	-45.5	0	0	0	111.6	S361 V362 L366 H367	S361-D364 WeakPolarHBondContact CB-OD2 3.49Å; S361-D364 PolarHBondContact N-OD2 2.9Å; S361-D364 PolarHBondContact O-N 3.5Å; S361-D364 VanDerWaalsContact O-N 3.09Å; S361-D364 PolarHBondContact OG-N 2.77Å; S361-D364 VanDerWaalsContact OG-N 3.13Å; S361-D364 PolarHBondContact OG-OD2 3.12Å; V362-D364 PolarHBondContact O-N 3.02Å; D364-L366 PolarHBondContact O-N 3.35Å; D364-H367 PolarHBondContact O-N 3.35Å
365	Y	97.1	Very high	95	Very high	27 Å²	27	47.9 Å²	47.9	11%	0.106	24%	0.244	C	C	.	.	H	α-helix	trans	-60.8	-46.7	178.8	-172.9	-86.6	0	0	0	111.8	L359 S361 V362 Y363 H367 V368 Y369 I371 L414 L418	L359-Y365 HydrophobicContact CB-CD2 4.31Å; L359-Y365 HydrophobicContact CD1-CD2 4.4Å; L359-Y365 HydrophobicContact CD1-CE2 4.22Å; L359-Y365 HydrophobicContact CD2-CD2 4.48Å; L359-Y365 HydrophobicContact CD2-CE2 4.41Å; S361-Y365 WeakPolarHBondContact O-CB 3.43Å; S361-Y365 PolarHBondContact O-N 2.83Å; V362-Y365 PolarHBondContact O-N 3.36Å; Y363-Y365 PolarHBondContact O-N 3.42Å; Y365-H367 VanDerWaalsContact C-N 3.25Å; Y365-H367 PolarHBondContact O-N 3.04Å; Y365-V368 PolarHBondContact O-N 3.45Å; Y365-V368 VanDerWaalsContact O-N 3.09Å; Y365-Y369 HydrophobicContact CD1-CD2 4.33Å; Y365-Y369 AromaticContact CD2-CD2 3.61Å; Y365-Y369 HydrophobicContact CD2-CD2 3.61Å; Y365-Y369 HydrophobicContact CD2-CE2 4.17Å; Y365-Y369 HydrophobicContact CD2-CG 4.45Å; Y365-Y369 HydrophobicContact CE1-CD2 4.26Å; Y365-Y369 HydrophobicContact CE1-CG 4.25Å; Y365-Y369 AromaticContact CE2-CD2 3.56Å; Y365-Y369 HydrophobicContact CE2-CD2 3.56Å; Y365-Y369 HydrophobicContact CE2-CE2 4.16Å; Y365-Y369 HydrophobicContact CE2-CG 4.04Å; Y365-Y369 HydrophobicContact CG-CD2 4.01Å; Y365-Y369 AromaticContact CZ-CD2 3.9Å; Y365-Y369 AromaticContact CZ-CG 3.93Å; Y365-Y369 PolarHBondContact O-N 2.87Å; Y365-I371 HydrophobicContact CD1-CD1 4.49Å; Y365-I371 HydrophobicContact CD1-CG1 4.4Å; Y365-I371 HydrophobicContact CE1-CD1 4.35Å; Y365-I371 HydrophobicContact CE1-CG1 3.85Å; Y365-L414 HydrophobicContact CD1-CD1 3.96Å; Y365-L414 HydrophobicContact CD2-CD1 3.75Å; Y365-L414 HydrophobicContact CE2-CD1 4.39Å; Y365-L414 HydrophobicContact CG-CD1 3.5Å; Y365-L414 VanDerWaalsContact CG-CD1 3.5Å; Y365-L418 HydrophobicContact CD2-CD2 4.4Å; Y365-L418 HydrophobicContact CE2-CD2 3.66Å
366	L	96.7	Very high	95.2	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-67.1	-22.6	-177.1	-71.9	-173.3	0	0	0	114	V362 Y363 D364 V368 I371 E480 L481 R484 Y500	V362-L366 HydrophobicContact CG1-CD1 3.78Å; V362-L366 HydrophobicContact CG1-CG 3.99Å; V362-L366 WeakPolarHBondContact O-CB 3.2Å; V362-L366 WeakPolarHBondContact O-CG 3.24Å; V362-L366 PolarHBondContact O-N 2.96Å; Y363-L366 PolarHBondContact O-N 2.94Å; D364-L366 PolarHBondContact O-N 3.35Å; L366-V368 VanDerWaalsContact C-N 3.28Å; L366-I371 HydrophobicContact CD2-CD1 3.26Å; L366-I371 HydrophobicContact CD2-CG1 3.98Å; L366-E480 HydrophobicContact CD1-CB 3.91Å; L366-L481 HydrophobicContact CD1-CD2 4.28Å; L366-L481 HydrophobicContact CD2-CD2 4.18Å; L366-R484 HydrophobicContact CB-CG 4.23Å; L366-R484 HydrophobicContact CD1-CG 4.41Å; L366-R484 HydrophobicContact CD2-CB 3.61Å; L366-R484 HydrophobicContact CD2-CG 3.78Å; L366-R484 HydrophobicContact CG-CG 4.36Å; L366-R484 PolarHBondContact O-NE 3.47Å; L366-R484 PolarHBondContact O-NH2 2.02Å; L366-Y500 HydrophobicContact CB-CD2 3.68Å; L366-Y500 HydrophobicContact CB-CE2 4.27Å; L366-Y500 HydrophobicContact CD1-CD2 4.19Å; L366-Y500 HydrophobicContact CD1-CE2 4.2Å
367	H	95	Very high	95.4	Very high	85 Å²	85	43 Å²	43	39%	0.394	22%	0.222	S	C	.	.	H	α-helix	trans	-71.8	-25.4	174.1	-77.2	65.2	0	0	0	112.6	Y363 D364 Y365 Y500	Y363-H367 AromaticContact CD1-CE1 3.81Å; Y363-H367 AromaticContact CD1-ND1 3.98Å; Y363-H367 AromaticContact CD2-CE1 3.74Å; Y363-H367 AromaticContact CE1-CE1 3.34Å; Y363-H367 WeakPolarHBondContact CE1-CE1 3.45Å; Y363-H367 AromaticContact CE1-ND1 3.81Å; Y363-H367 AromaticContact CE1-NE2 3.81Å; Y363-H367 AromaticContact CE2-CE1 3.26Å; Y363-H367 WeakPolarHBondContact CE2-CE1 3.4Å; Y363-H367 AromaticContact CE2-NE2 3.92Å; Y363-H367 AromaticContact CG-CE1 3.98Å; Y363-H367 AromaticContact CZ-CE1 3.01Å; Y363-H367 AromaticContact CZ-ND1 3.93Å; Y363-H367 AromaticContact CZ-NE2 3.36Å; Y363-H367 PolarHBondContact O-N 2.75Å; Y363-H367 PolarHBondContact O-ND1 3.21Å; Y363-H367 PolarHBondContact OH-CE1 3.25Å; Y363-H367 PolarHBondContact OH-NE2 2.95Å; D364-H367 PolarHBondContact O-N 3.35Å; Y365-H367 VanDerWaalsContact C-N 3.25Å; Y365-H367 PolarHBondContact O-N 3.04Å; H367-Y500 AromaticContact CE1-CD1 2.98Å; H367-Y500 WeakPolarHBondContact CE1-CD1 3.1Å; H367-Y500 AromaticContact CE1-CD2 3.95Å; H367-Y500 AromaticContact CE1-CE1 3.23Å; H367-Y500 WeakPolarHBondContact CE1-CE1 3.39Å; H367-Y500 AromaticContact CE1-CG 3.38Å; H367-Y500 AromaticContact CE1-CZ 3.78Å; H367-Y500 AromaticContact ND1-CD1 3.76Å; H367-Y500 AromaticContact ND1-CG 3.67Å; H367-Y500 AromaticContact NE2-CD1 3.22Å; H367-Y500 WeakPolarHBondContact NE2-CD1 3.14Å; H367-Y500 AromaticContact NE2-CE1 3.68Å; H367-Y500 AromaticContact NE2-CG 3.88Å
368	V	93.7	Very high	95.5	Very high	99 Å²	99	45.3 Å²	45.3	60%	0.6	23%	0.233	S	C	*	.	H	α-helix	trans	-106.3	-43.1	-172.6	-177.9	0	0	0	0	111.4	Y365 L366	Y365-V368 PolarHBondContact O-N 3.45Å; Y365-V368 VanDerWaalsContact O-N 3.09Å; L366-V368 VanDerWaalsContact C-N 3.28Å
369	Y	94.2	Very high	95.7	Very high	116 Å²	116	40.9 Å²	40.9	46%	0.455	20%	0.204	S	C	.	.			trans	-112.7	150.4	-169.8	-56.9	-75.7	0	0	0	111.8	Y365 R484	Y365-Y369 HydrophobicContact CD1-CD2 4.33Å; Y365-Y369 AromaticContact CD2-CD2 3.61Å; Y365-Y369 HydrophobicContact CD2-CD2 3.61Å; Y365-Y369 HydrophobicContact CD2-CE2 4.17Å; Y365-Y369 HydrophobicContact CD2-CG 4.45Å; Y365-Y369 HydrophobicContact CE1-CD2 4.26Å; Y365-Y369 HydrophobicContact CE1-CG 4.25Å; Y365-Y369 AromaticContact CE2-CD2 3.56Å; Y365-Y369 HydrophobicContact CE2-CD2 3.56Å; Y365-Y369 HydrophobicContact CE2-CE2 4.16Å; Y365-Y369 HydrophobicContact CE2-CG 4.04Å; Y365-Y369 HydrophobicContact CG-CD2 4.01Å; Y365-Y369 AromaticContact CZ-CD2 3.9Å; Y365-Y369 AromaticContact CZ-CG 3.93Å; Y365-Y369 PolarHBondContact O-N 2.87Å; Y369-R484 VanDerWaalsContact C-NH2 3.26Å; Y369-R484 PolarHBondContact O-NE 3.39Å; Y369-R484 PolarHBondContact O-NH2 3.28Å
370	D	92.9	Very high	95.8	Very high	73 Å²	73	38.4 Å²	38.4	39%	0.39	19%	0.191	S	C	.	.			trans	-85.5	168.9	156.8	56.9	1.7	0	0	0	110.3	C486 I497	D370-C486 HydrophobicContact CB-CB 4.13Å; D370-I497 HydrophobicContact CB-CD1 3.58Å
371	I	92.9	Very high	96	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.01	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-124.6	133.2	-176.1	-59.4	177.4	0	0	0	109.8	Y365 L366 D375 L376 I379 L481 R484 C485 C486	Y365-I371 HydrophobicContact CD1-CD1 4.49Å; Y365-I371 HydrophobicContact CD1-CG1 4.4Å; Y365-I371 HydrophobicContact CE1-CD1 4.35Å; Y365-I371 HydrophobicContact CE1-CG1 3.85Å; L366-I371 HydrophobicContact CD2-CD1 3.26Å; L366-I371 HydrophobicContact CD2-CG1 3.98Å; I371-D375 HydrophobicContact CG2-CB 3.85Å; I371-L376 HydrophobicContact CG2-CB 3.66Å; I371-I379 HydrophobicContact CD1-CD1 4.05Å; I371-L481 HydrophobicContact CD1-CD2 3.49Å; I371-L481 VanDerWaalsContact CD1-CD2 3.49Å; I371-R484 PolarHBondContact N-O 2.91Å; I371-C485 CarbonylContact O-C 3.6Å; I371-C485 VanDerWaalsContact O-CA 3.28Å; I371-C485 WeakPolarHBondContact O-CA 3.29Å; I371-C486 PolarHBondContact O-N 3.27Å; I371-C486 PolarHBondContact O-SG 3.24Å
372	Q	92.8	Very high	96	Very high	92 Å²	92	37.7 Å²	37.7	43%	0.43	18%	0.183	S	C	.	.			trans	-78.2	151.2	170	-55.2	-64.1	-44.3	0	0	110.7	I374 D375 L376 C486 C487	Q372-I374 VanDerWaalsContact C-N 3.32Å; Q372-I374 PolarHBondContact O-N 3.33Å; Q372-I374 VanDerWaalsContact O-N 3.12Å; Q372-D375 PolarHBondContact O-N 3.5Å; Q372-L376 PolarHBondContact O-N 3.36Å; Q372-C486 PolarHBondContact NE2-SG 3.36Å; Q372-C486 PolarHBondContact OE1-SG 3.41Å; Q372-C487 PolarHBondContact OE1-SG 3Å
373	W	93.8	Very high	96.1	Very high	11 Å²	11	37.7 Å²	37.7	4%	0.042	18%	0.183	C	C	.	.	H	α-helix	trans	-47.5	-46.1	-177.1	175.6	-116.8	0	0	0	115.2	L376 L377 G539 L540 L543 L571 S575	W373-L376 HydrophobicContact CZ3-CD2 4.18Å; W373-L376 WeakPolarHBondContact O-CB 2.98Å; W373-L376 PolarHBondContact O-N 3.4Å; W373-L377 HydrophobicContact CD2-CD1 4.32Å; W373-L377 HydrophobicContact CD2-CG 4.34Å; W373-L377 HydrophobicContact CH2-CD1 4.27Å; W373-L377 HydrophobicContact CH2-CD2 3.78Å; W373-L377 HydrophobicContact CH2-CG 4.11Å; W373-L377 HydrophobicContact CZ2-CD1 3.57Å; W373-L377 HydrophobicContact CZ2-CD2 3.93Å; W373-L377 HydrophobicContact CZ2-CG 3.9Å; W373-L377 HydrophobicContact CZ3-CD2 4.3Å; W373-L377 HydrophobicContact CZ3-CG 4.43Å; W373-L377 WeakPolarHBondContact O-CG 3.48Å; W373-L377 PolarHBondContact O-N 2.66Å; W373-L377 VanDerWaalsContact O-N 3.09Å; W373-G539 WeakPolarHBondContact CH2-O 3.31Å; W373-L540 HydrophobicContact CE3-CD2 4.04Å; W373-L540 HydrophobicContact CE3-CG 4.19Å; W373-L540 HydrophobicContact CZ3-CD2 3.6Å; W373-L540 HydrophobicContact CZ3-CG 3.84Å; W373-L543 HydrophobicContact CH2-CB 4.28Å; W373-L543 HydrophobicContact CZ3-CD2 4.28Å; W373-L571 HydrophobicContact CH2-CD2 4.08Å; W373-L571 HydrophobicContact CZ2-CD1 4.33Å; W373-L571 HydrophobicContact CZ2-CD2 4.08Å; W373-L571 HydrophobicContact CZ2-CG 4.15Å; W373-S575 PolarHBondContact NE1-OG 3.16Å
374	I	94.8	Very high	96.2	Very high	37 Å²	37	35.4 Å²	35.4	19%	0.19	17%	0.174	C	C	.	.	H	α-helix	trans	-67.9	-40.2	-179.8	-63.9	-55.5	0	0	0	112	Q372 L376 L377 K378 L572 S575 V576	Q372-I374 VanDerWaalsContact C-N 3.32Å; Q372-I374 PolarHBondContact O-N 3.33Å; Q372-I374 VanDerWaalsContact O-N 3.12Å; I374-L376 VanDerWaalsContact C-N 3.32Å; I374-L377 PolarHBondContact O-N 2.96Å; I374-K378 WeakPolarHBondContact O-CB 3.42Å; I374-K378 PolarHBondContact O-N 3.43Å; I374-L572 HydrophobicContact CG2-CD1 4.17Å; I374-S575 VanDerWaalsContact CD1-CB 3.5Å; I374-V576 HydrophobicContact CD1-CG2 4.11Å; I374-V576 HydrophobicContact CG2-CG2 4.44Å
375	D	95.9	Very high	96.3	Very high	52 Å²	52	34.9 Å²	34.9	28%	0.278	17%	0.169	S	C	.	.	H	α-helix	trans	-67.2	-37.9	178.4	-64.8	-38.5	0	0	0	110.8	I371 Q372 L377 K378 I379 L418	I371-D375 HydrophobicContact CG2-CB 3.85Å; Q372-D375 PolarHBondContact O-N 3.5Å; D375-L377 PolarHBondContact O-N 3.02Å; D375-K378 WeakPolarHBondContact O-CB 3.22Å; D375-K378 PolarHBondContact O-N 3.41Å; D375-I379 VanDerWaalsContact O-CG1 3.25Å; D375-I379 WeakPolarHBondContact O-CG1 3.43Å; D375-I379 PolarHBondContact O-N 3.21Å; D375-L418 HydrophobicContact CB-CD1 3.74Å
376	L	97.2	Very high	96.4	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-56.5	-53.4	172	-178.7	156.3	0	0	0	110.4	I371 Q372 W373 I374 K378 I379 C380 L481 M482 C485 L543	I371-L376 HydrophobicContact CG2-CB 3.66Å; Q372-L376 PolarHBondContact O-N 3.36Å; W373-L376 HydrophobicContact CZ3-CD2 4.18Å; W373-L376 WeakPolarHBondContact O-CB 2.98Å; W373-L376 PolarHBondContact O-N 3.4Å; I374-L376 VanDerWaalsContact C-N 3.32Å; L376-K378 VanDerWaalsContact C-N 3.27Å; L376-K378 PolarHBondContact O-N 3.48Å; L376-I379 PolarHBondContact O-N 2.96Å; L376-C380 WeakPolarHBondContact O-CB 3.39Å; L376-C380 PolarHBondContact O-N 3.42Å; L376-C380 PolarHBondContact O-SG 3.33Å; L376-C380 VanDerWaalsContact O-SG 3.33Å; L376-L481 HydrophobicContact CD1-CB 4.47Å; L376-L481 HydrophobicContact CG-CB 4.37Å; L376-M482 HydrophobicContact CD1-CG 4.24Å; L376-C485 HydrophobicContact CD1-CB 3.62Å; L376-C485 VanDerWaalsContact CD1-SG 3.6Å; L376-L543 HydrophobicContact CD2-CD2 3.29Å
377	L	97.7	Very high	96.5	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-63.3	-35.2	-180	-70.8	-177.5	0	0	0	111.9	W373 I374 D375 T381 L571 L572 S575	W373-L377 HydrophobicContact CD2-CD1 4.32Å; W373-L377 HydrophobicContact CD2-CG 4.34Å; W373-L377 HydrophobicContact CH2-CD1 4.27Å; W373-L377 HydrophobicContact CH2-CD2 3.78Å; W373-L377 HydrophobicContact CH2-CG 4.11Å; W373-L377 HydrophobicContact CZ2-CD1 3.57Å; W373-L377 HydrophobicContact CZ2-CD2 3.93Å; W373-L377 HydrophobicContact CZ2-CG 3.9Å; W373-L377 HydrophobicContact CZ3-CD2 4.3Å; W373-L377 HydrophobicContact CZ3-CG 4.43Å; W373-L377 WeakPolarHBondContact O-CG 3.48Å; W373-L377 PolarHBondContact O-N 2.66Å; W373-L377 VanDerWaalsContact O-N 3.09Å; I374-L377 PolarHBondContact O-N 2.96Å; D375-L377 PolarHBondContact O-N 3.02Å; L377-T381 WeakPolarHBondContact O-CB 3.49Å; L377-T381 PolarHBondContact O-N 3.39Å; L377-T381 PolarHBondContact O-OG1 2.8Å; L377-L571 HydrophobicContact CD1-CG 4Å; L377-L571 HydrophobicContact CD2-CD2 3.71Å; L377-L571 HydrophobicContact CD2-CG 4.01Å; L377-L572 HydrophobicContact CB-CB 4.21Å; L377-L572 HydrophobicContact CB-CD1 3.8Å; L377-L572 HydrophobicContact CB-CG 4.5Å; L377-L572 HydrophobicContact CD1-CB 4.33Å; L377-L572 HydrophobicContact CD1-CD1 4.36Å; L377-S575 WeakPolarHBondContact CD1-OG 3.35Å
378	K	97.7	Very high	96.7	Very high	62 Å²	62	30.5 Å²	30.5	27%	0.27	15%	0.153	S	C	.	.	H	α-helix	trans	-62.7	-48.2	175.2	-175.7	176.5	-179.1	175.9	0	111.3	I374 D375 L376 T381 G382 D417 T419	I374-K378 WeakPolarHBondContact O-CB 3.42Å; I374-K378 PolarHBondContact O-N 3.43Å; D375-K378 WeakPolarHBondContact O-CB 3.22Å; D375-K378 PolarHBondContact O-N 3.41Å; L376-K378 VanDerWaalsContact C-N 3.27Å; L376-K378 PolarHBondContact O-N 3.48Å; K378-T381 PolarHBondContact O-N 2.98Å; K378-G382 PolarHBondContact O-N 2.94Å; K378-D417 WeakPolarHBondContact CE-O 3.22Å; K378-D417 PolarHBondContact NZ-O 3.24Å; K378-D417 IonicContact NZ-OD2 3.27Å; K378-D417 PolarHBondContact NZ-OD2 3.46Å; K378-T419 VanDerWaalsContact CE-OG1 3.27Å; K378-T419 WeakPolarHBondContact CE-OG1 3.3Å
379	I	98.5	Very high	96.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-62.1	-50.8	177.7	-65.6	165.6	0	0	0	110	V362 I371 D375 L376 T381 G382 L383 L414 L418 A420 L481	V362-I379 HydrophobicContact CG2-CG2 4.22Å; I371-I379 HydrophobicContact CD1-CD1 4.05Å; D375-I379 VanDerWaalsContact O-CG1 3.25Å; D375-I379 WeakPolarHBondContact O-CG1 3.43Å; D375-I379 PolarHBondContact O-N 3.21Å; L376-I379 PolarHBondContact O-N 2.96Å; I379-T381 VanDerWaalsContact C-N 3.34Å; I379-T381 PolarHBondContact O-N 3.29Å; I379-G382 PolarHBondContact O-N 2.97Å; I379-L383 PolarHBondContact O-N 3.1Å; I379-L414 HydrophobicContact CD1-CD1 4.21Å; I379-L414 HydrophobicContact CD1-CD2 4.18Å; I379-L414 HydrophobicContact CG1-CD2 3.88Å; I379-L414 HydrophobicContact CG2-CD2 3.98Å; I379-L418 HydrophobicContact CG1-CB 4.27Å; I379-L418 WeakPolarHBondContact CG1-O 3.26Å; I379-A420 HydrophobicContact CG2-CB 4.18Å; I379-A420 WeakPolarHBondContact O-CB 3.32Å; I379-L481 HydrophobicContact CB-CD1 4.45Å; I379-L481 HydrophobicContact CB-CD2 4.48Å; I379-L481 HydrophobicContact CD1-CD2 4.29Å; I379-L481 HydrophobicContact CG2-CD1 3.68Å; I379-L481 HydrophobicContact CG2-CD2 3.82Å; I379-L481 HydrophobicContact CG2-CG 4.45Å
380	C	98.7	Very high	97	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-59.3	-43.7	179	-68.6	0	0	0	0	112	L376 L383 A384 F478 L481 L568	L376-C380 WeakPolarHBondContact O-CB 3.39Å; L376-C380 PolarHBondContact O-N 3.42Å; L376-C380 PolarHBondContact O-SG 3.33Å; L376-C380 VanDerWaalsContact O-SG 3.33Å; C380-L383 PolarHBondContact O-N 3.37Å; C380-A384 WeakPolarHBondContact O-CB 3.43Å; C380-A384 PolarHBondContact O-N 2.82Å; C380-F478 HydrophobicContact CB-CD1 3.98Å; C380-F478 HydrophobicContact CB-CE1 3.66Å; C380-F478 HydrophobicContact CB-CZ 4.08Å; C380-F478 VanDerWaalsContact SG-CD1 3.53Å; C380-L481 VanDerWaalsContact SG-CD1 3.53Å; C380-L568 HydrophobicContact CB-CD1 3.85Å; C380-L568 HydrophobicContact CB-CD2 4.33Å; C380-L568 WeakPolarHBondContact O-CD1 3.45Å
381	T	98.6	Very high	97.3	Very high	7 Å²	7	18.5 Å²	18.5	4%	0.043	9%	0.092	C	C	.	.	H	α-helix	trans	-63.8	-45.4	178.9	-59.8	0	0	0	0	110.9	L377 K378 I379 L383 A384 Q385 L568	L377-T381 WeakPolarHBondContact O-CB 3.49Å; L377-T381 PolarHBondContact O-N 3.39Å; L377-T381 PolarHBondContact O-OG1 2.8Å; K378-T381 PolarHBondContact O-N 2.98Å; I379-T381 VanDerWaalsContact C-N 3.34Å; I379-T381 PolarHBondContact O-N 3.29Å; T381-L383 PolarHBondContact O-N 3.05Å; T381-A384 PolarHBondContact O-N 3.09Å; T381-Q385 HydrophobicContact CG2-CG 4.34Å; T381-Q385 WeakPolarHBondContact O-CB 3.23Å; T381-Q385 VanDerWaalsContact O-CG 3.23Å; T381-Q385 WeakPolarHBondContact O-CG 3.29Å; T381-Q385 PolarHBondContact O-N 2.93Å; T381-L568 WeakPolarHBondContact OG1-CB 3.43Å
382	G	98.5	Very high	97.4	Very high	3 Å²	3	23.2 Å²	23.2	3%	0.031	12%	0.115	C	C	.	.	H	α-helix	trans	-61.8	-43.2	177.6	0	0	0	0	0	112.6	N327 K378 I379 Q385 G386	N327-G382 WeakPolarHBondContact CB-O 3.48Å; N327-G382 VanDerWaalsContact ND2-CA 3.26Å; N327-G382 WeakPolarHBondContact ND2-CA 3.3Å; N327-G382 PolarHBondContact ND2-O 2.98Å; K378-G382 PolarHBondContact O-N 2.94Å; I379-G382 PolarHBondContact O-N 2.97Å; G382-Q385 PolarHBondContact O-N 3.07Å; G382-G386 PolarHBondContact O-N 3.2Å
383	L	98.8	Very high	97.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-60.6	-48.6	175.3	175.9	54.3	0	0	0	111.6	I379 C380 T381 Q385 G386 L387 L407 V412 A420 I422 M474 V477 F478	I379-L383 PolarHBondContact O-N 3.1Å; C380-L383 PolarHBondContact O-N 3.37Å; T381-L383 PolarHBondContact O-N 3.05Å; L383-Q385 VanDerWaalsContact C-N 3.33Å; L383-Q385 PolarHBondContact O-N 3.2Å; L383-G386 PolarHBondContact O-N 3.43Å; L383-L387 PolarHBondContact O-N 3.47Å; L383-L407 HydrophobicContact CD1-CD1 4.21Å; L383-V412 HydrophobicContact CD1-CG1 4.21Å; L383-V412 HydrophobicContact CD1-CG2 3.59Å; L383-V412 HydrophobicContact CD2-CG2 4.18Å; L383-A420 HydrophobicContact CB-CB 4.39Å; L383-I422 HydrophobicContact CD1-CD1 4.04Å; L383-I422 HydrophobicContact CD1-CG1 3.83Å; L383-M474 HydrophobicContact CD2-CG 4.12Å; L383-M474 HydrophobicContact CG-CG 4.2Å; L383-M474 HydrophobicContact CG-SD 4.49Å; L383-V477 HydrophobicContact CD2-CB 4.12Å; L383-V477 HydrophobicContact CD2-CG1 3.69Å; L383-F478 HydrophobicContact CB-CE1 4.4Å; L383-F478 HydrophobicContact CD2-CD1 4.34Å; L383-F478 HydrophobicContact CD2-CE1 3.93Å; L383-F478 HydrophobicContact CG-CE1 4.34Å
384	A	98.8	Very high	97.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-61.2	-41	178.6	0	0	0	0	0	112.3	C380 T381 L387 A388 M474 F478 V564 T565 L568	C380-A384 WeakPolarHBondContact O-CB 3.43Å; C380-A384 PolarHBondContact O-N 2.82Å; T381-A384 PolarHBondContact O-N 3.09Å; A384-L387 PolarHBondContact O-N 3.13Å; A384-A388 WeakPolarHBondContact O-CB 3.3Å; A384-A388 PolarHBondContact O-N 3.22Å; A384-M474 HydrophobicContact CB-SD 4.16Å; A384-F478 HydrophobicContact CB-CZ 4.4Å; A384-V564 HydrophobicContact CB-CB 4.48Å; A384-V564 HydrophobicContact CB-CG1 4.01Å; A384-T565 WeakPolarHBondContact CB-OG1 3.43Å; A384-T565 PolarHBondContact O-OG1 3.24Å; A384-T565 VanDerWaalsContact O-OG1 3.13Å; A384-L568 HydrophobicContact CB-CD1 3.93Å
385	Q	98.7	Very high	97	Very high	67 Å²	67	27.2 Å²	27.2	31%	0.313	14%	0.143	S	C	.	.	H	α-helix	trans	-64.5	-44.3	176.6	-75.3	171.9	-16.6	0	0	111.9	N327 T381 G382 L383 A388 H389 T565	N327-Q385 WeakPolarHBondContact OD1-CB 3.44Å; N327-Q385 PolarHBondContact OD1-OE1 3.38Å; T381-Q385 HydrophobicContact CG2-CG 4.34Å; T381-Q385 WeakPolarHBondContact O-CB 3.23Å; T381-Q385 VanDerWaalsContact O-CG 3.23Å; T381-Q385 WeakPolarHBondContact O-CG 3.29Å; T381-Q385 PolarHBondContact O-N 2.93Å; G382-Q385 PolarHBondContact O-N 3.07Å; L383-Q385 VanDerWaalsContact C-N 3.33Å; L383-Q385 PolarHBondContact O-N 3.2Å; Q385-A388 PolarHBondContact O-N 3.33Å; Q385-H389 WeakPolarHBondContact O-CB 3.37Å; Q385-H389 PolarHBondContact O-N 3.15Å; Q385-T565 HydrophobicContact CG-CG2 3.49Å; Q385-T565 VanDerWaalsContact CG-CG2 3.49Å; Q385-T565 PolarHBondContact N-OG1 3.06Å
386	G	98.6	Very high	96.6	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.3	-45.6	175	0	0	0	0	0	111.9	G382 L383 H389 L390	G382-G386 PolarHBondContact O-N 3.2Å; L383-G386 PolarHBondContact O-N 3.43Å; G386-H389 PolarHBondContact O-N 2.92Å; G386-L390 PolarHBondContact O-N 3.03Å
387	L	98.8	Very high	96.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-68.7	-40.9	-179.5	-169.9	63.1	0	0	0	111.7	L383 A384 H389 L390 H391 L407 I422 D470 M474 A561	L383-L387 PolarHBondContact O-N 3.47Å; A384-L387 PolarHBondContact O-N 3.13Å; L387-H389 VanDerWaalsContact C-N 3.29Å; L387-H389 PolarHBondContact O-N 3.43Å; L387-L390 HydrophobicContact CD1-CD1 4.39Å; L387-L390 PolarHBondContact O-N 2.79Å; L387-H391 VanDerWaalsContact CD1-NE2 3.35Å; L387-H391 WeakPolarHBondContact CD1-NE2 3.48Å; L387-H391 WeakPolarHBondContact O-CB 3.45Å; L387-H391 PolarHBondContact O-CD2 2.94Å; L387-H391 VanDerWaalsContact O-CG 3.24Å; L387-H391 PolarHBondContact O-N 3.2Å; L387-L407 HydrophobicContact CD1-CD2 4.23Å; L387-L407 HydrophobicContact CD2-CD2 3.91Å; L387-I422 HydrophobicContact CB-CD1 3.94Å; L387-I422 HydrophobicContact CD1-CD1 4.29Å; L387-I422 VanDerWaalsContact N-CD1 3.31Å; L387-D470 HydrophobicContact CD1-CB 3.93Å; L387-D470 HydrophobicContact CD2-CB 4.1Å; L387-M474 HydrophobicContact CD2-CB 4.12Å; L387-M474 HydrophobicContact CD2-CE 4.28Å; L387-M474 HydrophobicContact CD2-CG 4.48Å; L387-M474 HydrophobicContact CD2-SD 3.75Å; L387-A561 HydrophobicContact CB-CB 4.09Å; L387-A561 HydrophobicContact CD2-CB 4.04Å; L387-A561 HydrophobicContact CG-CB 3.94Å
388	A	98.6	Very high	95.6	Very high	20 Å²	20	39.5 Å²	39.5	17%	0.165	22%	0.215	C	C	.	.	H	α-helix	trans	-59.7	-40.9	174.4	0	0	0	0	0	111.6	A384 Q385 H391 M392 A561	A384-A388 WeakPolarHBondContact O-CB 3.3Å; A384-A388 PolarHBondContact O-N 3.22Å; Q385-A388 PolarHBondContact O-N 3.33Å; A388-H391 PolarHBondContact O-N 2.9Å; A388-M392 VanDerWaalsContact O-CB 3.23Å; A388-M392 WeakPolarHBondContact O-CB 3.48Å; A388-M392 PolarHBondContact O-N 2.77Å; A388-A561 HydrophobicContact CB-CB 4.02Å
389	H	98.1	Very high	95.4	Very high	19 Å²	19	36.6 Å²	36.6	9%	0.088	20%	0.203	C	C	.	.	H	α-helix	trans	-64	-42.2	175.6	-177.9	71.6	0	0	0	112.6	G322 L323 H325 Q385 G386 L387 K399	G322-H389 PolarHBondContact O-CE1 3.49Å; G322-H389 PolarHBondContact O-NE2 3.15Å; L323-H389 PolarHBondContact O-CD2 2.8Å; L323-H389 PolarHBondContact O-NE2 2.95Å; H325-H389 VanDerWaalsContact CB-CD2 3.48Å; H325-H389 WeakPolarHBondContact CB-CD2 3.34Å; H325-H389 AromaticContact CD2-CG 3.95Å; H325-H389 AromaticContact CD2-ND1 3.95Å; H325-H389 AromaticContact CG-CD2 3.91Å; H325-H389 AromaticContact CG-CG 3.86Å; Q385-H389 WeakPolarHBondContact O-CB 3.37Å; Q385-H389 PolarHBondContact O-N 3.15Å; G386-H389 PolarHBondContact O-N 2.92Å; L387-H389 VanDerWaalsContact C-N 3.29Å; L387-H389 PolarHBondContact O-N 3.43Å; H389-K399 WeakPolarHBondContact O-CE 3.45Å; H389-K399 PolarHBondContact O-NZ 2.95Å
390	L	97.7	Very high	95.2	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.1	-48.3	173.1	-71.4	170.3	0	0	0	111.6	L323 I328 G386 L387 K399 I402 I422 F425	L323-L390 HydrophobicContact CD1-CD2 3.58Å; I328-L390 HydrophobicContact CD1-CD1 3.88Å; I328-L390 HydrophobicContact CD1-CD2 3.89Å; I328-L390 HydrophobicContact CD1-CG 3.64Å; G386-L390 PolarHBondContact O-N 3.03Å; L387-L390 HydrophobicContact CD1-CD1 4.39Å; L387-L390 PolarHBondContact O-N 2.79Å; L390-K399 PolarHBondContact O-NZ 3.46Å; L390-I402 CarbonylContact C-O 3.54Å; L390-I402 HydrophobicContact CB-CB 4.44Å; L390-I402 HydrophobicContact CD2-CB 4.4Å; L390-I402 HydrophobicContact CD2-CD1 4.47Å; L390-I402 HydrophobicContact CD2-CG2 4.32Å; L390-I402 PolarHBondContact O-N 2.98Å; L390-I422 HydrophobicContact CD1-CB 4.49Å; L390-I422 HydrophobicContact CD1-CD1 3.77Å; L390-I422 HydrophobicContact CD1-CG2 4.13Å; L390-F425 HydrophobicContact CD1-CE1 3.93Å; L390-F425 HydrophobicContact CD2-CE1 3.92Å
391	H	97.7	Very high	95	Very high	17 Å²	17	37.5 Å²	37.5	8%	0.079	21%	0.209	C	C	.	.	H	α-helix	trans	-69.6	-32.8	-175.1	-71.8	-165.6	0	0	0	113.2	L387 A388 S401 I402 L467 D470	L387-H391 VanDerWaalsContact CD1-NE2 3.35Å; L387-H391 WeakPolarHBondContact CD1-NE2 3.48Å; L387-H391 WeakPolarHBondContact O-CB 3.45Å; L387-H391 PolarHBondContact O-CD2 2.94Å; L387-H391 VanDerWaalsContact O-CG 3.24Å; L387-H391 PolarHBondContact O-N 3.2Å; A388-H391 PolarHBondContact O-N 2.9Å; H391-S401 WeakPolarHBondContact O-CB 3.47Å; H391-S401 PolarHBondContact O-OG 3.14Å; H391-I402 PolarHBondContact CD2-O 2.64Å; H391-I402 VanDerWaalsContact CD2-O 3.25Å; H391-L467 HydrophobicContact CB-CD1 4.28Å; H391-L467 HydrophobicContact CB-CD2 4.11Å; H391-L467 VanDerWaalsContact CD2-CD2 3.48Å; H391-L467 WeakPolarHBondContact CD2-CD2 3.42Å; H391-L467 PolarHBondContact CE1-O 3.15Å; H391-L467 VanDerWaalsContact CE1-O 3.22Å; H391-D470 IonicContact CD2-OD2 2.72Å; H391-D470 IonicContact CE1-OD2 3.53Å; H391-D470 IonicContact NE2-OD2 2.81Å; H391-D470 PolarHBondContact NE2-OD2 3.28Å
392	M	95.5	Very high	94.9	Very high	100 Å²	100	37.2 Å²	37.2	49%	0.493	21%	0.207	S	C	.	.	S	Bend	trans	-67.8	132.3	-178.2	-177.3	166.4	66.7	0	0	111.4	A388 I394 K399	A388-M392 VanDerWaalsContact O-CB 3.23Å; A388-M392 WeakPolarHBondContact O-CB 3.48Å; A388-M392 PolarHBondContact O-N 2.77Å; M392-I394 HydrophobicContact CE-CD1 3.79Å; M392-I394 HydrophobicContact CE-CG1 3.93Å; M392-I394 HydrophobicContact CG-CG1 4.19Å; M392-K399 WeakPolarHBondContact O-CE 3.4Å; M392-K399 PolarHBondContact O-NZ 2.94Å
393	E	93.8	Very high	94.7	Very high	106 Å²	106	37 Å²	37	50%	0.495	21%	0.205	S	C	.	.			trans	-83.4	133.6	168	-172.3	175.7	170.1	0	0	108.9	K463	E393-K463 IonicContact OE2-NZ 3.35Å
394	I	92	Very high	94.6	Very high	23 Å²	23	37 Å²	37	12%	0.118	21%	0.205	C	C	.	.	B	Isolated β-bridge	trans	-122.7	87.7	-179.6	-53	176	0	0	0	108.1	M392 N396 L397 S398 K399	M392-I394 HydrophobicContact CE-CD1 3.79Å; M392-I394 HydrophobicContact CE-CG1 3.93Å; M392-I394 HydrophobicContact CG-CG1 4.19Å; I394-N396 VanDerWaalsContact C-N 3.35Å; I394-N396 WeakPolarHBondContact CG2-OD1 3.34Å; I394-N396 PolarHBondContact O-N 3.32Å; I394-L397 HydrophobicContact CG2-CB 3.96Å; I394-L397 HydrophobicContact CG2-CD1 3.97Å; I394-L397 HydrophobicContact CG2-CG 3.95Å; I394-L397 CarbonylContact O-C 3.5Å; I394-L397 PolarHBondContact O-N 3.2Å; I394-L397 VanDerWaalsContact O-N 3.12Å; I394-S398 PolarHBondContact O-N 3.45Å; I394-S398 VanDerWaalsContact O-N 3.11Å; I394-K399 HydrophobicContact CB-CB 3.88Å; I394-K399 HydrophobicContact CD1-CD 3.92Å; I394-K399 HydrophobicContact CG1-CB 4.37Å; I394-K399 HydrophobicContact CG1-CD 4.37Å; I394-K399 PolarHBondContact N-O 2.83Å; I394-K399 PolarHBondContact O-N 2.81Å
395	P	87.1	Confident	94.4	Very high	96 Å²	96	38.3 Å²	38.3	62%	0.623	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-60.8	-37.8	-170.3	-26.8	35.6	0	0	0	114.3	L397 S398	P395-L397 PolarHBondContact O-N 3.37Å; P395-S398 PolarHBondContact O-N 2.84Å; P395-S398 VanDerWaalsContact O-N 3.08Å
396	N	87.5	Confident	94.2	Very high	132 Å²	132	35.5 Å²	35.5	71%	0.706	20%	0.197	S	C	*	.	G	3₁₀ helix	trans	-65.8	-22.7	178.7	56.6	-40.2	0	0	0	113.5	I394	I394-N396 VanDerWaalsContact C-N 3.35Å; I394-N396 WeakPolarHBondContact CG2-OD1 3.34Å; I394-N396 PolarHBondContact O-N 3.32Å
397	L	87.3	Confident	94.2	Very high	80 Å²	80	35.7 Å²	35.7	42%	0.419	20%	0.198	S	C	.	.	G	3₁₀ helix	trans	-104.6	4.3	174.1	-62	179.2	0	0	0	112.2	P321 I394 P395 K399	P321-L397 WeakPolarHBondContact CB-O 3.43Å; I394-L397 HydrophobicContact CG2-CB 3.96Å; I394-L397 HydrophobicContact CG2-CD1 3.97Å; I394-L397 HydrophobicContact CG2-CG 3.95Å; I394-L397 CarbonylContact O-C 3.5Å; I394-L397 PolarHBondContact O-N 3.2Å; I394-L397 VanDerWaalsContact O-N 3.12Å; P395-L397 PolarHBondContact O-N 3.37Å; L397-K399 PolarHBondContact O-N 2.07Å; L397-K399 VanDerWaalsContact O-N 3.15Å
398	S	87.6	Confident	94.1	Very high	97 Å²	97	35.9 Å²	35.9	68%	0.678	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	29.8	-172.3	-53.9	0	0	0	0	113.2	I394 P395 P400	I394-S398 PolarHBondContact O-N 3.45Å; I394-S398 VanDerWaalsContact O-N 3.11Å; P395-S398 PolarHBondContact O-N 2.84Å; P395-S398 VanDerWaalsContact O-N 3.08Å; S398-P400 VanDerWaalsContact O-CD 3.25Å; S398-P400 WeakPolarHBondContact O-CD 3.19Å
399	K	93.6	Very high	94.1	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.009	19%	0.191	C	C	.	.	B	Isolated β-bridge	trans	-83.5	111.9	175.3	-160	-164.8	78.1	64.1	0	108.8	V320 P321 G322 H389 L390 M392 I394 L397	V320-K399 HydrophobicContact CG1-CB 4.46Å; V320-K399 HydrophobicContact CG1-CG 3.78Å; P321-K399 WeakPolarHBondContact O-CB 3.49Å; G322-K399 VanDerWaalsContact O-CD 3.31Å; G322-K399 WeakPolarHBondContact O-CD 3.35Å; H389-K399 WeakPolarHBondContact O-CE 3.45Å; H389-K399 PolarHBondContact O-NZ 2.95Å; L390-K399 PolarHBondContact O-NZ 3.46Å; M392-K399 WeakPolarHBondContact O-CE 3.4Å; M392-K399 PolarHBondContact O-NZ 2.94Å; I394-K399 HydrophobicContact CB-CB 3.88Å; I394-K399 HydrophobicContact CD1-CD 3.92Å; I394-K399 HydrophobicContact CG1-CB 4.37Å; I394-K399 HydrophobicContact CG1-CD 4.37Å; I394-K399 PolarHBondContact N-O 2.83Å; I394-K399 PolarHBondContact O-N 2.81Å; L397-K399 PolarHBondContact O-N 2.07Å; L397-K399 VanDerWaalsContact O-N 3.15Å
400	P	94	Very high	94	Very high	15 Å²	15	40.2 Å²	40.2	10%	0.097	21%	0.211	C	C	.	.			trans	-68.7	165.3	172.2	30.7	-35	0	0	0	110.6	S398 R430 F431 E432	S398-P400 VanDerWaalsContact O-CD 3.25Å; S398-P400 WeakPolarHBondContact O-CD 3.19Å; P400-R430 HydrophobicContact CB-CB 4.39Å; P400-R430 HydrophobicContact CG-CB 3.87Å; P400-R430 HydrophobicContact CG-CG 4.22Å; P400-F431 WeakPolarHBondContact CB-O 3.31Å; P400-E432 HydrophobicContact CB-CG 4.37Å
401	S	95	Very high	94	Very high	4 Å²	4	41.1 Å²	41.1	3%	0.028	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	142.2	160	-68.1	0	0	0	0	109.6	H391 F431	H391-S401 WeakPolarHBondContact O-CB 3.47Å; H391-S401 PolarHBondContact O-OG 3.14Å; S401-F431 VanDerWaalsContact O-CD2 3.28Å; S401-F431 WeakPolarHBondContact O-CD2 3.33Å; S401-F431 PolarHBondContact O-N 3.46Å
402	I	95.2	Very high	94	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	130.4	-178.7	-58	176.3	0	0	0	108.3	L317 L323 L390 H391 A428 I429 R430	L317-I402 HydrophobicContact CD1-CG2 3.81Å; L317-I402 HydrophobicContact CG-CD1 4.35Å; L323-I402 HydrophobicContact CD1-CD1 3.91Å; L390-I402 CarbonylContact C-O 3.54Å; L390-I402 HydrophobicContact CB-CB 4.44Å; L390-I402 HydrophobicContact CD2-CB 4.4Å; L390-I402 HydrophobicContact CD2-CD1 4.47Å; L390-I402 HydrophobicContact CD2-CG2 4.32Å; L390-I402 PolarHBondContact O-N 2.98Å; H391-I402 PolarHBondContact CD2-O 2.64Å; H391-I402 VanDerWaalsContact CD2-O 3.25Å; I402-A428 HydrophobicContact CG2-CB 4.19Å; I402-I429 CarbonylContact C-O 3.49Å; I402-I429 VanDerWaalsContact CA-O 3.29Å; I402-I429 WeakPolarHBondContact CA-O 3.49Å; I402-R430 HydrophobicContact CG1-CG 4.26Å
403	A	95.4	Very high	94.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	134.9	167.6	0	0	0	0	0	109.6	R405 A428 I429 F431 F466 L467 D470	A403-R405 HydrophobicContact CB-CG 4.16Å; A403-A428 CarbonylContact O-C 3.5Å; A403-A428 WeakPolarHBondContact O-CA 3.45Å; A403-A428 VanDerWaalsContact O-CB 3.32Å; A403-A428 WeakPolarHBondContact O-CB 3.31Å; A403-I429 HydrophobicContact CB-CG1 3.98Å; A403-I429 PolarHBondContact N-O 2.98Å; A403-I429 PolarHBondContact O-N 3.34Å; A403-F431 HydrophobicContact CB-CE2 3.62Å; A403-F431 HydrophobicContact CB-CZ 3.72Å; A403-F466 HydrophobicContact CB-CB 3.73Å; A403-L467 HydrophobicContact CB-CD2 4.11Å; A403-D470 WeakPolarHBondContact CA-OD2 3.35Å
404	H	96	Very high	94.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.173	C	C	.	.			trans	-75.9	-44.1	-176.6	-170.5	-84	0	0	0	112.4	D406 L407 I422 A423 D424 F425 D470	H404-D406 PolarHBondContact CE1-O 3.42Å; H404-D406 PolarHBondContact ND1-N 2.89Å; H404-D406 PolarHBondContact ND1-O 2.88Å; H404-D406 PolarHBondContact O-N 2.74Å; H404-L407 PolarHBondContact ND1-N 3.43Å; H404-I422 VanDerWaalsContact CD2-CG2 3.43Å; H404-I422 WeakPolarHBondContact CD2-CG2 3.09Å; H404-A423 PolarHBondContact NE2-O 2.89Å; H404-D424 PolarHBondContact CE1-O 3.16Å; H404-D424 PolarHBondContact NE2-O 3.21Å; H404-F425 AromaticContact CD2-CD1 3.8Å; H404-F425 AromaticContact CD2-CE1 3.83Å; H404-D470 PolarHBondContact N-OD1 3.18Å; H404-D470 PolarHBondContact N-OD2 3Å
405	R	94.1	Very high	94.6	Very high	27 Å²	27	32.5 Å²	32.5	10%	0.102	17%	0.174	C	C	.	.	S	Bend	trans	67.5	-12.1	176.3	-56.3	-179.9	59.3	-154.9	7.1	117.6	A403 L427 I429 H441 F466 D470	A403-R405 HydrophobicContact CB-CG 4.16Å; R405-L427 WeakPolarHBondContact CD-O 3.41Å; R405-L427 PolarHBondContact NH1-O 3.48Å; R405-I429 HydrophobicContact CG-CG1 4.42Å; R405-H441 PolarHBondContact NH2-O 3.48Å; R405-F466 HydrophobicContact CG-CD1 4.15Å; R405-D470 PolarHBondContact N-OD1 3.49Å
406	D	95.5	Very high	95	Very high	8 Å²	8	33.3 Å²	33.3	4%	0.043	18%	0.182	C	C	.	.			trans	-133.5	41.9	170.4	-155.9	0.8	0	0	0	111.4	R262 H404 N408 N411 L427 G445 T446	R262-D406 IonicContact CZ-OD2 2.93Å; R262-D406 IonicContact NH1-OD2 3.92Å; R262-D406 PolarHBondContact NH1-OD2 3.27Å; H404-D406 PolarHBondContact CE1-O 3.42Å; H404-D406 PolarHBondContact ND1-N 2.89Å; H404-D406 PolarHBondContact ND1-O 2.88Å; H404-D406 PolarHBondContact O-N 2.74Å; D406-N408 PolarHBondContact O-N 2.72Å; D406-N408 PolarHBondContact O-ND2 3Å; D406-N408 VanDerWaalsContact O-ND2 3.09Å; D406-N408 PolarHBondContact OD1-ND2 3.01Å; D406-N411 PolarHBondContact O-ND2 3.42Å; D406-L427 HydrophobicContact CB-CD1 3.9Å; D406-G445 WeakPolarHBondContact OD1-CA 3.35Å; D406-T446 WeakPolarHBondContact OD1-CB 3.12Å; D406-T446 PolarHBondContact OD1-N 3.47Å; D406-T446 PolarHBondContact OD1-OG1 2.94Å
407	L	97.8	Very high	95.4	Very high	3 Å²	3	30.5 Å²	30.5	2%	0.016	17%	0.167	C	C	.	.			trans	-70	126.8	178.1	-169.1	70.5	0	0	0	109.2	L383 L387 H404 V412 I422 A473 M474	L383-L407 HydrophobicContact CD1-CD1 4.21Å; L387-L407 HydrophobicContact CD1-CD2 4.23Å; L387-L407 HydrophobicContact CD2-CD2 3.91Å; H404-L407 PolarHBondContact ND1-N 3.43Å; L407-V412 HydrophobicContact CD1-CG2 4.27Å; L407-I422 HydrophobicContact CD1-CD1 4.37Å; L407-I422 HydrophobicContact CD1-CG1 4.44Å; L407-I422 HydrophobicContact CD1-CG2 4.16Å; L407-A473 HydrophobicContact CB-CB 4.1Å; L407-A473 WeakPolarHBondContact O-CB 3.36Å; L407-M474 HydrophobicContact CD2-CB 3.86Å
408	N	97.5	Very high	95.8	Very high	4 Å²	4	27.6 Å²	27.6	2%	0.021	15%	0.151	C	C	.	.	S	Bend	trans	-164	171.7	178.2	62.1	66	0	0	0	109.4	D406 R410 N411 T446 Y449	D406-N408 PolarHBondContact O-N 2.72Å; D406-N408 PolarHBondContact O-ND2 3Å; D406-N408 VanDerWaalsContact O-ND2 3.09Å; D406-N408 PolarHBondContact OD1-ND2 3.01Å; N408-R410 PolarHBondContact O-N 3.06Å; N408-R410 VanDerWaalsContact O-N 3.16Å; N408-R410 WeakPolarHBondContact OD1-CA 3.11Å; N408-R410 VanDerWaalsContact OD1-CB 3.24Å; N408-R410 WeakPolarHBondContact OD1-CB 3.38Å; N408-R410 PolarHBondContact OD1-N 3.48Å; N408-N411 PolarHBondContact ND2-ND2 3.4Å; N408-N411 PolarHBondContact O-N 2.97Å; N408-N411 PolarHBondContact OD1-N 2.87Å; N408-T446 PolarHBondContact ND2-OG1 2.88Å; N408-Y449 HydrophobicContact CB-CD1 3.89Å; N408-Y449 HydrophobicContact CB-CD2 3.66Å; N408-Y449 HydrophobicContact CB-CE1 3.77Å; N408-Y449 HydrophobicContact CB-CE2 3.54Å; N408-Y449 HydrophobicContact CB-CG 3.83Å
409	S	97.7	Very high	96.3	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-62.8	-20	-177.1	55.6	0	0	0	0	115	V362 Y363 Y449 E480	V362-S409 WeakPolarHBondContact CB-O 3.44Å; V362-S409 PolarHBondContact N-O 3.22Å; Y363-S409 PolarHBondContact N-O 3.09Å; S409-Y449 PolarHBondContact OG-OH 3.37Å; S409-E480 WeakPolarHBondContact CB-OE2 3.43Å; S409-E480 PolarHBondContact OG-OE2 3.49Å
410	R	96.6	Very high	96.6	Very high	131 Å²	131	23.6 Å²	23.6	49%	0.494	12%	0.123	S	C	.	.	G	3₁₀ helix	trans	-78.5	-26.8	173.7	-57.5	177	-180	-80.4	1.5	112.7	S361 Y363 N408 V412	S361-R410 VanDerWaalsContact CB-O 3.23Å; S361-R410 WeakPolarHBondContact CB-O 3.38Å; Y363-R410 HydrophobicContact CD1-CG 4.23Å; Y363-R410 HydrophobicContact CD2-CG 4.05Å; Y363-R410 VanDerWaalsContact CE1-CZ 3.43Å; Y363-R410 VanDerWaalsContact CE2-NH2 3.28Å; Y363-R410 HydrophobicContact CG-CG 3.71Å; Y363-R410 PolarHBondContact OH-NH2 3.27Å; N408-R410 PolarHBondContact O-N 3.06Å; N408-R410 VanDerWaalsContact O-N 3.16Å; N408-R410 WeakPolarHBondContact OD1-CA 3.11Å; N408-R410 VanDerWaalsContact OD1-CB 3.24Å; N408-R410 WeakPolarHBondContact OD1-CB 3.38Å; N408-R410 PolarHBondContact OD1-N 3.48Å; R410-V412 VanDerWaalsContact C-N 3.34Å
411	N	97.3	Very high	96.7	Very high	18 Å²	18	22.9 Å²	22.9	10%	0.096	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-95.9	13.7	-177.9	-70.4	-9.7	0	0	0	112.9	D406 N408 A423	D406-N411 PolarHBondContact O-ND2 3.42Å; N408-N411 PolarHBondContact ND2-ND2 3.4Å; N408-N411 PolarHBondContact O-N 2.97Å; N408-N411 PolarHBondContact OD1-N 2.87Å; N411-A423 PolarHBondContact O-N 2.9Å
412	V	98.4	Very high	96.9	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	117.5	170.2	-176.5	0	0	0	0	107.4	S361 V362 L383 L407 R410 A420	S361-V412 CarbonylContact C-O 2.97Å; S361-V412 VanDerWaalsContact CA-O 3.22Å; S361-V412 WeakPolarHBondContact CA-O 3.34Å; V362-V412 HydrophobicContact CB-CB 4.44Å; V362-V412 HydrophobicContact CG2-CB 3.88Å; V362-V412 HydrophobicContact CG2-CG1 3.68Å; V362-V412 PolarHBondContact N-O 2.91Å; L383-V412 HydrophobicContact CD1-CG1 4.21Å; L383-V412 HydrophobicContact CD1-CG2 3.59Å; L383-V412 HydrophobicContact CD2-CG2 4.18Å; L407-V412 HydrophobicContact CD1-CG2 4.27Å; R410-V412 VanDerWaalsContact C-N 3.34Å; V412-A420 HydrophobicContact CG1-CB 3.84Å
413	L	98.2	Very high	97	Very high	34 Å²	34	23 Å²	23	18%	0.178	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	152.2	178.8	-57.1	179.5	0	0	0	111	L329 G360 A420 C421 A423	L329-L413 HydrophobicContact CD1-CD1 3.96Å; L329-L413 HydrophobicContact CD2-CD1 4.07Å; G360-L413 WeakPolarHBondContact O-CA 3.35Å; L413-A420 CarbonylContact O-C 3.58Å; L413-A420 WeakPolarHBondContact O-CA 3.32Å; L413-C421 PolarHBondContact N-O 3.28Å; L413-C421 PolarHBondContact O-N 3.35Å; L413-A423 HydrophobicContact CD1-CB 3.88Å; L413-A423 HydrophobicContact CG-CB 3.91Å
414	L	98.4	Very high	96.8	Very high	1 Å²	1	24 Å²	24	1%	0.005	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.5	176.8	-63.6	-177.7	0	0	0	111.1	H357 L359 G360 V362 Y365 I379 L418 A420	H357-L414 WeakPolarHBondContact CB-O 3.46Å; L359-L414 HydrophobicContact CB-CB 4.01Å; L359-L414 HydrophobicContact CD1-CB 4.23Å; G360-L414 PolarHBondContact O-N 2.92Å; V362-L414 HydrophobicContact CG2-CD1 4.32Å; V362-L414 HydrophobicContact CG2-CD2 3.76Å; V362-L414 HydrophobicContact CG2-CG 3.93Å; Y365-L414 HydrophobicContact CD1-CD1 3.96Å; Y365-L414 HydrophobicContact CD2-CD1 3.75Å; Y365-L414 HydrophobicContact CE2-CD1 4.39Å; Y365-L414 HydrophobicContact CG-CD1 3.5Å; Y365-L414 VanDerWaalsContact CG-CD1 3.5Å; I379-L414 HydrophobicContact CD1-CD1 4.21Å; I379-L414 HydrophobicContact CD1-CD2 4.18Å; I379-L414 HydrophobicContact CG1-CD2 3.88Å; I379-L414 HydrophobicContact CG2-CD2 3.98Å; L414-L418 HydrophobicContact CD1-CD2 4.16Å; L414-A420 HydrophobicContact CD2-CB 4.2Å
415	K	97.1	Very high	96.7	Very high	31 Å²	31	24 Å²	24	14%	0.135	13%	0.125	C	C	.	.			trans	-69	166.4	169.3	-58.5	-166.2	-175.1	-160.4	0	110.4	I326 L359 D417 L418 T419	I326-K415 WeakPolarHBondContact O-CE 3.23Å; I326-K415 PolarHBondContact O-NZ 3.46Å; L359-K415 VanDerWaalsContact CD1-O 3.29Å; L359-K415 WeakPolarHBondContact CD1-O 3.37Å; K415-D417 WeakPolarHBondContact CB-OD1 2.98Å; K415-D417 PolarHBondContact O-N 3.36Å; K415-L418 WeakPolarHBondContact O-CA 3.24Å; K415-L418 PolarHBondContact O-N 2.79Å; K415-T419 WeakPolarHBondContact CB-O 3.28Å; K415-T419 HydrophobicContact CD-CG2 4.48Å; K415-T419 WeakPolarHBondContact CG-O 3.42Å; K415-T419 PolarHBondContact N-O 3.05Å
416	S	94.9	Very high	96.3	Very high	113 Å²	113	23 Å²	23	79%	0.79	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	-23.8	179.8	54.5	0	0	0	0	114.5
417	D	95.4	Very high	96	Very high	73 Å²	73	23.7 Å²	23.7	39%	0.39	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.8	11.5	176.7	78	-33.6	0	0	0	113.4	K378 K415 T419	K378-D417 WeakPolarHBondContact CE-O 3.22Å; K378-D417 PolarHBondContact NZ-O 3.24Å; K378-D417 IonicContact NZ-OD2 3.27Å; K378-D417 PolarHBondContact NZ-OD2 3.46Å; K415-D417 WeakPolarHBondContact CB-OD1 2.98Å; K415-D417 PolarHBondContact O-N 3.36Å; D417-T419 PolarHBondContact O-N 3.46Å; D417-T419 WeakPolarHBondContact OD1-CB 3.37Å; D417-T419 PolarHBondContact OD1-N 2.72Å; D417-T419 PolarHBondContact OD1-OG1 3.25Å; D417-T419 PolarHBondContact OD2-OG1 3.04Å
418	L	97	Very high	95.8	Very high	18 Å²	18	23.9 Å²	23.9	9%	0.094	13%	0.129	C	C	.	.			trans	66.5	12.8	-173.8	-54.6	174.4	0	0	0	115.2	L359 Y365 D375 I379 L414 K415 A420	L359-L418 HydrophobicContact CD1-CD2 3.58Å; Y365-L418 HydrophobicContact CD2-CD2 4.4Å; Y365-L418 HydrophobicContact CE2-CD2 3.66Å; D375-L418 HydrophobicContact CB-CD1 3.74Å; I379-L418 HydrophobicContact CG1-CB 4.27Å; I379-L418 WeakPolarHBondContact CG1-O 3.26Å; L414-L418 HydrophobicContact CD1-CD2 4.16Å; K415-L418 WeakPolarHBondContact O-CA 3.24Å; K415-L418 PolarHBondContact O-N 2.79Å; L418-A420 PolarHBondContact O-N 3.09Å
419	T	97.4	Very high	95.4	Very high	15 Å²	15	25.2 Å²	25.2	9%	0.092	14%	0.135	C	C	.	.			trans	-65.8	124.8	166.5	-63.2	0	0	0	0	109.4	I326 N327 K378 K415 D417	I326-T419 HydrophobicContact CG1-CG2 4.34Å; N327-T419 WeakPolarHBondContact ND2-CG2 3.26Å; K378-T419 VanDerWaalsContact CE-OG1 3.27Å; K378-T419 WeakPolarHBondContact CE-OG1 3.3Å; K415-T419 WeakPolarHBondContact CB-O 3.28Å; K415-T419 HydrophobicContact CD-CG2 4.48Å; K415-T419 WeakPolarHBondContact CG-O 3.42Å; K415-T419 PolarHBondContact N-O 3.05Å; D417-T419 PolarHBondContact O-N 3.46Å; D417-T419 WeakPolarHBondContact OD1-CB 3.37Å; D417-T419 PolarHBondContact OD1-N 2.72Å; D417-T419 PolarHBondContact OD1-OG1 3.25Å; D417-T419 PolarHBondContact OD2-OG1 3.04Å
420	A	98.5	Very high	95.1	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	142.6	177.8	0	0	0	0	0	111.8	N327 I379 L383 V412 L413 L414 L418	N327-A420 WeakPolarHBondContact CA-O 3.16Å; N327-A420 WeakPolarHBondContact CB-O 3.37Å; N327-A420 PolarHBondContact ND2-O 2.64Å; I379-A420 HydrophobicContact CG2-CB 4.18Å; I379-A420 WeakPolarHBondContact O-CB 3.32Å; L383-A420 HydrophobicContact CB-CB 4.39Å; V412-A420 HydrophobicContact CG1-CB 3.84Å; L413-A420 CarbonylContact O-C 3.58Å; L413-A420 WeakPolarHBondContact O-CA 3.32Å; L414-A420 HydrophobicContact CD2-CB 4.2Å; L418-A420 PolarHBondContact O-N 3.09Å
421	C	98.1	Very high	94.8	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	141.3	167.3	62	0	0	0	0	112.3	N327 L413	N327-C421 CarbonylContact O-C 3.49Å; N327-C421 VanDerWaalsContact O-CA 3.24Å; N327-C421 WeakPolarHBondContact O-CA 3.45Å; L413-C421 PolarHBondContact N-O 3.28Å; L413-C421 PolarHBondContact O-N 3.35Å
422	I	98.5	Very high	94	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	136.8	-179.4	-57.8	175.5	0	0	0	110	N327 I328 L329 L383 L387 L390 H404 L407 F425	N327-I422 PolarHBondContact O-N 3.14Å; I328-I422 HydrophobicContact CD1-CB 4.1Å; I328-I422 HydrophobicContact CD1-CD1 4.42Å; L329-I422 WeakPolarHBondContact CB-O 3.37Å; L329-I422 PolarHBondContact N-O 3.43Å; L383-I422 HydrophobicContact CD1-CD1 4.04Å; L383-I422 HydrophobicContact CD1-CG1 3.83Å; L387-I422 HydrophobicContact CB-CD1 3.94Å; L387-I422 HydrophobicContact CD1-CD1 4.29Å; L387-I422 VanDerWaalsContact N-CD1 3.31Å; L390-I422 HydrophobicContact CD1-CB 4.49Å; L390-I422 HydrophobicContact CD1-CD1 3.77Å; L390-I422 HydrophobicContact CD1-CG2 4.13Å; H404-I422 VanDerWaalsContact CD2-CG2 3.43Å; H404-I422 WeakPolarHBondContact CD2-CG2 3.09Å; L407-I422 HydrophobicContact CD1-CD1 4.37Å; L407-I422 HydrophobicContact CD1-CG1 4.44Å; L407-I422 HydrophobicContact CD1-CG2 4.16Å; I422-F425 HydrophobicContact CG2-CE1 4Å; I422-F425 HydrophobicContact CG2-CZ 4.17Å
423	A	96.1	Very high	92.6	Very high	8 Å²	8	32.6 Å²	32.6	7%	0.066	19%	0.191	C	C	.	.			trans	-133.1	170.3	-178.8	0	0	0	0	0	111.6	L329 H404 N411 L413	L329-A423 HydrophobicContact CB-CB 4.14Å; L329-A423 HydrophobicContact CD2-CB 3.74Å; H404-A423 PolarHBondContact NE2-O 2.89Å; N411-A423 PolarHBondContact O-N 2.9Å; L413-A423 HydrophobicContact CD1-CB 3.88Å; L413-A423 HydrophobicContact CG-CB 3.91Å
424	D	93.1	Very high	90.8	Very high	20 Å²	20	35.1 Å²	35.1	11%	0.107	23%	0.225	C	C	.	.			trans	63.4	77.2	178.5	-159.5	-3.8	0	0	0	115.3	K301 H404 G426	K301-D424 VanDerWaalsContact NZ-CG 3.29Å; K301-D424 IonicContact NZ-OD1 2.67Å; K301-D424 PolarHBondContact NZ-OD1 3.42Å; K301-D424 IonicContact NZ-OD2 3.53Å; H404-D424 PolarHBondContact CE1-O 3.16Å; H404-D424 PolarHBondContact NE2-O 3.21Å; D424-G426 VanDerWaalsContact C-N 3.29Å; D424-G426 PolarHBondContact O-N 3.06Å; D424-G426 PolarHBondContact OD1-N 3.47Å
425	F	92.5	Very high	89.1	Confident	0 Å²	0	41 Å²	41	0%	0	25%	0.252	C	S	.	.			trans	-90.1	16.8	179.2	-53	-79.4	0	0	0	113.9	E314 L317 F318 I328 L390 H404 I422 L427 A428	E314-F425 HydrophobicContact CG-CB 4.13Å; E314-F425 PolarHBondContact OE1-N 3.01Å; L317-F425 HydrophobicContact CB-CB 4.42Å; L317-F425 HydrophobicContact CD1-CB 3.89Å; L317-F425 HydrophobicContact CD1-CD1 4.41Å; L317-F425 HydrophobicContact CD1-CG 4.39Å; L317-F425 HydrophobicContact CD2-CB 3.81Å; L317-F425 HydrophobicContact CD2-CD1 3.8Å; L317-F425 HydrophobicContact CD2-CD2 4.03Å; L317-F425 HydrophobicContact CD2-CE1 4.4Å; L317-F425 HydrophobicContact CD2-CG 3.6Å; L317-F425 HydrophobicContact CG-CB 4.27Å; F318-F425 HydrophobicContact CD1-CD2 4.44Å; F318-F425 HydrophobicContact CD1-CE2 4.41Å; F318-F425 AromaticContact CE1-CD2 3.73Å; F318-F425 HydrophobicContact CE1-CD2 3.73Å; F318-F425 AromaticContact CE1-CE2 3.5Å; F318-F425 HydrophobicContact CE1-CE2 3.5Å; F318-F425 HydrophobicContact CE2-CD2 4.02Å; F318-F425 AromaticContact CZ-CD2 3.5Å; F318-F425 HydrophobicContact CZ-CD2 3.5Å; F318-F425 VanDerWaalsContact CZ-CD2 3.5Å; F318-F425 AromaticContact CZ-CE2 3.59Å; F318-F425 HydrophobicContact CZ-CE2 3.59Å; I328-F425 HydrophobicContact CD1-CZ 4.42Å; I328-F425 HydrophobicContact CG2-CE2 4.24Å; I328-F425 HydrophobicContact CG2-CZ 3.86Å; L390-F425 HydrophobicContact CD1-CE1 3.93Å; L390-F425 HydrophobicContact CD2-CE1 3.92Å; H404-F425 AromaticContact CD2-CD1 3.8Å; H404-F425 AromaticContact CD2-CE1 3.83Å; I422-F425 HydrophobicContact CG2-CE1 4Å; I422-F425 HydrophobicContact CG2-CZ 4.17Å; F425-L427 PolarHBondContact O-N 3.15Å; F425-A428 HydrophobicContact CB-CB 4.07Å; F425-A428 HydrophobicContact CD1-CB 4.37Å; F425-A428 PolarHBondContact O-N 2.9Å; F425-A428 VanDerWaalsContact O-N 3.11Å
426	G	87	Confident	87	Confident	5 Å²	5	43.9 Å²	43.9	5%	0.052	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-16.5	-175.7	0	0	0	0	0	114.9	D424	D424-G426 VanDerWaalsContact C-N 3.29Å; D424-G426 PolarHBondContact O-N 3.06Å; D424-G426 PolarHBondContact OD1-N 3.47Å
427	L	89.1	Confident	85.4	Confident	23 Å²	23	40.4 Å²	40.4	12%	0.12	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-3	177.3	-71.3	-177	0	0	0	114.7	F263 R405 D406 F425 L444	F263-L427 HydrophobicContact CE2-CD2 4.22Å; F263-L427 HydrophobicContact CE2-CG 3.92Å; F263-L427 HydrophobicContact CZ-CD1 4.26Å; F263-L427 HydrophobicContact CZ-CD2 3.64Å; F263-L427 HydrophobicContact CZ-CG 3.76Å; R405-L427 WeakPolarHBondContact CD-O 3.41Å; R405-L427 PolarHBondContact NH1-O 3.48Å; D406-L427 HydrophobicContact CB-CD1 3.9Å; F425-L427 PolarHBondContact O-N 3.15Å; L427-L444 HydrophobicContact CD1-CB 4.33Å; L427-L444 HydrophobicContact CD2-CD1 4.08Å
428	A	92.1	Very high	83.3	Confident	7 Å²	7	46.6 Å²	46.6	6%	0.058	27%	0.265	C	S	.	.			trans	-69.3	150.3	-172.6	0	0	0	0	0	111.6	L317 I402 A403 F425	L317-A428 HydrophobicContact CD1-CB 3.38Å; I402-A428 HydrophobicContact CG2-CB 4.19Å; A403-A428 CarbonylContact O-C 3.5Å; A403-A428 WeakPolarHBondContact O-CA 3.45Å; A403-A428 VanDerWaalsContact O-CB 3.32Å; A403-A428 WeakPolarHBondContact O-CB 3.31Å; F425-A428 HydrophobicContact CB-CB 4.07Å; F425-A428 HydrophobicContact CD1-CB 4.37Å; F425-A428 PolarHBondContact O-N 2.9Å; F425-A428 VanDerWaalsContact O-N 3.11Å
429	I	90.4	Very high	81.1	Confident	32 Å²	32	53 Å²	53	16%	0.164	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	145.4	179.6	62.8	174.6	0	0	0	110.4	I402 A403 R405 F431 M437 F466	I402-I429 CarbonylContact C-O 3.49Å; I402-I429 VanDerWaalsContact CA-O 3.29Å; I402-I429 WeakPolarHBondContact CA-O 3.49Å; A403-I429 HydrophobicContact CB-CG1 3.98Å; A403-I429 PolarHBondContact N-O 2.98Å; A403-I429 PolarHBondContact O-N 3.34Å; R405-I429 HydrophobicContact CG-CG1 4.42Å; I429-F431 HydrophobicContact CD1-CE1 3.62Å; I429-F431 HydrophobicContact CD1-CE2 4.48Å; I429-F431 HydrophobicContact CD1-CZ 3.48Å; I429-F431 VanDerWaalsContact CD1-CZ 3.48Å; I429-F431 HydrophobicContact CG1-CE1 4.13Å; I429-F431 HydrophobicContact CG1-CE2 4.21Å; I429-F431 HydrophobicContact CG1-CZ 3.65Å; I429-M437 HydrophobicContact CD1-SD 4.46Å; I429-F466 HydrophobicContact CD1-CB 4.33Å; I429-F466 HydrophobicContact CD1-CD1 3.72Å; I429-F466 HydrophobicContact CD1-CD2 3.92Å; I429-F466 HydrophobicContact CD1-CE1 3.9Å; I429-F466 HydrophobicContact CD1-CE2 4.11Å; I429-F466 HydrophobicContact CD1-CG 3.74Å; I429-F466 HydrophobicContact CD1-CZ 4.1Å
430	R	90.8	Very high	79.2	Confident	68 Å²	68	53.2 Å²	53.2	26%	0.257	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	142.6	174.6	-52.6	-175.7	-158.4	159.3	8.2	109.5	A316 V320 P400 I402	A316-R430 VanDerWaalsContact CB-NH2 3.26Å; A316-R430 PolarHBondContact O-NH2 3.3Å; V320-R430 VanDerWaalsContact CG2-NE 3.3Å; P400-R430 HydrophobicContact CB-CB 4.39Å; P400-R430 HydrophobicContact CG-CB 3.87Å; P400-R430 HydrophobicContact CG-CG 4.22Å; I402-R430 HydrophobicContact CG1-CG 4.26Å
431	F	89.5	Confident	77.6	Confident	23 Å²	23	59.8 Å²	59.8	10%	0.101	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	92.1	174.7	-53.8	-80.4	0	0	0	109	P400 S401 A403 I429 M437 K463 F466 L467	P400-F431 WeakPolarHBondContact CB-O 3.31Å; S401-F431 VanDerWaalsContact O-CD2 3.28Å; S401-F431 WeakPolarHBondContact O-CD2 3.33Å; S401-F431 PolarHBondContact O-N 3.46Å; A403-F431 HydrophobicContact CB-CE2 3.62Å; A403-F431 HydrophobicContact CB-CZ 3.72Å; I429-F431 HydrophobicContact CD1-CE1 3.62Å; I429-F431 HydrophobicContact CD1-CE2 4.48Å; I429-F431 HydrophobicContact CD1-CZ 3.48Å; I429-F431 VanDerWaalsContact CD1-CZ 3.48Å; I429-F431 HydrophobicContact CG1-CE1 4.13Å; I429-F431 HydrophobicContact CG1-CE2 4.21Å; I429-F431 HydrophobicContact CG1-CZ 3.65Å; F431-M437 HydrophobicContact CD1-CE 4.23Å; F431-M437 HydrophobicContact CD1-SD 3.38Å; F431-M437 WeakPolarHBondContact CD1-SD 3.39Å; F431-M437 HydrophobicContact CE1-CE 3.93Å; F431-M437 HydrophobicContact CE1-SD 3.25Å; F431-M437 WeakPolarHBondContact CE1-SD 3.29Å; F431-K463 HydrophobicContact CB-CB 4.3Å; F431-K463 HydrophobicContact CB-CD 3.99Å; F431-K463 HydrophobicContact CB-CG 4.08Å; F431-K463 HydrophobicContact CD1-CB 3.86Å; F431-K463 HydrophobicContact CD1-CG 4.13Å; F431-K463 HydrophobicContact CD2-CB 4.34Å; F431-K463 HydrophobicContact CD2-CD 4.23Å; F431-K463 HydrophobicContact CD2-CG 3.69Å; F431-K463 HydrophobicContact CE1-CB 4.29Å; F431-K463 HydrophobicContact CE2-CG 4.16Å; F431-K463 HydrophobicContact CG-CB 3.9Å; F431-K463 HydrophobicContact CG-CD 4.15Å; F431-K463 HydrophobicContact CG-CG 3.69Å; F431-F466 HydrophobicContact CE1-CB 4.22Å; F431-F466 AromaticContact CE1-CD2 3.97Å; F431-F466 HydrophobicContact CE1-CD2 3.97Å; F431-F466 HydrophobicContact CE1-CG 4.35Å; F431-F466 HydrophobicContact CE2-CB 4.48Å; F431-F466 HydrophobicContact CZ-CB 3.54Å; F431-F466 HydrophobicContact CZ-CD2 4.13Å; F431-F466 HydrophobicContact CZ-CG 4.04Å; F431-L467 HydrophobicContact CE2-CD2 3.97Å
432	E	81.1	Confident	76	Confident	102 Å²	102	62.2 Å²	62.2	48%	0.477	35%	0.346	S	S	.	.			trans	-91.7	146.1	174.8	-66	-179.7	-171.6	0	0	111	P400 G434 Q435	P400-E432 HydrophobicContact CB-CG 4.37Å; E432-G434 PolarHBondContact O-N 3.49Å; E432-G434 VanDerWaalsContact O-N 3.15Å; E432-Q435 PolarHBondContact O-N 3.09Å
433	A	69.6	Low	74.7	Confident	111 Å²	111	65.3 Å²	65.3	92%	0.917	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	119.4	179.1	0	0	0	0	0	110.9
434	G	59.5	Low	73.7	Confident	87 Å²	87	67 Å²	67	90%	0.897	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.8	-0.9	176.6	0	0	0	0	0	115.7	E432	E432-G434 PolarHBondContact O-N 3.49Å; E432-G434 VanDerWaalsContact O-N 3.15Å
435	Q	63.4	Low	73.1	Confident	124 Å²	124	66.5 Å²	66.5	58%	0.579	37%	0.368	S	S	*	.			trans	-82.9	127.1	176.3	-159.2	169.1	14.9	0	0	111.3	E432	E432-Q435 PolarHBondContact O-N 3.09Å
436	C	53	Low	72.9	Confident	93 Å²	93	69 Å²	69	63%	0.628	38%	0.383	S	S	*	.			trans	-89.2	125.4	175.4	-164.2	0	0	0	0	109.7	R438	C436-R438 VanDerWaalsContact C-N 3.32Å; C436-R438 PolarHBondContact O-N 3.36Å
437	M	61.8	Low	73.2	Confident	40 Å²	40	75.2 Å²	75.2	20%	0.197	41%	0.405	C	S	.	.			trans	-89.8	19.5	-170.8	-57.6	-164	-62.6	0	0	115.1	I429 F431 D439 A440 F461 F466	I429-M437 HydrophobicContact CD1-SD 4.46Å; F431-M437 HydrophobicContact CD1-CE 4.23Å; F431-M437 HydrophobicContact CD1-SD 3.38Å; F431-M437 WeakPolarHBondContact CD1-SD 3.39Å; F431-M437 HydrophobicContact CE1-CE 3.93Å; F431-M437 HydrophobicContact CE1-SD 3.25Å; F431-M437 WeakPolarHBondContact CE1-SD 3.29Å; M437-D439 PolarHBondContact O-N 3.24Å; M437-A440 PolarHBondContact O-N 3.41Å; M437-F461 HydrophobicContact CE-CB 4.33Å; M437-F461 WeakPolarHBondContact CE-O 3.43Å; M437-F466 HydrophobicContact CE-CD2 3.93Å; M437-F466 HydrophobicContact CE-CE2 3.76Å; M437-F466 HydrophobicContact SD-CD2 4.42Å; M437-F466 HydrophobicContact SD-CE2 4.27Å
438	R	50.1	Low	73.5	Confident	203 Å²	203	75.2 Å²	75.2	77%	0.766	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-17.3	-169.1	-75.2	178.8	-172.2	-150.5	0.8	114.6	C436	C436-R438 VanDerWaalsContact C-N 3.32Å; C436-R438 PolarHBondContact O-N 3.36Å
439	D	51.3	Low	73.8	Confident	152 Å²	152	75.6 Å²	75.6	81%	0.813	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	6.1	-176.1	-57.4	-24.6	0	0	0	113.9	M437 H441	M437-D439 PolarHBondContact O-N 3.24Å; D439-H441 PolarHBondContact O-N 3.39Å; D439-H441 VanDerWaalsContact O-N 3.16Å
440	A	58.3	Low	74	Confident	19 Å²	19	74.7 Å²	74.7	16%	0.157	40%	0.399	C	S	.	.			trans	-73.2	108.5	176.7	0	0	0	0	0	110.1	M437 L442 F466	M437-A440 PolarHBondContact O-N 3.41Å; A440-L442 WeakPolarHBondContact O-CD1 3.29Å; A440-L442 PolarHBondContact O-N 3.02Å; A440-L442 VanDerWaalsContact O-N 3.09Å; A440-F466 HydrophobicContact CB-CZ 4.1Å
441	H	65.2	Low	74.3	Confident	139 Å²	139	71.4 Å²	71.4	64%	0.644	39%	0.386	S	S	*	.			trans	-53.7	117.7	170.7	-62.6	-72.8	0	0	0	109.9	R405 D439 L444	R405-H441 PolarHBondContact NH2-O 3.48Å; D439-H441 PolarHBondContact O-N 3.39Å; D439-H441 VanDerWaalsContact O-N 3.16Å; H441-L444 HydrophobicContact CB-CD1 3.79Å; H441-L444 HydrophobicContact CB-CD2 4.21Å; H441-L444 HydrophobicContact CB-CG 3.8Å; H441-L444 WeakPolarHBondContact O-CG 3.12Å
442	L	64.1	Low	74.6	Confident	51 Å²	51	70.4 Å²	70.4	27%	0.267	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-39.4	-167.6	-75.2	78.8	0	0	0	113.5	A440 L444 G457 I459 F461	A440-L442 WeakPolarHBondContact O-CD1 3.29Å; A440-L442 PolarHBondContact O-N 3.02Å; A440-L442 VanDerWaalsContact O-N 3.09Å; L442-L444 VanDerWaalsContact C-N 3.34Å; L442-L444 PolarHBondContact O-N 2.77Å; L442-G457 WeakPolarHBondContact CD2-O 3.5Å; L442-I459 HydrophobicContact CB-CD1 3.88Å; L442-I459 HydrophobicContact CD2-CB 4.07Å; L442-I459 HydrophobicContact CD2-CD1 4.19Å; L442-I459 HydrophobicContact CD2-CG1 4.22Å; L442-I459 HydrophobicContact CG-CD1 4.16Å; L442-F461 HydrophobicContact CD1-CE1 3.81Å; L442-F461 HydrophobicContact CD1-CE2 4.49Å; L442-F461 HydrophobicContact CD1-CZ 3.41Å; L442-F461 VanDerWaalsContact CD1-CZ 3.41Å; L442-F461 HydrophobicContact CD2-CZ 4.09Å; L442-F461 HydrophobicContact CG-CE1 4.13Å; L442-F461 HydrophobicContact CG-CZ 3.91Å
443	Q	70.3	Confident	75.2	Confident	64 Å²	64	66.9 Å²	66.9	30%	0.299	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	50.9	-173.5	-66.7	179.5	-20.1	0	0	112.2	M514	Q443-M514 HydrophobicContact CG-CE 4.26Å
444	L	76.5	Confident	76.4	Confident	44 Å²	44	61.8 Å²	61.8	23%	0.23	32%	0.323	C	S	.	.			trans	-94.9	159.8	170.5	-64.1	179.8	0	0	0	110.6	L427 H441 L442 M450	L427-L444 HydrophobicContact CD1-CB 4.33Å; L427-L444 HydrophobicContact CD2-CD1 4.08Å; H441-L444 HydrophobicContact CB-CD1 3.79Å; H441-L444 HydrophobicContact CB-CD2 4.21Å; H441-L444 HydrophobicContact CB-CG 3.8Å; H441-L444 WeakPolarHBondContact O-CG 3.12Å; L442-L444 VanDerWaalsContact C-N 3.34Å; L442-L444 PolarHBondContact O-N 2.77Å; L444-M450 WeakPolarHBondContact O-CE 3.44Å
445	G	79.4	Confident	78	Confident	10 Å²	10	57.9 Å²	57.9	10%	0.103	28%	0.281	C	S	.	.	S	Bend	trans	105.1	-177.1	-176.2	0	0	0	0	0	113.7	R262 D406	R262-G445 VanDerWaalsContact NH1-C 3.32Å; R262-G445 PolarHBondContact NH1-O 3.44Å; R262-G445 VanDerWaalsContact NH1-O 3.14Å; D406-G445 WeakPolarHBondContact OD1-CA 3.35Å
446	T	88.4	Confident	79.2	Confident	53 Å²	53	55 Å²	55	33%	0.325	27%	0.27	S	S	.	.			trans	-86	117	178.5	-60.1	0	0	0	0	109.9	D406 N408 R448 Y449	D406-T446 WeakPolarHBondContact OD1-CB 3.12Å; D406-T446 PolarHBondContact OD1-N 3.47Å; D406-T446 PolarHBondContact OD1-OG1 2.94Å; N408-T446 PolarHBondContact ND2-OG1 2.88Å; T446-R448 VanDerWaalsContact C-N 3.27Å; T446-R448 PolarHBondContact O-N 2.81Å; T446-Y449 HydrophobicContact CG2-CD2 3.81Å; T446-Y449 HydrophobicContact CG2-CE2 4.17Å; T446-Y449 PolarHBondContact O-N 3.4Å
447	R	93.1	Very high	80.8	Confident	134 Å²	134	52 Å²	52	51%	0.506	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-44.5	-46.5	-167.8	-63.1	-179.6	-173.7	167.4	-0.4	114.8	Y449 M450 M514 L517	R447-Y449 PolarHBondContact O-N 3.45Å; R447-M450 HydrophobicContact CG-CE 4.45Å; R447-M450 VanDerWaalsContact O-CB 3.31Å; R447-M450 WeakPolarHBondContact O-CB 3.45Å; R447-M450 WeakPolarHBondContact O-CG 3.36Å; R447-M450 PolarHBondContact O-N 2.89Å; R447-M450 VanDerWaalsContact O-N 3.12Å; R447-M514 HydrophobicContact CG-SD 4.36Å; R447-L517 HydrophobicContact CB-CD1 3.79Å
448	R	95.8	Very high	81.9	Confident	23 Å²	23	53.5 Å²	53.5	9%	0.087	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-63.1	-23.2	-177.1	-171.5	-175.6	-76.5	-67.1	13.3	114	T446 P503 Y504 G509 P510 P512	T446-R448 VanDerWaalsContact C-N 3.27Å; T446-R448 PolarHBondContact O-N 2.81Å; R448-P503 WeakPolarHBondContact CD-O 3.03Å; R448-P503 HydrophobicContact CG-CB 4.25Å; R448-P503 WeakPolarHBondContact CG-O 2.87Å; R448-P503 VanDerWaalsContact CZ-O 3.3Å; R448-P503 PolarHBondContact NE-O 3.14Å; R448-P503 PolarHBondContact NH1-O 2.87Å; R448-Y504 HydrophobicContact CG-CD2 3.77Å; R448-Y504 VanDerWaalsContact NH1-C 3.34Å; R448-Y504 PolarHBondContact NH1-O 3Å; R448-Y504 VanDerWaalsContact O-CE2 3.25Å; R448-Y504 WeakPolarHBondContact O-CE2 3.27Å; R448-G509 PolarHBondContact NH2-O 3.35Å; R448-P510 PolarHBondContact NH2-O 3.37Å; R448-P512 VanDerWaalsContact CZ-CD 3.41Å
449	Y	97.4	Very high	83.5	Confident	16 Å²	16	44.4 Å²	44.4	6%	0.063	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-100.3	0.1	179.7	-62.8	-96.6	0	0	0	112.8	N408 S409 T446 R447 A451 Y472 L476 V477 E480 P503	N408-Y449 HydrophobicContact CB-CD1 3.89Å; N408-Y449 HydrophobicContact CB-CD2 3.66Å; N408-Y449 HydrophobicContact CB-CE1 3.77Å; N408-Y449 HydrophobicContact CB-CE2 3.54Å; N408-Y449 HydrophobicContact CB-CG 3.83Å; S409-Y449 PolarHBondContact OG-OH 3.37Å; T446-Y449 HydrophobicContact CG2-CD2 3.81Å; T446-Y449 HydrophobicContact CG2-CE2 4.17Å; T446-Y449 PolarHBondContact O-N 3.4Å; R447-Y449 PolarHBondContact O-N 3.45Å; Y449-A451 PolarHBondContact O-N 3.22Å; Y449-Y472 WeakPolarHBondContact O-CD1 3.47Å; Y449-Y472 WeakPolarHBondContact O-CE1 3.11Å; Y449-L476 HydrophobicContact CD1-CB 3.95Å; Y449-L476 HydrophobicContact CD1-CD1 4.02Å; Y449-L476 HydrophobicContact CE1-CB 4.13Å; Y449-L476 HydrophobicContact CG-CD1 4.43Å; Y449-V477 HydrophobicContact CE1-CG2 4.03Å; Y449-E480 VanDerWaalsContact CE1-OE1 3.29Å; Y449-E480 WeakPolarHBondContact CE1-OE1 3.21Å; Y449-E480 VanDerWaalsContact OH-CD 3.27Å; Y449-E480 PolarHBondContact OH-OE1 3.16Å; Y449-E480 PolarHBondContact OH-OE2 3.14Å; Y449-P503 HydrophobicContact CE1-CG 3.99Å
450	M	95.6	Very high	84.9	Confident	12 Å²	12	43.5 Å²	43.5	6%	0.059	23%	0.231	C	C	.	.			trans	-67	130.4	178.8	-69.6	179.1	173.9	0	0	110.5	L444 R447 V454 L455 Y472 M514	L444-M450 WeakPolarHBondContact O-CE 3.44Å; R447-M450 HydrophobicContact CG-CE 4.45Å; R447-M450 VanDerWaalsContact O-CB 3.31Å; R447-M450 WeakPolarHBondContact O-CB 3.45Å; R447-M450 WeakPolarHBondContact O-CG 3.36Å; R447-M450 PolarHBondContact O-N 2.89Å; R447-M450 VanDerWaalsContact O-N 3.12Å; M450-V454 HydrophobicContact CB-CB 4.11Å; M450-V454 HydrophobicContact CB-CG1 3.97Å; M450-V454 HydrophobicContact CG-CG1 3.91Å; M450-V454 HydrophobicContact SD-CG1 3.99Å; M450-L455 HydrophobicContact CB-CD2 3.77Å; M450-L455 HydrophobicContact CB-CG 3.94Å; M450-L455 HydrophobicContact SD-CD2 4.2Å; M450-Y472 VanDerWaalsContact O-CE1 3.27Å; M450-Y472 WeakPolarHBondContact O-CE1 3.31Å; M450-M514 HydrophobicContact SD-CE 3.72Å; M450-M514 HydrophobicContact SD-SD 4.01Å
451	A	96.6	Very high	86.1	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.243	C	C	.	.			trans	-63.7	155.6	173.7	0	0	0	0	0	111.2	Y449 E453 V454 L455 I469 Y472	Y449-A451 PolarHBondContact O-N 3.22Å; A451-E453 VanDerWaalsContact C-N 3.28Å; A451-E453 WeakPolarHBondContact CB-OE1 3.48Å; A451-E453 WeakPolarHBondContact CB-OE2 3.34Å; A451-E453 PolarHBondContact O-N 3.09Å; A451-V454 HydrophobicContact CB-CG2 4.08Å; A451-V454 WeakPolarHBondContact O-CA 3.43Å; A451-V454 VanDerWaalsContact O-CB 3.31Å; A451-V454 WeakPolarHBondContact O-CB 3.47Å; A451-V454 PolarHBondContact O-N 3.19Å; A451-L455 PolarHBondContact O-N 3.46Å; A451-I469 HydrophobicContact CB-CG1 4.15Å; A451-I469 HydrophobicContact CB-CG2 4.41Å; A451-Y472 HydrophobicContact CB-CD1 3.82Å; A451-Y472 HydrophobicContact CB-CD2 4.2Å; A451-Y472 HydrophobicContact CB-CE1 4.39Å; A451-Y472 HydrophobicContact CB-CG 3.72Å
452	P	96.3	Very high	87.1	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.006	23%	0.225	C	C	.	.	H	α-helix	trans	-54.9	-40.4	-177	20	-32.8	0	0	0	113.4	V454 L455 D456 V521 A522	P452-V454 VanDerWaalsContact C-N 3.26Å; P452-V454 PolarHBondContact O-N 3.2Å; P452-L455 PolarHBondContact O-N 3.41Å; P452-D456 PolarHBondContact O-N 3.37Å; P452-V521 HydrophobicContact CB-CG1 4.44Å; P452-A522 HydrophobicContact CB-CB 4.01Å
453	E	94.3	Very high	88.4	Confident	29 Å²	29	43.1 Å²	43.1	14%	0.136	23%	0.227	C	C	.	.	H	α-helix	trans	-66.7	-24.8	176.6	67.6	-84	-161	0	0	113.6	A451 G457 A458 I459 R558	A451-E453 VanDerWaalsContact C-N 3.28Å; A451-E453 WeakPolarHBondContact CB-OE1 3.48Å; A451-E453 WeakPolarHBondContact CB-OE2 3.34Å; A451-E453 PolarHBondContact O-N 3.09Å; E453-G457 PolarHBondContact O-N 3.23Å; E453-A458 PolarHBondContact O-N 2.74Å; E453-I459 HydrophobicContact CG-CG1 4.4Å; E453-I459 WeakPolarHBondContact O-CG1 3.33Å; E453-R558 IonicContact OE1-CZ 3.87Å; E453-R558 IonicContact OE1-NH1 3.94Å; E453-R558 PolarHBondContact OE1-NH1 2.73Å; E453-R558 IonicContact OE1-NH2 2.65Å; E453-R558 PolarHBondContact OE1-NH2 3.35Å; E453-R558 IonicContact OE2-CZ 2.94Å; E453-R558 IonicContact OE2-NH1 3.92Å; E453-R558 IonicContact OE2-NH2 3.4Å; E453-R558 PolarHBondContact OE2-NH2 3.3Å
454	V	93.5	Very high	89.4	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.024	23%	0.234	C	C	.	.	H	α-helix	trans	-77.1	-43.1	173.7	-178.8	0	0	0	0	110.1	M450 A451 P452 D456 G457 I459 I469	M450-V454 HydrophobicContact CB-CB 4.11Å; M450-V454 HydrophobicContact CB-CG1 3.97Å; M450-V454 HydrophobicContact CG-CG1 3.91Å; M450-V454 HydrophobicContact SD-CG1 3.99Å; A451-V454 HydrophobicContact CB-CG2 4.08Å; A451-V454 WeakPolarHBondContact O-CA 3.43Å; A451-V454 VanDerWaalsContact O-CB 3.31Å; A451-V454 WeakPolarHBondContact O-CB 3.47Å; A451-V454 PolarHBondContact O-N 3.19Å; P452-V454 VanDerWaalsContact C-N 3.26Å; P452-V454 PolarHBondContact O-N 3.2Å; V454-D456 VanDerWaalsContact C-N 3.33Å; V454-D456 PolarHBondContact O-N 2.75Å; V454-G457 PolarHBondContact O-N 3.32Å; V454-G457 VanDerWaalsContact O-N 3.14Å; V454-I459 HydrophobicContact CB-CD1 4.09Å; V454-I459 HydrophobicContact CB-CG1 4.48Å; V454-I459 HydrophobicContact CG1-CD1 4.17Å; V454-I459 HydrophobicContact CG2-CD1 3.69Å; V454-I459 HydrophobicContact CG2-CG1 4.11Å; V454-I469 HydrophobicContact CG2-CD1 3.42Å; V454-I469 VanDerWaalsContact CG2-CD1 3.42Å; V454-I469 HydrophobicContact CG2-CG1 3.69Å; V454-I469 HydrophobicContact CG2-CG2 3.99Å
455	L	93.2	Very high	90.2	Very high	4 Å²	4	42.5 Å²	42.5	2%	0.021	23%	0.227	C	C	.	.	H	α-helix	trans	-61.5	-42.4	177.4	-67.2	171.8	0	0	0	111.4	M450 A451 P452 G457 M514 L517 Q518 V521 A522	M450-L455 HydrophobicContact CB-CD2 3.77Å; M450-L455 HydrophobicContact CB-CG 3.94Å; M450-L455 HydrophobicContact SD-CD2 4.2Å; A451-L455 PolarHBondContact O-N 3.46Å; P452-L455 PolarHBondContact O-N 3.41Å; L455-G457 VanDerWaalsContact C-N 3.27Å; L455-G457 PolarHBondContact O-N 3.1Å; L455-M514 HydrophobicContact CD2-CE 3.61Å; L455-M514 HydrophobicContact CD2-SD 3.64Å; L455-L517 HydrophobicContact CD1-CB 4.24Å; L455-L517 HydrophobicContact CD2-CB 4.02Å; L455-Q518 HydrophobicContact CB-CB 4.44Å; L455-Q518 HydrophobicContact CB-CG 4.44Å; L455-V521 HydrophobicContact CD1-CB 3.67Å; L455-V521 HydrophobicContact CD1-CG1 3.79Å; L455-V521 HydrophobicContact CD1-CG2 4.29Å; L455-A522 HydrophobicContact CB-CB 4.36Å
456	D	89.8	Confident	90.9	Very high	64 Å²	64	42.1 Å²	42.1	34%	0.342	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-7.5	176.8	-75.8	-16.7	0	0	0	114	P452 V454 A458 Q518 A522 H523	P452-D456 PolarHBondContact O-N 3.37Å; V454-D456 VanDerWaalsContact C-N 3.33Å; V454-D456 PolarHBondContact O-N 2.75Å; D456-A458 HydrophobicContact CB-CB 4.28Å; D456-A458 PolarHBondContact O-N 3.33Å; D456-Q518 VanDerWaalsContact OD1-CG 3.28Å; D456-Q518 WeakPolarHBondContact OD1-CG 3.45Å; D456-Q518 PolarHBondContact OD1-NE2 3.42Å; D456-A522 WeakPolarHBondContact OD1-CB 3.31Å; D456-A522 WeakPolarHBondContact OD2-CB 3.16Å; D456-H523 IonicContact OD1-CD2 3.61Å; D456-H523 IonicContact OD1-NE2 3.3Å; D456-H523 PolarHBondContact OD1-NE2 3.16Å
457	G	85.9	Confident	91.2	Very high	31 Å²	31	40.6 Å²	40.6	32%	0.32	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.2	15.4	-175.4	0	0	0	0	0	114	L442 E453 V454 L455 I459	L442-G457 WeakPolarHBondContact CD2-O 3.5Å; E453-G457 PolarHBondContact O-N 3.23Å; V454-G457 PolarHBondContact O-N 3.32Å; V454-G457 VanDerWaalsContact O-N 3.14Å; L455-G457 VanDerWaalsContact C-N 3.27Å; L455-G457 PolarHBondContact O-N 3.1Å; G457-I459 PolarHBondContact O-N 2.93Å
458	A	84.9	Confident	91.4	Very high	70 Å²	70	36.7 Å²	36.7	58%	0.579	20%	0.197	S	C	*	.			trans	-98.4	34.8	-173.7	0	0	0	0	0	112.9	E453 D456	E453-A458 PolarHBondContact O-N 2.74Å; D456-A458 HydrophobicContact CB-CB 4.28Å; D456-A458 PolarHBondContact O-N 3.33Å
459	I	83.7	Confident	91.5	Very high	13 Å²	13	36.4 Å²	36.4	7%	0.067	20%	0.197	C	C	.	.			trans	-75.3	132.4	-176.7	-49.6	172	0	0	0	110.3	L442 E453 V454 G457 A465 I469	L442-I459 HydrophobicContact CB-CD1 3.88Å; L442-I459 HydrophobicContact CD2-CB 4.07Å; L442-I459 HydrophobicContact CD2-CD1 4.19Å; L442-I459 HydrophobicContact CD2-CG1 4.22Å; L442-I459 HydrophobicContact CG-CD1 4.16Å; E453-I459 HydrophobicContact CG-CG1 4.4Å; E453-I459 WeakPolarHBondContact O-CG1 3.33Å; V454-I459 HydrophobicContact CB-CD1 4.09Å; V454-I459 HydrophobicContact CB-CG1 4.48Å; V454-I459 HydrophobicContact CG1-CD1 4.17Å; V454-I459 HydrophobicContact CG2-CD1 3.69Å; V454-I459 HydrophobicContact CG2-CG1 4.11Å; G457-I459 PolarHBondContact O-N 2.93Å; I459-A465 HydrophobicContact CG2-CB 4.43Å; I459-I469 HydrophobicContact CD1-CD1 4.12Å; I459-I469 HydrophobicContact CG1-CD1 4.46Å; I459-I469 HydrophobicContact CG2-CD1 4Å
460	Q	81.3	Confident	91.5	Very high	132 Å²	132	35.7 Å²	35.7	62%	0.617	20%	0.195	S	C	*	.			trans	-74.8	129.2	164.9	-64.2	-178.3	9.5	0	0	110	S462 A465	Q460-S462 PolarHBondContact O-N 3.33Å; Q460-A465 HydrophobicContact CB-CB 4.23Å; Q460-A465 WeakPolarHBondContact O-CB 3.47Å
461	F	82.5	Confident	91.7	Very high	95 Å²	95	35.2 Å²	35.2	42%	0.417	19%	0.193	S	C	.	.			trans	-76.7	64.1	176	-64.4	-86.7	0	0	0	111.9	M437 L442	M437-F461 HydrophobicContact CE-CB 4.33Å; M437-F461 WeakPolarHBondContact CE-O 3.43Å; L442-F461 HydrophobicContact CD1-CE1 3.81Å; L442-F461 HydrophobicContact CD1-CE2 4.49Å; L442-F461 HydrophobicContact CD1-CZ 3.41Å; L442-F461 VanDerWaalsContact CD1-CZ 3.41Å; L442-F461 HydrophobicContact CD2-CZ 4.09Å; L442-F461 HydrophobicContact CG-CE1 4.13Å; L442-F461 HydrophobicContact CG-CZ 3.91Å
462	S	87	Confident	91.8	Very high	37 Å²	37	35.2 Å²	35.2	26%	0.259	19%	0.193	S	C	.	.	S	Bend	trans	-124.1	155	176	72	0	0	0	0	110.6	Q460 D464 A465 F466	Q460-S462 PolarHBondContact O-N 3.33Å; S462-D464 VanDerWaalsContact C-N 3.32Å; S462-D464 PolarHBondContact O-N 3.27Å; S462-A465 PolarHBondContact O-N 3.36Å; S462-A465 WeakPolarHBondContact OG-CB 3.39Å; S462-A465 PolarHBondContact OG-N 3.4Å; S462-F466 WeakPolarHBondContact O-CD2 3.48Å; S462-F466 PolarHBondContact O-N 2.81Å
463	K	90.6	Very high	91.9	Very high	70 Å²	70	35.4 Å²	35.4	30%	0.304	19%	0.194	S	C	.	.	H	α-helix	trans	-49.5	-55.6	174.3	174.3	175.8	72.9	168.3	0	110.8	E393 F431 A465 F466 L467	E393-K463 IonicContact OE2-NZ 3.35Å; F431-K463 HydrophobicContact CB-CB 4.3Å; F431-K463 HydrophobicContact CB-CD 3.99Å; F431-K463 HydrophobicContact CB-CG 4.08Å; F431-K463 HydrophobicContact CD1-CB 3.86Å; F431-K463 HydrophobicContact CD1-CG 4.13Å; F431-K463 HydrophobicContact CD2-CB 4.34Å; F431-K463 HydrophobicContact CD2-CD 4.23Å; F431-K463 HydrophobicContact CD2-CG 3.69Å; F431-K463 HydrophobicContact CE1-CB 4.29Å; F431-K463 HydrophobicContact CE2-CG 4.16Å; F431-K463 HydrophobicContact CG-CB 3.9Å; F431-K463 HydrophobicContact CG-CD 4.15Å; F431-K463 HydrophobicContact CG-CG 3.69Å; K463-A465 VanDerWaalsContact C-N 3.29Å; K463-A465 PolarHBondContact O-N 3.45Å; K463-F466 PolarHBondContact O-N 3.21Å; K463-F466 VanDerWaalsContact O-N 3.15Å; K463-L467 HydrophobicContact CD-CD1 4.48Å; K463-L467 HydrophobicContact CG-CD1 3.96Å; K463-L467 HydrophobicContact CG-CG 4.28Å; K463-L467 WeakPolarHBondContact O-CG 3.47Å; K463-L467 PolarHBondContact O-N 3Å; K463-L467 VanDerWaalsContact O-N 3.14Å
464	D	92.3	Very high	92.1	Very high	84 Å²	84	34 Å²	34	45%	0.449	19%	0.188	S	C	.	.	H	α-helix	trans	-63.7	-33.4	-172.3	-56.1	-43.1	0	0	0	112.7	S462 L467 R468	S462-D464 VanDerWaalsContact C-N 3.32Å; S462-D464 PolarHBondContact O-N 3.27Å; D464-L467 PolarHBondContact O-N 3.44Å; D464-R468 WeakPolarHBondContact O-CB 3.45Å; D464-R468 VanDerWaalsContact O-CD 3.31Å; D464-R468 WeakPolarHBondContact O-CD 3.48Å; D464-R468 WeakPolarHBondContact O-CG 3.26Å; D464-R468 PolarHBondContact O-N 3.03Å
465	A	92.5	Very high	92.3	Very high	10 Å²	10	33.8 Å²	33.8	8%	0.083	19%	0.186	C	C	.	.	H	α-helix	trans	-61.1	-46.1	175.4	0	0	0	0	0	111.9	I459 Q460 S462 K463 R468 I469	I459-A465 HydrophobicContact CG2-CB 4.43Å; Q460-A465 HydrophobicContact CB-CB 4.23Å; Q460-A465 WeakPolarHBondContact O-CB 3.47Å; S462-A465 PolarHBondContact O-N 3.36Å; S462-A465 WeakPolarHBondContact OG-CB 3.39Å; S462-A465 PolarHBondContact OG-N 3.4Å; K463-A465 VanDerWaalsContact C-N 3.29Å; K463-A465 PolarHBondContact O-N 3.45Å; A465-R468 PolarHBondContact O-N 3.24Å; A465-I469 WeakPolarHBondContact O-CG1 3.27Å; A465-I469 PolarHBondContact O-N 3.43Å; A465-I469 VanDerWaalsContact O-N 3.1Å
466	F	93.4	Very high	92.6	Very high	3 Å²	3	33.6 Å²	33.6	1%	0.013	19%	0.185	C	C	.	.	H	α-helix	trans	-67.3	-36.2	176.9	-78	-81.3	0	0	0	112.9	A403 R405 I429 F431 M437 A440 S462 K463 I469 D470	A403-F466 HydrophobicContact CB-CB 3.73Å; R405-F466 HydrophobicContact CG-CD1 4.15Å; I429-F466 HydrophobicContact CD1-CB 4.33Å; I429-F466 HydrophobicContact CD1-CD1 3.72Å; I429-F466 HydrophobicContact CD1-CD2 3.92Å; I429-F466 HydrophobicContact CD1-CE1 3.9Å; I429-F466 HydrophobicContact CD1-CE2 4.11Å; I429-F466 HydrophobicContact CD1-CG 3.74Å; I429-F466 HydrophobicContact CD1-CZ 4.1Å; F431-F466 HydrophobicContact CE1-CB 4.22Å; F431-F466 AromaticContact CE1-CD2 3.97Å; F431-F466 HydrophobicContact CE1-CD2 3.97Å; F431-F466 HydrophobicContact CE1-CG 4.35Å; F431-F466 HydrophobicContact CE2-CB 4.48Å; F431-F466 HydrophobicContact CZ-CB 3.54Å; F431-F466 HydrophobicContact CZ-CD2 4.13Å; F431-F466 HydrophobicContact CZ-CG 4.04Å; M437-F466 HydrophobicContact CE-CD2 3.93Å; M437-F466 HydrophobicContact CE-CE2 3.76Å; M437-F466 HydrophobicContact SD-CD2 4.42Å; M437-F466 HydrophobicContact SD-CE2 4.27Å; A440-F466 HydrophobicContact CB-CZ 4.1Å; S462-F466 WeakPolarHBondContact O-CD2 3.48Å; S462-F466 PolarHBondContact O-N 2.81Å; K463-F466 PolarHBondContact O-N 3.21Å; K463-F466 VanDerWaalsContact O-N 3.15Å; F466-I469 HydrophobicContact CD1-CD1 4.38Å; F466-I469 WeakPolarHBondContact O-CB 3.39Å; F466-I469 PolarHBondContact O-N 3.45Å; F466-D470 PolarHBondContact O-N 2.95Å
467	L	96.4	Very high	93	Very high	20 Å²	20	30.6 Å²	30.6	11%	0.105	17%	0.169	C	C	.	.	H	α-helix	trans	-64.8	-40.5	174.5	-56	-177.5	0	0	0	111.2	H391 A403 F431 K463 D464 I469 D470 V471	H391-L467 HydrophobicContact CB-CD1 4.28Å; H391-L467 HydrophobicContact CB-CD2 4.11Å; H391-L467 VanDerWaalsContact CD2-CD2 3.48Å; H391-L467 WeakPolarHBondContact CD2-CD2 3.42Å; H391-L467 PolarHBondContact CE1-O 3.15Å; H391-L467 VanDerWaalsContact CE1-O 3.22Å; A403-L467 HydrophobicContact CB-CD2 4.11Å; F431-L467 HydrophobicContact CE2-CD2 3.97Å; K463-L467 HydrophobicContact CD-CD1 4.48Å; K463-L467 HydrophobicContact CG-CD1 3.96Å; K463-L467 HydrophobicContact CG-CG 4.28Å; K463-L467 WeakPolarHBondContact O-CG 3.47Å; K463-L467 PolarHBondContact O-N 3Å; K463-L467 VanDerWaalsContact O-N 3.14Å; D464-L467 PolarHBondContact O-N 3.44Å; L467-I469 VanDerWaalsContact C-N 3.29Å; L467-I469 PolarHBondContact O-N 3.47Å; L467-D470 PolarHBondContact O-N 3.07Å; L467-V471 PolarHBondContact O-N 3.43Å
468	R	97.5	Very high	93.6	Very high	52 Å²	52	29.1 Å²	29.1	20%	0.196	15%	0.154	C	C	.	.	H	α-helix	trans	-66.1	-27.7	176.4	-72.3	160.1	169.8	176.9	0.2	113.1	D464 A465 Y472 A555 E556 R558	D464-R468 WeakPolarHBondContact O-CB 3.45Å; D464-R468 VanDerWaalsContact O-CD 3.31Å; D464-R468 WeakPolarHBondContact O-CD 3.48Å; D464-R468 WeakPolarHBondContact O-CG 3.26Å; D464-R468 PolarHBondContact O-N 3.03Å; A465-R468 PolarHBondContact O-N 3.24Å; R468-Y472 PolarHBondContact O-N 2.81Å; R468-A555 HydrophobicContact CB-CB 4.23Å; R468-A555 WeakPolarHBondContact CD-O 3.38Å; R468-A555 WeakPolarHBondContact CG-O 3.38Å; R468-A555 PolarHBondContact NE-O 3.35Å; R468-E556 VanDerWaalsContact CZ-CA 3.49Å; R468-E556 IonicContact CZ-OE1 3.64Å; R468-E556 IonicContact NH1-OE1 3.02Å; R468-E556 PolarHBondContact NH1-OE1 3.41Å; R468-E556 IonicContact NH2-OE1 2.75Å; R468-R558 PolarHBondContact O-NH1 2.87Å
469	I	96.9	Very high	94.2	Very high	17 Å²	17	25.8 Å²	25.8	9%	0.087	13%	0.126	C	C	.	.	H	α-helix	trans	-65.7	-43.5	172.1	-70.2	164.5	0	0	0	110.4	A451 V454 I459 A465 F466 L467 V471 Y472 A473	A451-I469 HydrophobicContact CB-CG1 4.15Å; A451-I469 HydrophobicContact CB-CG2 4.41Å; V454-I469 HydrophobicContact CG2-CD1 3.42Å; V454-I469 VanDerWaalsContact CG2-CD1 3.42Å; V454-I469 HydrophobicContact CG2-CG1 3.69Å; V454-I469 HydrophobicContact CG2-CG2 3.99Å; I459-I469 HydrophobicContact CD1-CD1 4.12Å; I459-I469 HydrophobicContact CG1-CD1 4.46Å; I459-I469 HydrophobicContact CG2-CD1 4Å; A465-I469 WeakPolarHBondContact O-CG1 3.27Å; A465-I469 PolarHBondContact O-N 3.43Å; A465-I469 VanDerWaalsContact O-N 3.1Å; F466-I469 HydrophobicContact CD1-CD1 4.38Å; F466-I469 WeakPolarHBondContact O-CB 3.39Å; F466-I469 PolarHBondContact O-N 3.45Å; L467-I469 VanDerWaalsContact C-N 3.29Å; L467-I469 PolarHBondContact O-N 3.47Å; I469-V471 VanDerWaalsContact C-N 3.33Å; I469-V471 PolarHBondContact O-N 3.25Å; I469-Y472 WeakPolarHBondContact O-CB 3.49Å; I469-Y472 PolarHBondContact O-N 2.73Å; I469-A473 PolarHBondContact O-N 3.17Å
470	D	98	Very high	94.9	Very high	2 Å²	2	25.2 Å²	25.2	1%	0.011	12%	0.124	C	C	.	.	H	α-helix	trans	-65.5	-36.7	177.3	-67	-26.2	0	0	0	112.1	L387 H391 A403 H404 R405 F466 L467 Y472 A473 M474	L387-D470 HydrophobicContact CD1-CB 3.93Å; L387-D470 HydrophobicContact CD2-CB 4.1Å; H391-D470 IonicContact CD2-OD2 2.72Å; H391-D470 IonicContact CE1-OD2 3.53Å; H391-D470 IonicContact NE2-OD2 2.81Å; H391-D470 PolarHBondContact NE2-OD2 3.28Å; A403-D470 WeakPolarHBondContact CA-OD2 3.35Å; H404-D470 PolarHBondContact N-OD1 3.18Å; H404-D470 PolarHBondContact N-OD2 3Å; R405-D470 PolarHBondContact N-OD1 3.49Å; F466-D470 PolarHBondContact O-N 2.95Å; L467-D470 PolarHBondContact O-N 3.07Å; D470-Y472 VanDerWaalsContact C-N 3.35Å; D470-A473 PolarHBondContact O-N 2.87Å; D470-M474 PolarHBondContact O-N 3.23Å
471	V	98.7	Very high	95.6	Very high	2 Å²	2	19 Å²	19	1%	0.012	9%	0.094	C	C	.	.	H	α-helix	trans	-63.7	-41.8	177	174.5	0	0	0	0	111.3	L467 I469 A473 M474 G475 C550 R558 L559	L467-V471 PolarHBondContact O-N 3.43Å; I469-V471 VanDerWaalsContact C-N 3.33Å; I469-V471 PolarHBondContact O-N 3.25Å; V471-A473 VanDerWaalsContact C-N 3.3Å; V471-A473 PolarHBondContact O-N 3.4Å; V471-M474 HydrophobicContact CG1-CE 4.25Å; V471-M474 WeakPolarHBondContact O-CB 3.49Å; V471-M474 PolarHBondContact O-N 2.86Å; V471-G475 PolarHBondContact O-N 2.8Å; V471-C550 HydrophobicContact CG1-CB 3.93Å; V471-R558 HydrophobicContact CG1-CB 4.41Å; V471-L559 VanDerWaalsContact CG1-O 3.3Å; V471-L559 WeakPolarHBondContact CG1-O 3.41Å; V471-L559 WeakPolarHBondContact CG2-O 3.49Å
472	Y	98.7	Very high	96.3	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-56	-48.6	174.2	173.2	-84.9	0	0	0	111	Y449 M450 A451 R468 I469 D470 M474 G475 L476 Y504 V521 C550 W551	Y449-Y472 WeakPolarHBondContact O-CD1 3.47Å; Y449-Y472 WeakPolarHBondContact O-CE1 3.11Å; M450-Y472 VanDerWaalsContact O-CE1 3.27Å; M450-Y472 WeakPolarHBondContact O-CE1 3.31Å; A451-Y472 HydrophobicContact CB-CD1 3.82Å; A451-Y472 HydrophobicContact CB-CD2 4.2Å; A451-Y472 HydrophobicContact CB-CE1 4.39Å; A451-Y472 HydrophobicContact CB-CG 3.72Å; R468-Y472 PolarHBondContact O-N 2.81Å; I469-Y472 WeakPolarHBondContact O-CB 3.49Å; I469-Y472 PolarHBondContact O-N 2.73Å; D470-Y472 VanDerWaalsContact C-N 3.35Å; Y472-M474 VanDerWaalsContact C-N 3.34Å; Y472-M474 PolarHBondContact O-N 3.3Å; Y472-G475 PolarHBondContact O-N 2.69Å; Y472-L476 HydrophobicContact CD1-CD1 4.12Å; Y472-L476 HydrophobicContact CE1-CD1 3.49Å; Y472-L476 VanDerWaalsContact CE1-CD1 3.49Å; Y472-L476 HydrophobicContact CE1-CG 4.28Å; Y472-L476 PolarHBondContact O-N 3.45Å; Y472-Y504 PolarHBondContact OH-OH 2.8Å; Y472-V521 WeakPolarHBondContact OH-CG1 3.03Å; Y472-C550 WeakPolarHBondContact CA-O 3.13Å; Y472-W551 HydrophobicContact CD2-CB 3.77Å; Y472-W551 HydrophobicContact CE2-CB 3.89Å
473	A	98.5	Very high	96.6	Very high	4 Å²	4	13.7 Å²	13.7	3%	0.033	7%	0.067	C	C	.	.	H	α-helix	trans	-64.3	-37.9	178.8	0	0	0	0	0	112.4	L407 I469 D470 V471 G475 L476 V477	L407-A473 HydrophobicContact CB-CB 4.1Å; L407-A473 WeakPolarHBondContact O-CB 3.36Å; I469-A473 PolarHBondContact O-N 3.17Å; D470-A473 PolarHBondContact O-N 2.87Å; V471-A473 VanDerWaalsContact C-N 3.3Å; V471-A473 PolarHBondContact O-N 3.4Å; A473-G475 VanDerWaalsContact C-N 3.33Å; A473-G475 PolarHBondContact O-N 2.99Å; A473-L476 WeakPolarHBondContact O-CB 3.36Å; A473-L476 PolarHBondContact O-N 3.16Å; A473-V477 PolarHBondContact O-N 3.01Å; A473-V477 VanDerWaalsContact O-N 3.14Å
474	M	98.7	Very high	96.8	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-60.1	-40.6	173.8	-177.4	178.4	64.1	0	0	112	L383 A384 L387 L407 D470 V471 Y472 L476 V477 F478 V564	L383-M474 HydrophobicContact CD2-CG 4.12Å; L383-M474 HydrophobicContact CG-CG 4.2Å; L383-M474 HydrophobicContact CG-SD 4.49Å; A384-M474 HydrophobicContact CB-SD 4.16Å; L387-M474 HydrophobicContact CD2-CB 4.12Å; L387-M474 HydrophobicContact CD2-CE 4.28Å; L387-M474 HydrophobicContact CD2-CG 4.48Å; L387-M474 HydrophobicContact CD2-SD 3.75Å; L407-M474 HydrophobicContact CD2-CB 3.86Å; D470-M474 PolarHBondContact O-N 3.23Å; V471-M474 HydrophobicContact CG1-CE 4.25Å; V471-M474 WeakPolarHBondContact O-CB 3.49Å; V471-M474 PolarHBondContact O-N 2.86Å; Y472-M474 VanDerWaalsContact C-N 3.34Å; Y472-M474 PolarHBondContact O-N 3.3Å; M474-L476 VanDerWaalsContact C-N 3.3Å; M474-L476 PolarHBondContact O-N 3.29Å; M474-V477 PolarHBondContact O-N 3.41Å; M474-F478 HydrophobicContact CE-CE2 4.41Å; M474-F478 HydrophobicContact CE-CZ 4.37Å; M474-F478 HydrophobicContact CG-CD1 4.38Å; M474-F478 HydrophobicContact CG-CE1 3.8Å; M474-F478 HydrophobicContact CG-CE2 4.13Å; M474-F478 HydrophobicContact CG-CZ 3.65Å; M474-F478 WeakPolarHBondContact O-CG 3.33Å; M474-F478 PolarHBondContact O-N 3.12Å; M474-F478 HydrophobicContact SD-CE1 4.38Å; M474-F478 HydrophobicContact SD-CE2 4.39Å; M474-F478 HydrophobicContact SD-CZ 3.8Å; M474-V564 HydrophobicContact CE-CB 3.94Å; M474-V564 HydrophobicContact CE-CG1 3.78Å; M474-V564 HydrophobicContact CE-CG2 3.8Å
475	G	98.6	Very high	96.8	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-58.5	-40.4	174.8	0	0	0	0	0	112.7	V471 Y472 A473 F478 W479 V547	V471-G475 PolarHBondContact O-N 2.8Å; Y472-G475 PolarHBondContact O-N 2.69Å; A473-G475 VanDerWaalsContact C-N 3.33Å; A473-G475 PolarHBondContact O-N 2.99Å; G475-F478 PolarHBondContact O-N 3.33Å; G475-W479 PolarHBondContact O-N 3.18Å; G475-W479 VanDerWaalsContact O-N 3.09Å; G475-V547 WeakPolarHBondContact O-CG1 3.28Å
476	L	98.6	Very high	96.5	Very high	0 Å²	0	8 Å²	8	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-65.9	-39.5	175.3	-63.7	172	0	0	0	112.4	Y449 Y472 A473 M474 F478 W479 E480 P503 Y504 P528 W551	Y449-L476 HydrophobicContact CD1-CB 3.95Å; Y449-L476 HydrophobicContact CD1-CD1 4.02Å; Y449-L476 HydrophobicContact CE1-CB 4.13Å; Y449-L476 HydrophobicContact CG-CD1 4.43Å; Y472-L476 HydrophobicContact CD1-CD1 4.12Å; Y472-L476 HydrophobicContact CE1-CD1 3.49Å; Y472-L476 VanDerWaalsContact CE1-CD1 3.49Å; Y472-L476 HydrophobicContact CE1-CG 4.28Å; Y472-L476 PolarHBondContact O-N 3.45Å; A473-L476 WeakPolarHBondContact O-CB 3.36Å; A473-L476 PolarHBondContact O-N 3.16Å; M474-L476 VanDerWaalsContact C-N 3.3Å; M474-L476 PolarHBondContact O-N 3.29Å; L476-F478 VanDerWaalsContact C-N 3.33Å; L476-F478 PolarHBondContact O-N 2.87Å; L476-W479 WeakPolarHBondContact O-CB 3.45Å; L476-W479 PolarHBondContact O-N 3.39Å; L476-E480 PolarHBondContact O-N 3.39Å; L476-E480 VanDerWaalsContact O-N 3.09Å; L476-P503 HydrophobicContact CB-CB 4.32Å; L476-P503 HydrophobicContact CB-CG 4.04Å; L476-P503 HydrophobicContact CD2-CB 4.05Å; L476-Y504 HydrophobicContact CD1-CE2 4.05Å; L476-Y504 HydrophobicContact CD2-CE2 3.87Å; L476-Y504 WeakPolarHBondContact CD2-OH 3.33Å; L476-P528 HydrophobicContact CD2-CG 3.88Å; L476-W551 HydrophobicContact CD2-CE3 3.6Å; L476-W551 HydrophobicContact CD2-CZ3 3.86Å; L476-W551 HydrophobicContact CG-CE3 4.27Å
477	V	98.6	Very high	95.8	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-64.6	-38	175.5	178.2	0	0	0	0	111.5	L383 Y449 A473 M474 W479 E480 L481	L383-V477 HydrophobicContact CD2-CB 4.12Å; L383-V477 HydrophobicContact CD2-CG1 3.69Å; Y449-V477 HydrophobicContact CE1-CG2 4.03Å; A473-V477 PolarHBondContact O-N 3.01Å; A473-V477 VanDerWaalsContact O-N 3.14Å; M474-V477 PolarHBondContact O-N 3.41Å; V477-W479 VanDerWaalsContact C-N 3.33Å; V477-W479 PolarHBondContact O-N 3.29Å; V477-E480 WeakPolarHBondContact CA-OE1 3.48Å; V477-E480 PolarHBondContact O-N 3.44Å; V477-L481 HydrophobicContact CG1-CD1 4.38Å; V477-L481 WeakPolarHBondContact O-CG 3.45Å; V477-L481 PolarHBondContact O-N 3.45Å; V477-L481 VanDerWaalsContact O-N 3.11Å
478	F	98.5	Very high	94.8	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-62.4	-40.7	173.1	-69.9	-6.3	0	0	0	112.1	C380 L383 A384 M474 G475 L476 E480 L481 M482 V547 V564 L568	C380-F478 HydrophobicContact CB-CD1 3.98Å; C380-F478 HydrophobicContact CB-CE1 3.66Å; C380-F478 HydrophobicContact CB-CZ 4.08Å; C380-F478 VanDerWaalsContact SG-CD1 3.53Å; L383-F478 HydrophobicContact CB-CE1 4.4Å; L383-F478 HydrophobicContact CD2-CD1 4.34Å; L383-F478 HydrophobicContact CD2-CE1 3.93Å; L383-F478 HydrophobicContact CG-CE1 4.34Å; A384-F478 HydrophobicContact CB-CZ 4.4Å; M474-F478 HydrophobicContact CE-CE2 4.41Å; M474-F478 HydrophobicContact CE-CZ 4.37Å; M474-F478 HydrophobicContact CG-CD1 4.38Å; M474-F478 HydrophobicContact CG-CE1 3.8Å; M474-F478 HydrophobicContact CG-CE2 4.13Å; M474-F478 HydrophobicContact CG-CZ 3.65Å; M474-F478 WeakPolarHBondContact O-CG 3.33Å; M474-F478 PolarHBondContact O-N 3.12Å; M474-F478 HydrophobicContact SD-CE1 4.38Å; M474-F478 HydrophobicContact SD-CE2 4.39Å; M474-F478 HydrophobicContact SD-CZ 3.8Å; G475-F478 PolarHBondContact O-N 3.33Å; L476-F478 VanDerWaalsContact C-N 3.33Å; L476-F478 PolarHBondContact O-N 2.87Å; F478-E480 VanDerWaalsContact C-N 3.34Å; F478-E480 PolarHBondContact O-N 2.84Å; F478-L481 HydrophobicContact CD1-CD1 4.39Å; F478-L481 WeakPolarHBondContact O-CB 3.26Å; F478-L481 PolarHBondContact O-N 3.45Å; F478-M482 VanDerWaalsContact O-CG 3.29Å; F478-M482 WeakPolarHBondContact O-CG 3.37Å; F478-M482 PolarHBondContact O-N 2.91Å; F478-V547 HydrophobicContact CB-CG2 3.61Å; F478-V547 HydrophobicContact CD2-CG2 4.2Å; F478-V547 HydrophobicContact CG-CG2 4.46Å; F478-V564 HydrophobicContact CE2-CG1 3.63Å; F478-V564 HydrophobicContact CZ-CG1 3.99Å; F478-L568 HydrophobicContact CE1-CD1 4.49Å; F478-L568 HydrophobicContact CE2-CD1 3.83Å; F478-L568 HydrophobicContact CZ-CD1 3.59Å
479	W	97.7	Very high	93.6	Very high	1 Å²	1	7.2 Å²	7.2	0%	0.004	4%	0.043	C	C	.	.	H	α-helix	trans	-60.6	-42.3	174.5	176.4	81.8	0	0	0	112.3	G475 L476 V477 L481 M482 M483 P503 P528 K529 W534 W544 V547 W551	G475-W479 PolarHBondContact O-N 3.18Å; G475-W479 VanDerWaalsContact O-N 3.09Å; L476-W479 WeakPolarHBondContact O-CB 3.45Å; L476-W479 PolarHBondContact O-N 3.39Å; V477-W479 VanDerWaalsContact C-N 3.33Å; V477-W479 PolarHBondContact O-N 3.29Å; W479-L481 VanDerWaalsContact C-N 3.32Å; W479-L481 PolarHBondContact O-N 2.96Å; W479-M482 PolarHBondContact O-N 3.23Å; W479-M483 HydrophobicContact CD2-CG 3.96Å; W479-M483 HydrophobicContact CE3-CG 4.26Å; W479-M483 HydrophobicContact CH2-CG 3.91Å; W479-M483 HydrophobicContact CZ2-CE 4.4Å; W479-M483 HydrophobicContact CZ2-CG 3.58Å; W479-M483 HydrophobicContact CZ2-SD 3.9Å; W479-M483 HydrophobicContact CZ3-CG 4.22Å; W479-M483 WeakPolarHBondContact O-CG 3.13Å; W479-M483 PolarHBondContact O-N 3.41Å; W479-P503 HydrophobicContact CE3-CB 4.39Å; W479-P503 HydrophobicContact CE3-CG 4.28Å; W479-P503 HydrophobicContact CZ3-CB 4.45Å; W479-P503 HydrophobicContact CZ3-CG 4.45Å; W479-P528 HydrophobicContact CD2-CB 3.67Å; W479-P528 HydrophobicContact CD2-CG 4.28Å; W479-P528 HydrophobicContact CE3-CB 4.25Å; W479-P528 HydrophobicContact CG-CB 4.06Å; W479-P528 HydrophobicContact CH2-CB 4.32Å; W479-P528 HydrophobicContact CZ2-CB 3.74Å; W479-K529 PolarHBondContact NE1-O 3Å; W479-W534 AromaticContact CD1-CH2 3.97Å; W479-W544 AromaticContact CD1-CZ3 3.83Å; W479-V547 HydrophobicContact CB-CG1 4.49Å; W479-W551 HydrophobicContact CB-CH2 4.11Å; W479-W551 HydrophobicContact CB-CZ3 3.76Å; W479-W551 HydrophobicContact CG-CH2 4.18Å; W479-W551 HydrophobicContact CG-CZ3 4.16Å
480	E	97.3	Very high	92.3	Very high	1 Å²	1	10.4 Å²	10.4	1%	0.005	6%	0.06	C	C	.	.	H	α-helix	trans	-58.6	-43.4	175.1	-68	170.1	-99.6	0	0	111.9	L366 S409 Y449 L476 V477 F478 M483 Y500 P503	L366-E480 HydrophobicContact CD1-CB 3.91Å; S409-E480 WeakPolarHBondContact CB-OE2 3.43Å; S409-E480 PolarHBondContact OG-OE2 3.49Å; Y449-E480 VanDerWaalsContact CE1-OE1 3.29Å; Y449-E480 WeakPolarHBondContact CE1-OE1 3.21Å; Y449-E480 VanDerWaalsContact OH-CD 3.27Å; Y449-E480 PolarHBondContact OH-OE1 3.16Å; Y449-E480 PolarHBondContact OH-OE2 3.14Å; L476-E480 PolarHBondContact O-N 3.39Å; L476-E480 VanDerWaalsContact O-N 3.09Å; V477-E480 WeakPolarHBondContact CA-OE1 3.48Å; V477-E480 PolarHBondContact O-N 3.44Å; F478-E480 VanDerWaalsContact C-N 3.34Å; F478-E480 PolarHBondContact O-N 2.84Å; E480-M483 PolarHBondContact O-N 3.24Å; E480-Y500 HydrophobicContact CG-CE2 4.46Å; E480-Y500 WeakPolarHBondContact OE2-CE2 3.1Å; E480-Y500 PolarHBondContact OE2-OH 3.22Å; E480-P503 HydrophobicContact CG-CG 3.75Å
481	L	97.2	Very high	90.8	Very high	1 Å²	1	15.7 Å²	15.7	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-63.4	-44.2	176.2	-69.3	164.6	0	0	0	111.6	V362 L366 I371 L376 I379 C380 V477 F478 W479 M483 R484 C485	V362-L481 HydrophobicContact CG1-CD2 3.72Å; V362-L481 HydrophobicContact CG1-CG 4.27Å; L366-L481 HydrophobicContact CD1-CD2 4.28Å; L366-L481 HydrophobicContact CD2-CD2 4.18Å; I371-L481 HydrophobicContact CD1-CD2 3.49Å; I371-L481 VanDerWaalsContact CD1-CD2 3.49Å; L376-L481 HydrophobicContact CD1-CB 4.47Å; L376-L481 HydrophobicContact CG-CB 4.37Å; I379-L481 HydrophobicContact CB-CD1 4.45Å; I379-L481 HydrophobicContact CB-CD2 4.48Å; I379-L481 HydrophobicContact CD1-CD2 4.29Å; I379-L481 HydrophobicContact CG2-CD1 3.68Å; I379-L481 HydrophobicContact CG2-CD2 3.82Å; I379-L481 HydrophobicContact CG2-CG 4.45Å; C380-L481 VanDerWaalsContact SG-CD1 3.53Å; V477-L481 HydrophobicContact CG1-CD1 4.38Å; V477-L481 WeakPolarHBondContact O-CG 3.45Å; V477-L481 PolarHBondContact O-N 3.45Å; V477-L481 VanDerWaalsContact O-N 3.11Å; F478-L481 HydrophobicContact CD1-CD1 4.39Å; F478-L481 WeakPolarHBondContact O-CB 3.26Å; F478-L481 PolarHBondContact O-N 3.45Å; W479-L481 VanDerWaalsContact C-N 3.32Å; W479-L481 PolarHBondContact O-N 2.96Å; L481-M483 VanDerWaalsContact C-N 3.35Å; L481-M483 PolarHBondContact O-N 3.11Å; L481-R484 PolarHBondContact O-N 2.9Å; L481-R484 VanDerWaalsContact O-N 3.14Å; L481-C485 PolarHBondContact O-N 3.4Å
482	M	95.7	Very high	88.9	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62.4	-38.7	178	-70.8	178.9	73.5	0	0	112.8	L376 F478 W479 R484 C485 W534 L540 L543 W544 V547	L376-M482 HydrophobicContact CD1-CG 4.24Å; F478-M482 VanDerWaalsContact O-CG 3.29Å; F478-M482 WeakPolarHBondContact O-CG 3.37Å; F478-M482 PolarHBondContact O-N 2.91Å; W479-M482 PolarHBondContact O-N 3.23Å; M482-R484 PolarHBondContact O-N 3.18Å; M482-R484 VanDerWaalsContact O-N 3.16Å; M482-C485 VanDerWaalsContact O-CB 3.32Å; M482-C485 WeakPolarHBondContact O-CB 3.34Å; M482-C485 PolarHBondContact O-N 3.31Å; M482-C485 VanDerWaalsContact O-N 3.12Å; M482-W534 HydrophobicContact CB-CH2 3.91Å; M482-W534 HydrophobicContact CB-CZ2 3.77Å; M482-W534 HydrophobicContact CE-CD2 4.12Å; M482-W534 HydrophobicContact CE-CE3 3.86Å; M482-W534 HydrophobicContact CE-CH2 4.46Å; M482-W534 HydrophobicContact CE-CZ3 4.05Å; M482-L540 HydrophobicContact CE-CB 4.45Å; M482-L540 HydrophobicContact CE-CD2 4Å; M482-L540 WeakPolarHBondContact CE-O 3.46Å; M482-L543 HydrophobicContact CE-CB 4.39Å; M482-L543 HydrophobicContact CE-CD2 4.27Å; M482-L543 HydrophobicContact CE-CG 4.31Å; M482-L543 HydrophobicContact CG-CD2 3.55Å; M482-L543 HydrophobicContact CG-CG 4.27Å; M482-L543 HydrophobicContact SD-CB 4.41Å; M482-L543 HydrophobicContact SD-CD2 3.67Å; M482-L543 HydrophobicContact SD-CG 3.71Å; M482-W544 HydrophobicContact CE-CB 4.05Å; M482-W544 HydrophobicContact CE-CE3 4.48Å; M482-V547 HydrophobicContact SD-CG2 3.93Å
483	M	94	Very high	87.2	Confident	21 Å²	21	23.7 Å²	23.7	10%	0.103	13%	0.129	C	C	.	.	H	α-helix	trans	-62.7	-19.7	176.6	-75.1	-62.4	-63.3	0	0	113.5	W479 E480 L481 N531 W534	W479-M483 HydrophobicContact CD2-CG 3.96Å; W479-M483 HydrophobicContact CE3-CG 4.26Å; W479-M483 HydrophobicContact CH2-CG 3.91Å; W479-M483 HydrophobicContact CZ2-CE 4.4Å; W479-M483 HydrophobicContact CZ2-CG 3.58Å; W479-M483 HydrophobicContact CZ2-SD 3.9Å; W479-M483 HydrophobicContact CZ3-CG 4.22Å; W479-M483 WeakPolarHBondContact O-CG 3.13Å; W479-M483 PolarHBondContact O-N 3.41Å; E480-M483 PolarHBondContact O-N 3.24Å; L481-M483 VanDerWaalsContact C-N 3.35Å; L481-M483 PolarHBondContact O-N 3.11Å; M483-N531 HydrophobicContact SD-CB 4.49Å; M483-W534 HydrophobicContact CG-CH2 4.2Å; M483-W534 HydrophobicContact CG-CZ2 4.2Å; M483-W534 HydrophobicContact SD-CH2 3.72Å; M483-W534 HydrophobicContact SD-CZ2 3.63Å
484	R	94.7	Very high	85.6	Confident	22 Å²	22	29.7 Å²	29.7	8%	0.083	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107	8.3	179.4	-61.9	-68	-65.5	159.9	2.5	112.9	L366 Y369 I371 L481 M482 C486 T498	L366-R484 HydrophobicContact CB-CG 4.23Å; L366-R484 HydrophobicContact CD1-CG 4.41Å; L366-R484 HydrophobicContact CD2-CB 3.61Å; L366-R484 HydrophobicContact CD2-CG 3.78Å; L366-R484 HydrophobicContact CG-CG 4.36Å; L366-R484 PolarHBondContact O-NE 3.47Å; L366-R484 PolarHBondContact O-NH2 2.02Å; Y369-R484 VanDerWaalsContact C-NH2 3.26Å; Y369-R484 PolarHBondContact O-NE 3.39Å; Y369-R484 PolarHBondContact O-NH2 3.28Å; I371-R484 PolarHBondContact N-O 2.91Å; L481-R484 PolarHBondContact O-N 2.9Å; L481-R484 VanDerWaalsContact O-N 3.14Å; M482-R484 PolarHBondContact O-N 3.18Å; M482-R484 VanDerWaalsContact O-N 3.16Å; R484-C486 PolarHBondContact O-N 3.31Å; R484-T498 PolarHBondContact NH1-O 2.94Å
485	C	92.8	Very high	84.4	Confident	2 Å²	2	30.3 Å²	30.3	1%	0.014	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-76.8	116.2	176.4	-157.6	0	0	0	0	110.9	I371 L376 L481 M482 C487 L540	I371-C485 CarbonylContact O-C 3.6Å; I371-C485 VanDerWaalsContact O-CA 3.28Å; I371-C485 WeakPolarHBondContact O-CA 3.29Å; L376-C485 HydrophobicContact CD1-CB 3.62Å; L376-C485 VanDerWaalsContact CD1-SG 3.6Å; L481-C485 PolarHBondContact O-N 3.4Å; M482-C485 VanDerWaalsContact O-CB 3.32Å; M482-C485 WeakPolarHBondContact O-CB 3.34Å; M482-C485 PolarHBondContact O-N 3.31Å; M482-C485 VanDerWaalsContact O-N 3.12Å; C485-C487 PolarHBondContact SG-O 2.93Å; C485-L540 HydrophobicContact CB-CD2 4.43Å
486	C	86.1	Confident	83.5	Confident	19 Å²	19	36.7 Å²	36.7	13%	0.128	20%	0.198	C	C	.	.	S	Bend	trans	-79.1	-29.3	-176.3	60.4	0	0	0	0	114	D370 I371 Q372 R484 I495 I497	D370-C486 HydrophobicContact CB-CB 4.13Å; I371-C486 PolarHBondContact O-N 3.27Å; I371-C486 PolarHBondContact O-SG 3.24Å; Q372-C486 PolarHBondContact NE2-SG 3.36Å; Q372-C486 PolarHBondContact OE1-SG 3.41Å; R484-C486 PolarHBondContact O-N 3.31Å; C486-I495 PolarHBondContact O-N 3.07Å; C486-I497 HydrophobicContact CB-CD1 3.23Å; C486-I497 HydrophobicContact CB-CG1 4.17Å
487	C	79	Confident	82.6	Confident	19 Å²	19	38.9 Å²	38.9	13%	0.128	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-135.9	139.8	-177.2	60.9	0	0	0	0	108.4	Q372 C485	Q372-C487 PolarHBondContact OE1-SG 3Å; C485-C487 PolarHBondContact SG-O 2.93Å
488	G	74.2	Confident	81.7	Confident	2 Å²	2	41.3 Å²	41.3	2%	0.021	22%	0.224	C	C	.	.			trans	-74.9	-171.2	169.3	0	0	0	0	0	111.8	N490 D537	G488-N490 PolarHBondContact O-N 3.44Å; G488-D537 VanDerWaalsContact C-OD2 3.3Å; G488-D537 VanDerWaalsContact CA-OD2 3.3Å; G488-D537 WeakPolarHBondContact CA-OD2 3.39Å
489	S	72.6	Confident	81.3	Confident	38 Å²	38	48 Å²	48	27%	0.266	26%	0.26	S	S	.	.	S	Bend	trans	-54.4	-31.3	165.4	-174.8	0	0	0	0	112.3	D537	S489-D537 WeakPolarHBondContact CA-OD2 3.45Å; S489-D537 WeakPolarHBondContact CB-OD1 3.1Å; S489-D537 PolarHBondContact N-OD1 2.84Å; S489-D537 PolarHBondContact N-OD2 3.42Å
490	N	70.3	Confident	81.1	Confident	84 Å²	84	49.1 Å²	49.1	45%	0.449	26%	0.264	S	S	.	.	S	Bend	trans	-89.7	107.6	170.7	-170.9	-7.7	0	0	0	111.4	G488 N492 A493 D537	G488-N490 PolarHBondContact O-N 3.44Å; N490-N492 PolarHBondContact O-N 3.26Å; N490-N492 PolarHBondContact OD1-N 3.47Å; N490-N492 VanDerWaalsContact OD1-N 3.16Å; N490-A493 PolarHBondContact O-N 3.19Å; N490-D537 PolarHBondContact N-OD2 2.98Å
491	K	65.6	Low	81	Confident	113 Å²	113	51.2 Å²	51.2	49%	0.491	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-23.3	178.5	-69.3	-175.7	-179.9	176.8	0	113.9	A493 D583	K491-A493 VanDerWaalsContact C-N 3.32Å; K491-D583 IonicContact NZ-OD1 3.34Å; K491-D583 PolarHBondContact NZ-OD1 2.97Å; K491-D583 IonicContact NZ-OD2 3.44Å
492	N	60.6	Low	80.9	Confident	148 Å²	148	51.7 Å²	51.7	79%	0.791	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-10.6	-179.1	-66	-5.9	0	0	0	113.3	N490 T494	N490-N492 PolarHBondContact O-N 3.26Å; N490-N492 PolarHBondContact OD1-N 3.47Å; N490-N492 VanDerWaalsContact OD1-N 3.16Å; N492-T494 PolarHBondContact O-N 3.09Å
493	A	62.4	Low	80.9	Confident	22 Å²	22	51.7 Å²	51.7	18%	0.182	28%	0.279	C	S	.	.			trans	-90.7	97.2	174.8	0	0	0	0	0	109.5	N490 K491 I495	N490-A493 PolarHBondContact O-N 3.19Å; K491-A493 VanDerWaalsContact C-N 3.32Å; A493-I495 PolarHBondContact O-N 3.09Å
494	T	64.2	Low	81.1	Confident	130 Å²	130	50.7 Å²	50.7	80%	0.798	27%	0.274	S	S	*	.	B	Isolated β-bridge	trans	-74.7	117.4	168	48.5	0	0	0	0	109.1	N492	N492-T494 PolarHBondContact O-N 3.09Å
495	I	74.8	Confident	81.1	Confident	13 Å²	13	52.1 Å²	52.1	7%	0.067	28%	0.282	C	S	.	.			trans	-94.5	127.6	175.9	-61.1	167.7	0	0	0	107.4	C486 A493 I497 Q533 L540	C486-I495 PolarHBondContact O-N 3.07Å; A493-I495 PolarHBondContact O-N 3.09Å; I495-I497 WeakPolarHBondContact O-CG1 3.24Å; I495-I497 PolarHBondContact O-N 3.14Å; I495-Q533 HydrophobicContact CG2-CB 4.09Å; I495-L540 HydrophobicContact CD1-CD1 3.35Å
496	H	78.2	Confident	81.1	Confident	135 Å²	135	56.8 Å²	56.8	63%	0.625	31%	0.306	S	S	*	.			trans	-66.9	115.1	172.6	178.3	-73.5	0	0	0	109.7	Q533	H496-Q533 PolarHBondContact O-NE2 2.84Å
497	I	79.4	Confident	81.5	Confident	46 Å²	46	57.5 Å²	57.5	24%	0.236	31%	0.307	C	S	.	.	P	Polyproline II helix	trans	-89.9	129.8	-177.3	-46.9	173	0	0	0	109.5	D370 C486 I495	D370-I497 HydrophobicContact CB-CD1 3.58Å; C486-I497 HydrophobicContact CB-CD1 3.23Å; C486-I497 HydrophobicContact CB-CG1 4.17Å; I495-I497 WeakPolarHBondContact O-CG1 3.24Å; I495-I497 PolarHBondContact O-N 3.14Å
498	T	80.1	Confident	82.3	Confident	51 Å²	51	58.9 Å²	58.9	31%	0.313	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-89.8	161.7	169.9	59.6	0	0	0	0	110.3	R484	R484-T498 PolarHBondContact NH1-O 2.94Å
499	N	90.6	Very high	83.3	Confident	140 Å²	140	59.9 Å²	59.9	75%	0.749	32%	0.324	S	S	*	.	P	Polyproline II helix	trans	-51.8	157	163.4	-67.3	-23.2	0	0	0	110.5	L501	N499-L501 PolarHBondContact O-N 3.18Å
500	Y	94.4	Very high	84.2	Confident	24 Å²	24	62.6 Å²	62.6	9%	0.094	34%	0.34	C	S	.	.	P	Polyproline II helix	trans	-52.7	137.4	174.5	169.8	-84.8	0	0	0	110.7	Y363 L366 H367 E480 A502	Y363-Y500 HydrophobicContact CD2-CE1 4.12Å; Y363-Y500 HydrophobicContact CD2-CE2 4.33Å; Y363-Y500 AromaticContact CD2-CZ 3.66Å; Y363-Y500 VanDerWaalsContact CD2-OH 3.26Å; Y363-Y500 WeakPolarHBondContact CD2-OH 3.5Å; Y363-Y500 AromaticContact CE2-CE1 3.63Å; Y363-Y500 HydrophobicContact CE2-CE1 3.63Å; Y363-Y500 AromaticContact CE2-CZ 3.65Å; Y363-Y500 WeakPolarHBondContact CE2-OH 3.43Å; L366-Y500 HydrophobicContact CB-CD2 3.68Å; L366-Y500 HydrophobicContact CB-CE2 4.27Å; L366-Y500 HydrophobicContact CD1-CD2 4.19Å; L366-Y500 HydrophobicContact CD1-CE2 4.2Å; H367-Y500 AromaticContact CE1-CD1 2.98Å; H367-Y500 WeakPolarHBondContact CE1-CD1 3.1Å; H367-Y500 AromaticContact CE1-CD2 3.95Å; H367-Y500 AromaticContact CE1-CE1 3.23Å; H367-Y500 WeakPolarHBondContact CE1-CE1 3.39Å; H367-Y500 AromaticContact CE1-CG 3.38Å; H367-Y500 AromaticContact CE1-CZ 3.78Å; H367-Y500 AromaticContact ND1-CD1 3.76Å; H367-Y500 AromaticContact ND1-CG 3.67Å; H367-Y500 AromaticContact NE2-CD1 3.22Å; H367-Y500 WeakPolarHBondContact NE2-CD1 3.14Å; H367-Y500 AromaticContact NE2-CE1 3.68Å; H367-Y500 AromaticContact NE2-CG 3.88Å; E480-Y500 HydrophobicContact CG-CE2 4.46Å; E480-Y500 WeakPolarHBondContact OE2-CE2 3.1Å; E480-Y500 PolarHBondContact OE2-OH 3.22Å; Y500-A502 HydrophobicContact CE1-CB 4.2Å
501	L	93.5	Very high	85.2	Confident	45 Å²	45	67.3 Å²	67.3	24%	0.236	36%	0.36	C	S	.	.			trans	-134.3	132.1	174.3	-68.8	167.7	0	0	0	107.7	N499 E505 I506	N499-L501 PolarHBondContact O-N 3.18Å; L501-E505 HydrophobicContact CD2-CG 4.15Å; L501-I506 HydrophobicContact CD1-CD1 3.82Å; L501-I506 HydrophobicContact CD1-CG1 3.73Å
502	A	95.2	Very high	86.5	Confident	11 Å²	11	62.7 Å²	62.7	9%	0.091	34%	0.341	C	S	.	.			trans	-70.3	156.7	174.5	0	0	0	0	0	110.9	Y500 Y504 E505	Y500-A502 HydrophobicContact CE1-CB 4.2Å; A502-Y504 PolarHBondContact O-N 2.88Å; A502-E505 HydrophobicContact CB-CB 4.3Å; A502-E505 WeakPolarHBondContact CB-OE2 3.47Å; A502-E505 PolarHBondContact N-OE2 3.01Å; A502-E505 WeakPolarHBondContact O-CB 3.38Å; A502-E505 PolarHBondContact O-N 3.03Å
503	P	96.7	Very high	88	Confident	0 Å²	0	58 Å²	58	0%	0	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54	134.6	176.6	-25.2	32.9	0	0	0	111.6	R448 Y449 L476 W479 E480 E505 P528	R448-P503 WeakPolarHBondContact CD-O 3.03Å; R448-P503 HydrophobicContact CG-CB 4.25Å; R448-P503 WeakPolarHBondContact CG-O 2.87Å; R448-P503 VanDerWaalsContact CZ-O 3.3Å; R448-P503 PolarHBondContact NE-O 3.14Å; R448-P503 PolarHBondContact NH1-O 2.87Å; Y449-P503 HydrophobicContact CE1-CG 3.99Å; L476-P503 HydrophobicContact CB-CB 4.32Å; L476-P503 HydrophobicContact CB-CG 4.04Å; L476-P503 HydrophobicContact CD2-CB 4.05Å; W479-P503 HydrophobicContact CE3-CB 4.39Å; W479-P503 HydrophobicContact CE3-CG 4.28Å; W479-P503 HydrophobicContact CZ3-CB 4.45Å; W479-P503 HydrophobicContact CZ3-CG 4.45Å; E480-P503 HydrophobicContact CG-CG 3.75Å; P503-E505 PolarHBondContact O-N 2.78Å; P503-P528 HydrophobicContact CB-CG 4.26Å
504	Y	97.3	Very high	89.4	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	67	6.2	-175.7	-41.8	-78.5	0	0	0	116.2	R448 Y472 L476 A502 E507 L508 L517 W520 V521 P528	R448-Y504 HydrophobicContact CG-CD2 3.77Å; R448-Y504 VanDerWaalsContact NH1-C 3.34Å; R448-Y504 PolarHBondContact NH1-O 3Å; R448-Y504 VanDerWaalsContact O-CE2 3.25Å; R448-Y504 WeakPolarHBondContact O-CE2 3.27Å; Y472-Y504 PolarHBondContact OH-OH 2.8Å; L476-Y504 HydrophobicContact CD1-CE2 4.05Å; L476-Y504 HydrophobicContact CD2-CE2 3.87Å; L476-Y504 WeakPolarHBondContact CD2-OH 3.33Å; A502-Y504 PolarHBondContact O-N 2.88Å; Y504-E507 WeakPolarHBondContact CA-OE2 3.11Å; Y504-E507 PolarHBondContact O-N 2.97Å; Y504-L508 WeakPolarHBondContact O-CB 3.25Å; Y504-L508 PolarHBondContact O-N 2.97Å; Y504-L517 HydrophobicContact CD2-CD2 4.15Å; Y504-L517 HydrophobicContact CG-CD2 4.35Å; Y504-W520 AromaticContact CD1-CD1 3.87Å; Y504-V521 HydrophobicContact CD1-CG2 4.16Å; Y504-V521 HydrophobicContact CE1-CG2 3.57Å; Y504-V521 HydrophobicContact CE2-CG2 4.28Å; Y504-P528 HydrophobicContact CD1-CG 4.23Å; Y504-P528 HydrophobicContact CE1-CG 4.01Å; Y504-P528 HydrophobicContact CE2-CG 4.5Å
505	E	95.9	Very high	90.8	Very high	53 Å²	53	53.5 Å²	53.5	25%	0.248	29%	0.286	C	S	.	.	H	α-helix	trans	-68.8	-35.7	178.1	-177.5	166.6	172.8	0	0	112.2	L501 A502 P503 E507 G509	L501-E505 HydrophobicContact CD2-CG 4.15Å; A502-E505 HydrophobicContact CB-CB 4.3Å; A502-E505 WeakPolarHBondContact CB-OE2 3.47Å; A502-E505 PolarHBondContact N-OE2 3.01Å; A502-E505 WeakPolarHBondContact O-CB 3.38Å; A502-E505 PolarHBondContact O-N 3.03Å; P503-E505 PolarHBondContact O-N 2.78Å; E505-E507 VanDerWaalsContact C-N 3.31Å; E505-E507 PolarHBondContact O-N 3.44Å; E505-G509 WeakPolarHBondContact CA-O 3.36Å; E505-G509 WeakPolarHBondContact O-CA 3.05Å; E505-G509 PolarHBondContact O-N 3.05Å
506	I	92.7	Very high	91.9	Very high	99 Å²	99	54.3 Å²	54.3	51%	0.508	30%	0.295	S	S	.	.	H	α-helix	trans	-64.4	-40.3	176.2	-62.6	171	0	0	0	110.4	L501	L501-I506 HydrophobicContact CD1-CD1 3.82Å; L501-I506 HydrophobicContact CD1-CG1 3.73Å
507	E	94.4	Very high	92.7	Very high	35 Å²	35	47.9 Å²	47.9	16%	0.164	27%	0.265	C	S	.	.	H	α-helix	trans	-85.6	-40	-172	-63.1	79.8	-179.6	0	0	113.1	Y504 E505 W520 K529	Y504-E507 WeakPolarHBondContact CA-OE2 3.11Å; Y504-E507 PolarHBondContact O-N 2.97Å; E505-E507 VanDerWaalsContact C-N 3.31Å; E505-E507 PolarHBondContact O-N 3.44Å; E507-W520 HydrophobicContact CB-CH2 4.49Å; E507-W520 HydrophobicContact CB-CZ2 3.76Å; E507-W520 HydrophobicContact CG-CZ2 3.61Å; E507-K529 PolarHBondContact OE1-N 3.18Å
508	L	96	Very high	93.5	Very high	47 Å²	47	47.9 Å²	47.9	25%	0.246	26%	0.264	C	S	.	.	H	α-helix	trans	-123.8	-0.9	-169.4	-54.5	177.2	0	0	0	113.6	Y504 P512 L517 W520	Y504-L508 WeakPolarHBondContact O-CB 3.25Å; Y504-L508 PolarHBondContact O-N 2.97Å; L508-P512 HydrophobicContact CB-CB 3.75Å; L508-P512 HydrophobicContact CD1-CB 4.07Å; L508-L517 HydrophobicContact CD1-CD2 3.83Å; L508-L517 HydrophobicContact CD1-CG 4.33Å; L508-W520 HydrophobicContact CD1-CB 3.92Å; L508-W520 HydrophobicContact CD1-CG 4.06Å; L508-W520 HydrophobicContact CD2-CB 4.07Å; L508-W520 HydrophobicContact CD2-CD2 4.01Å; L508-W520 HydrophobicContact CD2-CE3 4.14Å; L508-W520 HydrophobicContact CD2-CG 3.99Å; L508-W520 HydrophobicContact CG-CB 4.48Å; L508-W520 HydrophobicContact CG-CG 4.27Å
509	G	93.9	Very high	94.3	Very high	24 Å²	24	51.8 Å²	51.8	25%	0.247	27%	0.273	C	S	.	.			trans	83.5	-179.4	-177.1	0	0	0	0	0	114.7	R448 E505 Q511	R448-G509 PolarHBondContact NH2-O 3.35Å; E505-G509 WeakPolarHBondContact CA-O 3.36Å; E505-G509 WeakPolarHBondContact O-CA 3.05Å; E505-G509 PolarHBondContact O-N 3.05Å; G509-Q511 VanDerWaalsContact C-N 3.32Å; G509-Q511 PolarHBondContact O-N 3.14Å
510	P	91.6	Very high	94.6	Very high	95 Å²	95	48.7 Å²	48.7	62%	0.617	25%	0.251	S	S	*	.	S	Bend	trans	-71	-22.1	-169.8	26.6	-35.3	0	0	0	114.2	R448	R448-P510 PolarHBondContact NH2-O 3.37Å
511	Q	90.8	Very high	94.8	Very high	182 Å²	182	47.6 Å²	47.6	85%	0.85	25%	0.247	S	C	*	.	S	Bend	trans	-139	75.3	-179.4	-65.5	-175.1	-1.8	0	0	111.4	G509	G509-Q511 VanDerWaalsContact C-N 3.32Å; G509-Q511 PolarHBondContact O-N 3.14Å
512	P	93.3	Very high	94.8	Very high	16 Å²	16	45.7 Å²	45.7	10%	0.104	24%	0.237	C	C	.	.			trans	-69.8	142.6	-179	31.7	-38.7	0	0	0	110.9	R448 L508 L517	R448-P512 VanDerWaalsContact CZ-CD 3.41Å; L508-P512 HydrophobicContact CB-CB 3.75Å; L508-P512 HydrophobicContact CD1-CB 4.07Å; P512-L517 HydrophobicContact CB-CD1 4.39Å; P512-L517 HydrophobicContact CB-CD2 4.33Å; P512-L517 HydrophobicContact CB-CG 3.98Å; P512-L517 HydrophobicContact CG-CD1 3.93Å; P512-L517 HydrophobicContact CG-CD2 4.01Å; P512-L517 HydrophobicContact CG-CG 3.91Å
513	S	93.5	Very high	94.8	Very high	49 Å²	49	50.3 Å²	50.3	34%	0.343	26%	0.257	S	S	.	.			trans	-69.1	161.8	171.4	91.8	0	0	0	0	110.8	E515 A516 L517	S513-E515 VanDerWaalsContact C-N 3.27Å; S513-E515 VanDerWaalsContact CB-OE2 3.25Å; S513-E515 WeakPolarHBondContact CB-OE2 3.27Å; S513-E515 PolarHBondContact O-N 3.3Å; S513-E515 PolarHBondContact OG-N 2.98Å; S513-E515 PolarHBondContact OG-OE2 2.86Å; S513-A516 PolarHBondContact O-N 3.38Å; S513-A516 PolarHBondContact OG-N 3.28Å; S513-A516 VanDerWaalsContact OG-N 3.07Å; S513-L517 PolarHBondContact O-N 2.99Å
514	M	91.4	Very high	94.8	Very high	14 Å²	14	52.6 Å²	52.6	7%	0.069	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-40.6	176.3	-171.8	66.3	173.8	0	0	110.9	Q443 R447 M450 L455 L517 Q518	Q443-M514 HydrophobicContact CG-CE 4.26Å; R447-M514 HydrophobicContact CG-SD 4.36Å; M450-M514 HydrophobicContact SD-CE 3.72Å; M450-M514 HydrophobicContact SD-SD 4.01Å; L455-M514 HydrophobicContact CD2-CE 3.61Å; L455-M514 HydrophobicContact CD2-SD 3.64Å; M514-L517 PolarHBondContact O-N 3.01Å; M514-Q518 WeakPolarHBondContact O-CB 3.31Å; M514-Q518 PolarHBondContact O-N 3.2Å
515	E	93.9	Very high	94.8	Very high	45 Å²	45	59.2 Å²	59.2	21%	0.21	31%	0.305	C	S	.	.	H	α-helix	trans	-67.5	-36.5	178.5	-53.4	73.6	-160.8	0	0	111.8	S513 R519	S513-E515 VanDerWaalsContact C-N 3.27Å; S513-E515 VanDerWaalsContact CB-OE2 3.25Å; S513-E515 WeakPolarHBondContact CB-OE2 3.27Å; S513-E515 PolarHBondContact O-N 3.3Å; S513-E515 PolarHBondContact OG-N 2.98Å; S513-E515 PolarHBondContact OG-OE2 2.86Å; E515-R519 WeakPolarHBondContact O-CB 3.44Å; E515-R519 VanDerWaalsContact O-CG 3.29Å; E515-R519 WeakPolarHBondContact O-CG 3.21Å; E515-R519 PolarHBondContact O-N 3.28Å
516	A	96.3	Very high	94.9	Very high	29 Å²	29	60.7 Å²	60.7	24%	0.24	31%	0.312	C	S	.	.	H	α-helix	trans	-64.9	-46.2	175.3	0	0	0	0	0	110.8	S513 R519 W520	S513-A516 PolarHBondContact O-N 3.38Å; S513-A516 PolarHBondContact OG-N 3.28Å; S513-A516 VanDerWaalsContact OG-N 3.07Å; A516-R519 PolarHBondContact O-N 3.06Å; A516-W520 VanDerWaalsContact O-CB 3.3Å; A516-W520 WeakPolarHBondContact O-CB 3.45Å; A516-W520 PolarHBondContact O-N 3.12Å
517	L	96.3	Very high	95.2	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-61.5	-46.1	174.4	-75.5	165.7	0	0	0	111.6	R447 L455 Y504 L508 P512 S513 M514 R519 W520 V521	R447-L517 HydrophobicContact CB-CD1 3.79Å; L455-L517 HydrophobicContact CD1-CB 4.24Å; L455-L517 HydrophobicContact CD2-CB 4.02Å; Y504-L517 HydrophobicContact CD2-CD2 4.15Å; Y504-L517 HydrophobicContact CG-CD2 4.35Å; L508-L517 HydrophobicContact CD1-CD2 3.83Å; L508-L517 HydrophobicContact CD1-CG 4.33Å; P512-L517 HydrophobicContact CB-CD1 4.39Å; P512-L517 HydrophobicContact CB-CD2 4.33Å; P512-L517 HydrophobicContact CB-CG 3.98Å; P512-L517 HydrophobicContact CG-CD1 3.93Å; P512-L517 HydrophobicContact CG-CD2 4.01Å; P512-L517 HydrophobicContact CG-CG 3.91Å; S513-L517 PolarHBondContact O-N 2.99Å; M514-L517 PolarHBondContact O-N 3.01Å; L517-R519 PolarHBondContact O-N 3.45Å; L517-W520 PolarHBondContact O-N 3.21Å; L517-V521 HydrophobicContact CD2-CG2 4.31Å; L517-V521 VanDerWaalsContact O-CB 3.25Å; L517-V521 WeakPolarHBondContact O-CB 3.47Å; L517-V521 WeakPolarHBondContact O-CG2 3.27Å; L517-V521 PolarHBondContact O-N 3.06Å
518	Q	95.6	Very high	95.3	Very high	46 Å²	46	55.9 Å²	55.9	22%	0.215	29%	0.286	C	S	.	.	I	π-helix	trans	-58.6	-48.9	178	-170.2	-176.8	16.7	0	0	111.6	L455 D456 M514 W520 A522 H523	L455-Q518 HydrophobicContact CB-CB 4.44Å; L455-Q518 HydrophobicContact CB-CG 4.44Å; D456-Q518 VanDerWaalsContact OD1-CG 3.28Å; D456-Q518 WeakPolarHBondContact OD1-CG 3.45Å; D456-Q518 PolarHBondContact OD1-NE2 3.42Å; M514-Q518 WeakPolarHBondContact O-CB 3.31Å; M514-Q518 PolarHBondContact O-N 3.2Å; Q518-W520 VanDerWaalsContact C-N 3.34Å; Q518-W520 PolarHBondContact O-N 3.43Å; Q518-A522 HydrophobicContact CG-CB 4.35Å; Q518-A522 WeakPolarHBondContact O-CA 3.41Å; Q518-A522 VanDerWaalsContact O-CB 3.31Å; Q518-A522 WeakPolarHBondContact O-CB 3.4Å; Q518-A522 PolarHBondContact O-N 3.44Å; Q518-H523 PolarHBondContact O-N 3.33Å
519	R	96.9	Very high	95.1	Very high	133 Å²	133	60.3 Å²	60.3	50%	0.502	30%	0.303	S	S	.	.	I	π-helix	trans	-61.9	-40.4	177.7	-71.7	-177.8	-166.6	107.4	-0.2	112.3	S103 E515 A516 L517 A524	S103-R519 PolarHBondContact OG-NH2 3.2Å; E515-R519 WeakPolarHBondContact O-CB 3.44Å; E515-R519 VanDerWaalsContact O-CG 3.29Å; E515-R519 WeakPolarHBondContact O-CG 3.21Å; E515-R519 PolarHBondContact O-N 3.28Å; A516-R519 PolarHBondContact O-N 3.06Å; L517-R519 PolarHBondContact O-N 3.45Å; R519-A524 WeakPolarHBondContact O-CB 3.15Å; R519-A524 PolarHBondContact O-N 3.04Å
520	W	97.4	Very high	95	Very high	74 Å²	74	62.3 Å²	62.3	28%	0.28	31%	0.305	S	S	.	.	I	π-helix	trans	-77.6	-52.8	-176.3	-167.8	-101.3	0	0	0	112.8	Y504 E507 L508 A516 L517 Q518 A524 K525 Q526	Y504-W520 AromaticContact CD1-CD1 3.87Å; E507-W520 HydrophobicContact CB-CH2 4.49Å; E507-W520 HydrophobicContact CB-CZ2 3.76Å; E507-W520 HydrophobicContact CG-CZ2 3.61Å; L508-W520 HydrophobicContact CD1-CB 3.92Å; L508-W520 HydrophobicContact CD1-CG 4.06Å; L508-W520 HydrophobicContact CD2-CB 4.07Å; L508-W520 HydrophobicContact CD2-CD2 4.01Å; L508-W520 HydrophobicContact CD2-CE3 4.14Å; L508-W520 HydrophobicContact CD2-CG 3.99Å; L508-W520 HydrophobicContact CG-CB 4.48Å; L508-W520 HydrophobicContact CG-CG 4.27Å; A516-W520 VanDerWaalsContact O-CB 3.3Å; A516-W520 WeakPolarHBondContact O-CB 3.45Å; A516-W520 PolarHBondContact O-N 3.12Å; L517-W520 PolarHBondContact O-N 3.21Å; Q518-W520 VanDerWaalsContact C-N 3.34Å; Q518-W520 PolarHBondContact O-N 3.43Å; W520-A524 CarbonylContact O-C 3.59Å; W520-A524 WeakPolarHBondContact O-CB 3.25Å; W520-K525 PolarHBondContact O-N 2.67Å; W520-Q526 HydrophobicContact CD2-CB 3.9Å; W520-Q526 HydrophobicContact CD2-CG 4.11Å; W520-Q526 VanDerWaalsContact CE2-CB 3.42Å; W520-Q526 HydrophobicContact CG-CB 3.99Å; W520-Q526 HydrophobicContact CH2-CG 4.42Å; W520-Q526 HydrophobicContact CZ2-CB 3.92Å; W520-Q526 HydrophobicContact CZ2-CG 4Å; W520-Q526 VanDerWaalsContact NE1-CB 3.25Å; W520-Q526 WeakPolarHBondContact O-CB 3.28Å; W520-Q526 PolarHBondContact O-N 3.27Å
521	V	97.2	Very high	95	Very high	1 Å²	1	59.1 Å²	59.1	1%	0.006	28%	0.283	C	S	.	.	I	π-helix	trans	-83.6	-49.4	-170.9	177.8	0	0	0	0	111.5	P452 L455 Y472 Y504 L517 K525 R527 Q553	P452-V521 HydrophobicContact CB-CG1 4.44Å; L455-V521 HydrophobicContact CD1-CB 3.67Å; L455-V521 HydrophobicContact CD1-CG1 3.79Å; L455-V521 HydrophobicContact CD1-CG2 4.29Å; Y472-V521 WeakPolarHBondContact OH-CG1 3.03Å; Y504-V521 HydrophobicContact CD1-CG2 4.16Å; Y504-V521 HydrophobicContact CE1-CG2 3.57Å; Y504-V521 HydrophobicContact CE2-CG2 4.28Å; L517-V521 HydrophobicContact CD2-CG2 4.31Å; L517-V521 VanDerWaalsContact O-CB 3.25Å; L517-V521 WeakPolarHBondContact O-CB 3.47Å; L517-V521 WeakPolarHBondContact O-CG2 3.27Å; L517-V521 PolarHBondContact O-N 3.06Å; V521-K525 WeakPolarHBondContact O-CA 3.26Å; V521-R527 PolarHBondContact O-NH1 3.29Å; V521-Q553 PolarHBondContact O-OE1 3.46Å
522	A	94.7	Very high	95	Very high	5 Å²	5	55.4 Å²	55.4	4%	0.041	27%	0.274	C	S	.	.	I	π-helix	trans	-85.1	-48.9	-173.3	0	0	0	0	0	111.7	P452 L455 D456 Q518 Q553	P452-A522 HydrophobicContact CB-CB 4.01Å; L455-A522 HydrophobicContact CB-CB 4.36Å; D456-A522 WeakPolarHBondContact OD1-CB 3.31Å; D456-A522 WeakPolarHBondContact OD2-CB 3.16Å; Q518-A522 HydrophobicContact CG-CB 4.35Å; Q518-A522 WeakPolarHBondContact O-CA 3.41Å; Q518-A522 VanDerWaalsContact O-CB 3.31Å; Q518-A522 WeakPolarHBondContact O-CB 3.4Å; Q518-A522 PolarHBondContact O-N 3.44Å; A522-Q553 PolarHBondContact O-NE2 3.33Å
523	H	95.8	Very high	94.7	Very high	109 Å²	109	57.9 Å²	57.9	51%	0.505	29%	0.285	S	S	.	.	I	π-helix	trans	-83.6	-51.1	-175.9	-56.2	170.1	0	0	0	113.2	D456 Q518 K525	D456-H523 IonicContact OD1-CD2 3.61Å; D456-H523 IonicContact OD1-NE2 3.3Å; D456-H523 PolarHBondContact OD1-NE2 3.16Å; Q518-H523 PolarHBondContact O-N 3.33Å; H523-K525 VanDerWaalsContact C-N 3.26Å; H523-K525 PolarHBondContact O-N 3.16Å
524	A	96.8	Very high	94.5	Very high	48 Å²	48	55.6 Å²	55.6	40%	0.397	27%	0.268	S	S	.	.	S	Bend	trans	-82.2	-5.2	-179.5	0	0	0	0	0	113.2	R519 W520 Q526	R519-A524 WeakPolarHBondContact O-CB 3.15Å; R519-A524 PolarHBondContact O-N 3.04Å; W520-A524 CarbonylContact O-C 3.59Å; W520-A524 WeakPolarHBondContact O-CB 3.25Å; A524-Q526 HydrophobicContact CB-CG 3.9Å; A524-Q526 PolarHBondContact O-N 3.07Å; A524-Q526 PolarHBondContact O-NE2 3.47Å
525	K	97.2	Very high	94.4	Very high	138 Å²	138	58.1 Å²	58.1	60%	0.6	29%	0.292	S	S	*	.			trans	53.6	34.4	178.1	-55.4	-176.6	179.4	-173.6	0	113.1	W520 V521 H523 Q553	W520-K525 PolarHBondContact O-N 2.67Å; V521-K525 WeakPolarHBondContact O-CA 3.26Å; H523-K525 VanDerWaalsContact C-N 3.26Å; H523-K525 PolarHBondContact O-N 3.16Å; K525-Q553 HydrophobicContact CD-CG 4.03Å; K525-Q553 HydrophobicContact CG-CG 4.15Å
526	Q	97.7	Very high	94	Very high	85 Å²	85	60.3 Å²	60.3	40%	0.397	31%	0.312	S	S	.	.			trans	-89.4	151.7	-179.9	-59.8	-59.1	-52.8	0	0	111	W520 A524	W520-Q526 HydrophobicContact CD2-CB 3.9Å; W520-Q526 HydrophobicContact CD2-CG 4.11Å; W520-Q526 VanDerWaalsContact CE2-CB 3.42Å; W520-Q526 HydrophobicContact CG-CB 3.99Å; W520-Q526 HydrophobicContact CH2-CG 4.42Å; W520-Q526 HydrophobicContact CZ2-CB 3.92Å; W520-Q526 HydrophobicContact CZ2-CG 4Å; W520-Q526 VanDerWaalsContact NE1-CB 3.25Å; W520-Q526 WeakPolarHBondContact O-CB 3.28Å; W520-Q526 PolarHBondContact O-N 3.27Å; A524-Q526 HydrophobicContact CB-CG 3.9Å; A524-Q526 PolarHBondContact O-N 3.07Å; A524-Q526 PolarHBondContact O-NE2 3.47Å
527	R	97.6	Very high	93.7	Very high	30 Å²	30	59.1 Å²	59.1	11%	0.113	30%	0.302	C	S	.	.			trans	-132.8	166.7	178.2	-63.9	-62.5	-179.7	-88.1	-0.9	109.4	V521 K529 W551	V521-R527 PolarHBondContact O-NH1 3.29Å; R527-K529 PolarHBondContact O-N 2.98Å; R527-W551 HydrophobicContact CB-CD2 4.44Å; R527-W551 HydrophobicContact CB-CZ2 4.1Å; R527-W551 HydrophobicContact CG-CD2 4.33Å; R527-W551 HydrophobicContact CG-CG 4.29Å; R527-W551 PolarHBondContact NE-O 2.93Å; R527-W551 PolarHBondContact NH2-O 3.04Å; R527-W551 VanDerWaalsContact NH2-O 3.13Å
528	P	96.3	Very high	93.3	Very high	2 Å²	2	61 Å²	61	1%	0.013	32%	0.321	C	S	.	.	P	Polyproline II helix	trans	-54.9	137.5	170.2	-23.2	35.7	0	0	0	110.4	L476 W479 P503 Y504 W551	L476-P528 HydrophobicContact CD2-CG 3.88Å; W479-P528 HydrophobicContact CD2-CB 3.67Å; W479-P528 HydrophobicContact CD2-CG 4.28Å; W479-P528 HydrophobicContact CE3-CB 4.25Å; W479-P528 HydrophobicContact CG-CB 4.06Å; W479-P528 HydrophobicContact CH2-CB 4.32Å; W479-P528 HydrophobicContact CZ2-CB 3.74Å; P503-P528 HydrophobicContact CB-CG 4.26Å; Y504-P528 HydrophobicContact CD1-CG 4.23Å; Y504-P528 HydrophobicContact CE1-CG 4.01Å; Y504-P528 HydrophobicContact CE2-CG 4.5Å; P528-W551 HydrophobicContact CB-CH2 4.35Å; P528-W551 HydrophobicContact CG-CH2 4.39Å; P528-W551 HydrophobicContact CG-CZ3 4.13Å
529	K	92.5	Very high	93.2	Very high	141 Å²	141	59 Å²	59	61%	0.613	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-72.2	148.1	-172.3	-66	179.9	-176.9	177.3	0	112.9	W479 E507 R527	W479-K529 PolarHBondContact NE1-O 3Å; E507-K529 PolarHBondContact OE1-N 3.18Å; R527-K529 PolarHBondContact O-N 2.98Å
530	F	92.6	Very high	93	Very high	66 Å²	66	52.7 Å²	52.7	29%	0.289	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-61.7	135	165.8	-179.3	-103.7	0	0	0	110.5	P532 W534 A535 W544	F530-P532 WeakPolarHBondContact O-CD 3.24Å; F530-W534 AromaticContact CD2-CE3 3.58Å; F530-W534 HydrophobicContact CD2-CE3 3.58Å; F530-W534 HydrophobicContact CD2-CZ3 4.17Å; F530-W534 HydrophobicContact CE1-CB 4.38Å; F530-W534 HydrophobicContact CE2-CB 3.74Å; F530-W534 HydrophobicContact CE2-CD2 4.43Å; F530-W534 AromaticContact CE2-CE3 3.71Å; F530-W534 HydrophobicContact CE2-CE3 3.71Å; F530-W534 HydrophobicContact CG-CE3 4.31Å; F530-W534 HydrophobicContact CZ-CB 3.59Å; F530-W534 HydrophobicContact CZ-CE3 4.5Å; F530-A535 HydrophobicContact CE1-CB 3.98Å; F530-A535 HydrophobicContact CZ-CB 4.15Å; F530-W544 HydrophobicContact CB-CH2 4.1Å; F530-W544 HydrophobicContact CB-CZ2 3.66Å; F530-W544 HydrophobicContact CD2-CB 4.42Å; F530-W544 AromaticContact CD2-CD1 3.68Å; F530-W544 AromaticContact CD2-CD2 3.49Å; F530-W544 HydrophobicContact CD2-CD2 3.49Å; F530-W544 VanDerWaalsContact CD2-CD2 3.49Å; F530-W544 AromaticContact CD2-CE2 3.49Å; F530-W544 VanDerWaalsContact CD2-CE2 3.49Å; F530-W544 HydrophobicContact CD2-CE3 4.12Å; F530-W544 AromaticContact CD2-CG 3.6Å; F530-W544 HydrophobicContact CD2-CG 3.6Å; F530-W544 HydrophobicContact CD2-CZ2 4.08Å; F530-W544 AromaticContact CD2-NE1 3.61Å; F530-W544 HydrophobicContact CE2-CB 4.18Å; F530-W544 AromaticContact CE2-CD1 3.86Å; F530-W544 HydrophobicContact CE2-CD2 4.13Å; F530-W544 AromaticContact CE2-CG 3.76Å; F530-W544 HydrophobicContact CE2-CG 3.76Å; F530-W544 HydrophobicContact CG-CZ2 4.37Å
531	N	90.9	Very high	92.9	Very high	27 Å²	27	50.7 Å²	50.7	14%	0.144	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-83.4	118.1	171.7	-175.9	-21.4	0	0	0	109.4	M483 Q533 W534	M483-N531 HydrophobicContact SD-CB 4.49Å; N531-Q533 PolarHBondContact O-N 3.09Å; N531-Q533 WeakPolarHBondContact OD1-CB 3.01Å; N531-Q533 WeakPolarHBondContact OD1-CG 3.41Å; N531-Q533 PolarHBondContact OD1-N 3.39Å; N531-Q533 VanDerWaalsContact OD1-N 3.13Å; N531-Q533 PolarHBondContact OD1-NE2 2.93Å; N531-W534 HydrophobicContact CB-CD2 3.59Å; N531-W534 VanDerWaalsContact CB-CE2 3.46Å; N531-W534 HydrophobicContact CB-CE3 3.88Å; N531-W534 HydrophobicContact CB-CG 4.12Å; N531-W534 HydrophobicContact CB-CH2 3.92Å; N531-W534 HydrophobicContact CB-CZ2 3.64Å; N531-W534 HydrophobicContact CB-CZ3 4.03Å; N531-W534 WeakPolarHBondContact O-CB 3.49Å; N531-W534 PolarHBondContact O-N 3.19Å
532	P	90.1	Very high	92.8	Very high	104 Å²	104	53.7 Å²	53.7	68%	0.675	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-55.6	-23.9	-177	-27	35.6	0	0	0	114.9	F530 W534 A535	F530-P532 WeakPolarHBondContact O-CD 3.24Å; P532-W534 PolarHBondContact O-N 3.34Å; P532-A535 WeakPolarHBondContact O-CB 3.25Å; P532-A535 PolarHBondContact O-N 3.28Å
533	Q	87.2	Confident	92.9	Very high	68 Å²	68	53.4 Å²	53.4	32%	0.318	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-63.6	-28.9	177.3	-64.9	-179.4	77	0	0	112.6	I495 H496 N531 A535 S536	I495-Q533 HydrophobicContact CG2-CB 4.09Å; H496-Q533 PolarHBondContact O-NE2 2.84Å; N531-Q533 PolarHBondContact O-N 3.09Å; N531-Q533 WeakPolarHBondContact OD1-CB 3.01Å; N531-Q533 WeakPolarHBondContact OD1-CG 3.41Å; N531-Q533 PolarHBondContact OD1-N 3.39Å; N531-Q533 VanDerWaalsContact OD1-N 3.13Å; N531-Q533 PolarHBondContact OD1-NE2 2.93Å; Q533-A535 VanDerWaalsContact C-N 3.27Å; Q533-A535 PolarHBondContact O-N 2.7Å; Q533-S536 PolarHBondContact O-OG 2.93Å
534	W	90.7	Very high	93	Very high	1 Å²	1	49.4 Å²	49.4	0%	0.004	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-69.7	-22.7	179.6	-57.7	-20.6	0	0	0	112.9	W479 M482 M483 F530 N531 P532 S536 D537 L540 C541 W544	W479-W534 AromaticContact CD1-CH2 3.97Å; M482-W534 HydrophobicContact CB-CH2 3.91Å; M482-W534 HydrophobicContact CB-CZ2 3.77Å; M482-W534 HydrophobicContact CE-CD2 4.12Å; M482-W534 HydrophobicContact CE-CE3 3.86Å; M482-W534 HydrophobicContact CE-CH2 4.46Å; M482-W534 HydrophobicContact CE-CZ3 4.05Å; M483-W534 HydrophobicContact CG-CH2 4.2Å; M483-W534 HydrophobicContact CG-CZ2 4.2Å; M483-W534 HydrophobicContact SD-CH2 3.72Å; M483-W534 HydrophobicContact SD-CZ2 3.63Å; F530-W534 AromaticContact CD2-CE3 3.58Å; F530-W534 HydrophobicContact CD2-CE3 3.58Å; F530-W534 HydrophobicContact CD2-CZ3 4.17Å; F530-W534 HydrophobicContact CE1-CB 4.38Å; F530-W534 HydrophobicContact CE2-CB 3.74Å; F530-W534 HydrophobicContact CE2-CD2 4.43Å; F530-W534 AromaticContact CE2-CE3 3.71Å; F530-W534 HydrophobicContact CE2-CE3 3.71Å; F530-W534 HydrophobicContact CG-CE3 4.31Å; F530-W534 HydrophobicContact CZ-CB 3.59Å; F530-W534 HydrophobicContact CZ-CE3 4.5Å; N531-W534 HydrophobicContact CB-CD2 3.59Å; N531-W534 VanDerWaalsContact CB-CE2 3.46Å; N531-W534 HydrophobicContact CB-CE3 3.88Å; N531-W534 HydrophobicContact CB-CG 4.12Å; N531-W534 HydrophobicContact CB-CH2 3.92Å; N531-W534 HydrophobicContact CB-CZ2 3.64Å; N531-W534 HydrophobicContact CB-CZ3 4.03Å; N531-W534 WeakPolarHBondContact O-CB 3.49Å; N531-W534 PolarHBondContact O-N 3.19Å; P532-W534 PolarHBondContact O-N 3.34Å; W534-S536 PolarHBondContact O-N 2.92Å; W534-D537 PolarHBondContact O-N 3.46Å; W534-L540 HydrophobicContact CB-CB 4.04Å; W534-L540 HydrophobicContact CB-CD1 4.48Å; W534-L540 HydrophobicContact CG-CB 4.31Å; W534-L540 HydrophobicContact CG-CD1 4.27Å; W534-C541 PolarHBondContact O-SG 3.44Å; W534-C541 VanDerWaalsContact O-SG 3.36Å; W534-W544 HydrophobicContact CE3-CE3 4.32Å; W534-W544 AromaticContact CZ3-CE3 3.83Å; W534-W544 HydrophobicContact CZ3-CE3 3.83Å; W534-W544 AromaticContact CZ3-CZ3 3.97Å; W534-W544 HydrophobicContact CZ3-CZ3 3.97Å
535	A	88.9	Confident	93	Very high	68 Å²	68	52 Å²	52	56%	0.562	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-59.8	-23.3	-178.5	0	0	0	0	0	113.3	F530 P532 Q533 D537	F530-A535 HydrophobicContact CE1-CB 3.98Å; F530-A535 HydrophobicContact CZ-CB 4.15Å; P532-A535 WeakPolarHBondContact O-CB 3.25Å; P532-A535 PolarHBondContact O-N 3.28Å; Q533-A535 VanDerWaalsContact C-N 3.27Å; Q533-A535 PolarHBondContact O-N 2.7Å; A535-D537 VanDerWaalsContact C-N 3.33Å
536	S	84.7	Confident	93	Very high	91 Å²	91	45.6 Å²	45.6	64%	0.636	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-81.5	-10.7	178.3	66.7	0	0	0	0	114	Q533 W534	Q533-S536 PolarHBondContact O-OG 2.93Å; W534-S536 PolarHBondContact O-N 2.92Å
537	D	89.5	Confident	93	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.016	24%	0.241	C	C	.	.			trans	-118.3	112.3	-175.5	-170.7	-89.2	0	0	0	111.7	G488 S489 N490 W534 A535 G539 L540 C541	G488-D537 VanDerWaalsContact C-OD2 3.3Å; G488-D537 VanDerWaalsContact CA-OD2 3.3Å; G488-D537 WeakPolarHBondContact CA-OD2 3.39Å; S489-D537 WeakPolarHBondContact CA-OD2 3.45Å; S489-D537 WeakPolarHBondContact CB-OD1 3.1Å; S489-D537 PolarHBondContact N-OD1 2.84Å; S489-D537 PolarHBondContact N-OD2 3.42Å; N490-D537 PolarHBondContact N-OD2 2.98Å; W534-D537 PolarHBondContact O-N 3.46Å; A535-D537 VanDerWaalsContact C-N 3.33Å; D537-G539 PolarHBondContact O-N 3.49Å; D537-G539 WeakPolarHBondContact OD1-CA 3.15Å; D537-G539 PolarHBondContact OD1-N 3.5Å; D537-L540 HydrophobicContact CB-CB 4.16Å; D537-L540 HydrophobicContact CB-CD1 3.94Å; D537-L540 HydrophobicContact CB-CG 4.36Å; D537-L540 PolarHBondContact O-N 3.13Å; D537-L540 PolarHBondContact OD1-N 3.01Å; D537-C541 PolarHBondContact O-N 2.95Å; D537-C541 PolarHBondContact O-SG 2.92Å; D537-C541 VanDerWaalsContact O-SG 3.41Å
538	G	89.5	Confident	93.1	Very high	40 Å²	40	44.5 Å²	44.5	41%	0.412	26%	0.256	S	S	.	.	H	α-helix	trans	-60.2	-32.4	-177.9	0	0	0	0	0	113.8	T542	G538-T542 PolarHBondContact O-N 2.76Å; G538-T542 PolarHBondContact O-OG1 3.18Å; G538-T542 VanDerWaalsContact O-OG1 3.05Å
539	G	92.5	Very high	93.1	Very high	5 Å²	5	47.4 Å²	47.4	5%	0.052	27%	0.269	C	S	.	.	H	α-helix	trans	-68.4	-48.9	178.6	0	0	0	0	0	111.9	W373 D537 C541 T542 L543	W373-G539 WeakPolarHBondContact CH2-O 3.31Å; D537-G539 PolarHBondContact O-N 3.49Å; D537-G539 WeakPolarHBondContact OD1-CA 3.15Å; D537-G539 PolarHBondContact OD1-N 3.5Å; G539-C541 VanDerWaalsContact C-N 3.3Å; G539-C541 PolarHBondContact O-N 3.28Å; G539-T542 PolarHBondContact O-N 3.28Å; G539-L543 PolarHBondContact O-N 3.13Å
540	L	93.8	Very high	93.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-62.7	-36.7	175.8	-73.8	164.9	0	0	0	111.9	W373 M482 C485 I495 W534 D537 L543 W544	W373-L540 HydrophobicContact CE3-CD2 4.04Å; W373-L540 HydrophobicContact CE3-CG 4.19Å; W373-L540 HydrophobicContact CZ3-CD2 3.6Å; W373-L540 HydrophobicContact CZ3-CG 3.84Å; M482-L540 HydrophobicContact CE-CB 4.45Å; M482-L540 HydrophobicContact CE-CD2 4Å; M482-L540 WeakPolarHBondContact CE-O 3.46Å; C485-L540 HydrophobicContact CB-CD2 4.43Å; I495-L540 HydrophobicContact CD1-CD1 3.35Å; W534-L540 HydrophobicContact CB-CB 4.04Å; W534-L540 HydrophobicContact CB-CD1 4.48Å; W534-L540 HydrophobicContact CG-CB 4.31Å; W534-L540 HydrophobicContact CG-CD1 4.27Å; D537-L540 HydrophobicContact CB-CB 4.16Å; D537-L540 HydrophobicContact CB-CD1 3.94Å; D537-L540 HydrophobicContact CB-CG 4.36Å; D537-L540 PolarHBondContact O-N 3.13Å; D537-L540 PolarHBondContact OD1-N 3.01Å; L540-L543 PolarHBondContact O-N 2.93Å; L540-W544 VanDerWaalsContact O-CB 3.31Å; L540-W544 WeakPolarHBondContact O-CB 3.49Å; L540-W544 PolarHBondContact O-N 3.34Å
541	C	94.1	Very high	93.7	Very high	33 Å²	33	38 Å²	38	22%	0.223	23%	0.228	C	C	.	.	H	α-helix	trans	-61.9	-47.5	172.3	-73	0	0	0	0	112.4	W534 D537 G539 L543 W544 E545	W534-C541 PolarHBondContact O-SG 3.44Å; W534-C541 VanDerWaalsContact O-SG 3.36Å; D537-C541 PolarHBondContact O-N 2.95Å; D537-C541 PolarHBondContact O-SG 2.92Å; D537-C541 VanDerWaalsContact O-SG 3.41Å; G539-C541 VanDerWaalsContact C-N 3.3Å; G539-C541 PolarHBondContact O-N 3.28Å; C541-L543 VanDerWaalsContact C-N 3.29Å; C541-L543 PolarHBondContact O-N 3.4Å; C541-W544 WeakPolarHBondContact O-CB 3.15Å; C541-W544 PolarHBondContact O-N 2.83Å; C541-W544 VanDerWaalsContact O-N 3.14Å; C541-E545 WeakPolarHBondContact O-CG 3.49Å; C541-E545 PolarHBondContact O-N 3.33Å
542	T	95.4	Very high	94	Very high	63 Å²	63	39.6 Å²	39.6	39%	0.387	24%	0.236	S	C	.	.	H	α-helix	trans	-62.8	-36.9	177.3	-59.5	0	0	0	0	112.3	G538 G539 T546 L571	G538-T542 PolarHBondContact O-N 2.76Å; G538-T542 PolarHBondContact O-OG1 3.18Å; G538-T542 VanDerWaalsContact O-OG1 3.05Å; G539-T542 PolarHBondContact O-N 3.28Å; T542-T546 PolarHBondContact O-N 2.76Å; T542-T546 PolarHBondContact O-OG1 3.17Å; T542-L571 HydrophobicContact CG2-CD1 4.35Å; T542-L571 HydrophobicContact CG2-CD2 4.22Å
543	L	96.9	Very high	94.3	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67.4	-42.1	173.6	179.7	62.5	0	0	0	111.4	W373 L376 M482 G539 L540 C541 E545 T546 V547 L568 L571	W373-L543 HydrophobicContact CH2-CB 4.28Å; W373-L543 HydrophobicContact CZ3-CD2 4.28Å; L376-L543 HydrophobicContact CD2-CD2 3.29Å; M482-L543 HydrophobicContact CE-CB 4.39Å; M482-L543 HydrophobicContact CE-CD2 4.27Å; M482-L543 HydrophobicContact CE-CG 4.31Å; M482-L543 HydrophobicContact CG-CD2 3.55Å; M482-L543 HydrophobicContact CG-CG 4.27Å; M482-L543 HydrophobicContact SD-CB 4.41Å; M482-L543 HydrophobicContact SD-CD2 3.67Å; M482-L543 HydrophobicContact SD-CG 3.71Å; G539-L543 PolarHBondContact O-N 3.13Å; L540-L543 PolarHBondContact O-N 2.93Å; C541-L543 VanDerWaalsContact C-N 3.29Å; C541-L543 PolarHBondContact O-N 3.4Å; L543-E545 VanDerWaalsContact C-N 3.35Å; L543-E545 PolarHBondContact O-N 2.96Å; L543-T546 WeakPolarHBondContact O-CA 3.39Å; L543-T546 WeakPolarHBondContact O-CB 3.07Å; L543-T546 PolarHBondContact O-N 3.4Å; L543-V547 WeakPolarHBondContact O-CG2 3.43Å; L543-V547 PolarHBondContact O-N 2.74Å; L543-L568 HydrophobicContact CD1-CD2 3.44Å; L543-L568 VanDerWaalsContact CD1-CD2 3.44Å; L543-L571 HydrophobicContact CB-CD2 4.3Å
544	W	97	Very high	94.7	Very high	25 Å²	25	38.1 Å²	38.1	10%	0.095	22%	0.223	C	C	.	.	H	α-helix	trans	-57.3	-44.6	176.3	176.9	-106.4	0	0	0	112.3	W479 M482 F530 W534 L540 C541 T546 V547 E548 W551	W479-W544 AromaticContact CD1-CZ3 3.83Å; M482-W544 HydrophobicContact CE-CB 4.05Å; M482-W544 HydrophobicContact CE-CE3 4.48Å; F530-W544 HydrophobicContact CB-CH2 4.1Å; F530-W544 HydrophobicContact CB-CZ2 3.66Å; F530-W544 HydrophobicContact CD2-CB 4.42Å; F530-W544 AromaticContact CD2-CD1 3.68Å; F530-W544 AromaticContact CD2-CD2 3.49Å; F530-W544 HydrophobicContact CD2-CD2 3.49Å; F530-W544 VanDerWaalsContact CD2-CD2 3.49Å; F530-W544 AromaticContact CD2-CE2 3.49Å; F530-W544 VanDerWaalsContact CD2-CE2 3.49Å; F530-W544 HydrophobicContact CD2-CE3 4.12Å; F530-W544 AromaticContact CD2-CG 3.6Å; F530-W544 HydrophobicContact CD2-CG 3.6Å; F530-W544 HydrophobicContact CD2-CZ2 4.08Å; F530-W544 AromaticContact CD2-NE1 3.61Å; F530-W544 HydrophobicContact CE2-CB 4.18Å; F530-W544 AromaticContact CE2-CD1 3.86Å; F530-W544 HydrophobicContact CE2-CD2 4.13Å; F530-W544 AromaticContact CE2-CG 3.76Å; F530-W544 HydrophobicContact CE2-CG 3.76Å; F530-W544 HydrophobicContact CG-CZ2 4.37Å; W534-W544 HydrophobicContact CE3-CE3 4.32Å; W534-W544 AromaticContact CZ3-CE3 3.83Å; W534-W544 HydrophobicContact CZ3-CE3 3.83Å; W534-W544 AromaticContact CZ3-CZ3 3.97Å; W534-W544 HydrophobicContact CZ3-CZ3 3.97Å; L540-W544 VanDerWaalsContact O-CB 3.31Å; L540-W544 WeakPolarHBondContact O-CB 3.49Å; L540-W544 PolarHBondContact O-N 3.34Å; C541-W544 WeakPolarHBondContact O-CB 3.15Å; C541-W544 PolarHBondContact O-N 2.83Å; C541-W544 VanDerWaalsContact O-N 3.14Å; W544-T546 PolarHBondContact O-N 3Å; W544-V547 HydrophobicContact CE3-CB 4.37Å; W544-V547 HydrophobicContact CE3-CG1 4.37Å; W544-V547 HydrophobicContact CZ3-CG1 4.28Å; W544-V547 CarbonylContact O-C 3.57Å; W544-V547 WeakPolarHBondContact O-CA 3.25Å; W544-V547 WeakPolarHBondContact O-CB 3.34Å; W544-V547 PolarHBondContact O-N 2.9Å; W544-E548 HydrophobicContact CD2-CG 4.27Å; W544-E548 HydrophobicContact CZ2-CG 3.93Å; W544-E548 PolarHBondContact NE1-OE1 3.37Å; W544-E548 PolarHBondContact NE1-OE2 2.95Å; W544-E548 PolarHBondContact O-N 2.92Å; W544-W551 AromaticContact CH2-CH2 3.65Å; W544-W551 HydrophobicContact CH2-CH2 3.65Å; W544-W551 AromaticContact CH2-CZ2 3.39Å; W544-W551 HydrophobicContact CH2-CZ2 3.39Å; W544-W551 HydrophobicContact CZ2-CZ2 4.1Å; W544-W551 AromaticContact CZ3-CH2 3.57Å; W544-W551 HydrophobicContact CZ3-CH2 3.57Å; W544-W551 AromaticContact CZ3-CZ2 3.66Å; W544-W551 HydrophobicContact CZ3-CZ2 3.66Å
545	E	97.2	Very high	95	Very high	102 Å²	102	39 Å²	39	48%	0.477	23%	0.23	S	C	.	.	H	α-helix	trans	-56	-40.7	174.4	-69.7	167.6	177.9	0	0	111.6	C541 L543 E548 E549	C541-E545 WeakPolarHBondContact O-CG 3.49Å; C541-E545 PolarHBondContact O-N 3.33Å; L543-E545 VanDerWaalsContact C-N 3.35Å; L543-E545 PolarHBondContact O-N 2.96Å; E545-E548 PolarHBondContact O-N 3.48Å; E545-E549 WeakPolarHBondContact O-CG 3.18Å; E545-E549 PolarHBondContact O-N 2.67Å
546	T	98.2	Very high	95.2	Very high	4 Å²	4	40 Å²	40	3%	0.025	22%	0.224	C	C	.	.	H	α-helix	trans	-66.5	-37.9	175.8	-58.4	0	0	0	0	111.8	T542 L543 W544 C550 L559 V564	T542-T546 PolarHBondContact O-N 2.76Å; T542-T546 PolarHBondContact O-OG1 3.17Å; L543-T546 WeakPolarHBondContact O-CA 3.39Å; L543-T546 WeakPolarHBondContact O-CB 3.07Å; L543-T546 PolarHBondContact O-N 3.4Å; W544-T546 PolarHBondContact O-N 3Å; T546-C550 PolarHBondContact O-N 3.35Å; T546-C550 PolarHBondContact O-SG 3.19Å; T546-L559 HydrophobicContact CG2-CD1 4.04Å; T546-V564 HydrophobicContact CG2-CG1 3.95Å; T546-V564 HydrophobicContact CG2-CG2 4.39Å
547	V	98.4	Very high	95.8	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63	-44.5	174.3	174.3	0	0	0	0	110.6	G475 F478 W479 M482 L543 W544 E549 C550 W551	G475-V547 WeakPolarHBondContact O-CG1 3.28Å; F478-V547 HydrophobicContact CB-CG2 3.61Å; F478-V547 HydrophobicContact CD2-CG2 4.2Å; F478-V547 HydrophobicContact CG-CG2 4.46Å; W479-V547 HydrophobicContact CB-CG1 4.49Å; M482-V547 HydrophobicContact SD-CG2 3.93Å; L543-V547 WeakPolarHBondContact O-CG2 3.43Å; L543-V547 PolarHBondContact O-N 2.74Å; W544-V547 HydrophobicContact CE3-CB 4.37Å; W544-V547 HydrophobicContact CE3-CG1 4.37Å; W544-V547 HydrophobicContact CZ3-CG1 4.28Å; W544-V547 CarbonylContact O-C 3.57Å; W544-V547 WeakPolarHBondContact O-CA 3.25Å; W544-V547 WeakPolarHBondContact O-CB 3.34Å; W544-V547 PolarHBondContact O-N 2.9Å; V547-E549 PolarHBondContact O-N 3.4Å; V547-C550 WeakPolarHBondContact O-CB 3.05Å; V547-C550 PolarHBondContact O-N 2.65Å; V547-C550 VanDerWaalsContact O-N 3.07Å; V547-W551 HydrophobicContact CG1-CD2 3.81Å; V547-W551 HydrophobicContact CG1-CE3 3.59Å; V547-W551 HydrophobicContact CG1-CH2 3.34Å; V547-W551 HydrophobicContact CG1-CZ2 3.55Å; V547-W551 HydrophobicContact CG1-CZ3 3.35Å; V547-W551 PolarHBondContact O-N 3.36Å; V547-W551 VanDerWaalsContact O-N 3.16Å
548	E	97.9	Very high	96.2	Very high	91 Å²	91	38.7 Å²	38.7	43%	0.425	22%	0.216	S	C	.	.	H	α-helix	trans	-60.2	-43.4	178.6	-72.7	-171.2	126.5	0	0	112.9	W544 E545 C550 D552	W544-E548 HydrophobicContact CD2-CG 4.27Å; W544-E548 HydrophobicContact CZ2-CG 3.93Å; W544-E548 PolarHBondContact NE1-OE1 3.37Å; W544-E548 PolarHBondContact NE1-OE2 2.95Å; W544-E548 PolarHBondContact O-N 2.92Å; E545-E548 PolarHBondContact O-N 3.48Å; E548-C550 VanDerWaalsContact C-N 3.32Å; E548-C550 PolarHBondContact O-N 3.45Å; E548-D552 PolarHBondContact O-N 3.3Å
549	E	98.1	Very high	96.6	Very high	63 Å²	63	37.6 Å²	37.6	29%	0.294	20%	0.2	S	C	.	.	H	α-helix	trans	-74.2	-19.4	175.8	-65.3	177	-116.6	0	0	113.1	E545 V547 R558 L559 R567	E545-E549 WeakPolarHBondContact O-CG 3.18Å; E545-E549 PolarHBondContact O-N 2.67Å; V547-E549 PolarHBondContact O-N 3.4Å; E549-R558 VanDerWaalsContact O-CA 3.27Å; E549-R558 WeakPolarHBondContact O-CA 3.46Å; E549-L559 HydrophobicContact CB-CD1 3.71Å; E549-L559 HydrophobicContact CB-CD2 4.43Å; E549-L559 HydrophobicContact CB-CG 3.74Å; E549-L559 PolarHBondContact O-N 2.02Å; E549-L559 WeakPolarHBondContact OE2-CD2 3.22Å; E549-R567 IonicContact OE1-CZ 2.73Å; E549-R567 IonicContact OE1-NH1 3.79Å; E549-R567 PolarHBondContact OE1-NH1 3.1Å; E549-R567 IonicContact OE1-NH2 3.29Å; E549-R567 PolarHBondContact OE1-NH2 2.85Å; E549-R567 IonicContact OE2-CZ 3.8Å; E549-R567 IonicContact OE2-NH1 2.88Å; E549-R567 PolarHBondContact OE2-NH1 2.7Å; E549-R567 IonicContact OE2-NH2 2.71Å; E549-R567 PolarHBondContact OE2-NH2 2.79Å
550	C	98.5	Very high	96.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-76.4	-37.6	174.6	-73.6	0	0	0	0	112.3	V471 Y472 T546 V547 E548 R558 V564	V471-C550 HydrophobicContact CG1-CB 3.93Å; Y472-C550 WeakPolarHBondContact CA-O 3.13Å; T546-C550 PolarHBondContact O-N 3.35Å; T546-C550 PolarHBondContact O-SG 3.19Å; V547-C550 WeakPolarHBondContact O-CB 3.05Å; V547-C550 PolarHBondContact O-N 2.65Å; V547-C550 VanDerWaalsContact O-N 3.07Å; E548-C550 VanDerWaalsContact C-N 3.32Å; E548-C550 PolarHBondContact O-N 3.45Å; C550-R558 VanDerWaalsContact O-CD 3.26Å; C550-R558 WeakPolarHBondContact O-CD 3.25Å; C550-R558 WeakPolarHBondContact O-CG 3.46Å; C550-V564 VanDerWaalsContact SG-CG2 3.59Å
551	W	97.8	Very high	97.1	Very high	10 Å²	10	41 Å²	41	4%	0.038	22%	0.223	C	C	.	.	S	Bend	trans	-104.5	22.1	-174.4	66.4	22.9	0	0	0	114.4	Y472 L476 W479 R527 P528 W544 V547	Y472-W551 HydrophobicContact CD2-CB 3.77Å; Y472-W551 HydrophobicContact CE2-CB 3.89Å; L476-W551 HydrophobicContact CD2-CE3 3.6Å; L476-W551 HydrophobicContact CD2-CZ3 3.86Å; L476-W551 HydrophobicContact CG-CE3 4.27Å; W479-W551 HydrophobicContact CB-CH2 4.11Å; W479-W551 HydrophobicContact CB-CZ3 3.76Å; W479-W551 HydrophobicContact CG-CH2 4.18Å; W479-W551 HydrophobicContact CG-CZ3 4.16Å; R527-W551 HydrophobicContact CB-CD2 4.44Å; R527-W551 HydrophobicContact CB-CZ2 4.1Å; R527-W551 HydrophobicContact CG-CD2 4.33Å; R527-W551 HydrophobicContact CG-CG 4.29Å; R527-W551 PolarHBondContact NE-O 2.93Å; R527-W551 PolarHBondContact NH2-O 3.04Å; R527-W551 VanDerWaalsContact NH2-O 3.13Å; P528-W551 HydrophobicContact CB-CH2 4.35Å; P528-W551 HydrophobicContact CG-CH2 4.39Å; P528-W551 HydrophobicContact CG-CZ3 4.13Å; W544-W551 AromaticContact CH2-CH2 3.65Å; W544-W551 HydrophobicContact CH2-CH2 3.65Å; W544-W551 AromaticContact CH2-CZ2 3.39Å; W544-W551 HydrophobicContact CH2-CZ2 3.39Å; W544-W551 HydrophobicContact CZ2-CZ2 4.1Å; W544-W551 AromaticContact CZ3-CH2 3.57Å; W544-W551 HydrophobicContact CZ3-CH2 3.57Å; W544-W551 AromaticContact CZ3-CZ2 3.66Å; W544-W551 HydrophobicContact CZ3-CZ2 3.66Å; V547-W551 HydrophobicContact CG1-CD2 3.81Å; V547-W551 HydrophobicContact CG1-CE3 3.59Å; V547-W551 HydrophobicContact CG1-CH2 3.34Å; V547-W551 HydrophobicContact CG1-CZ2 3.55Å; V547-W551 HydrophobicContact CG1-CZ3 3.35Å; V547-W551 PolarHBondContact O-N 3.36Å; V547-W551 VanDerWaalsContact O-N 3.16Å
552	D	98.1	Very high	97.3	Very high	60 Å²	60	40.8 Å²	40.8	32%	0.321	23%	0.227	S	C	.	.			trans	-50.5	143.9	178.6	-160.2	-59.4	0	0	0	110.8	E548 D554 A557 R558	E548-D552 PolarHBondContact O-N 3.3Å; D552-D554 VanDerWaalsContact C-N 3.26Å; D552-D554 PolarHBondContact O-N 3.15Å; D552-D554 PolarHBondContact OD1-N 2.91Å; D552-A557 HydrophobicContact CB-CB 4.24Å; D552-R558 HydrophobicContact CB-CG 4.02Å; D552-R558 PolarHBondContact O-NE 3.05Å; D552-R558 PolarHBondContact O-NH2 2.76Å
553	Q	96.1	Very high	97.4	Very high	53 Å²	53	39.9 Å²	39.9	25%	0.248	22%	0.223	C	C	.	.	S	Bend	trans	-59.3	-41.6	175.7	-176.5	64.9	21.8	0	0	111.2	V521 A522 K525	V521-Q553 PolarHBondContact O-OE1 3.46Å; A522-Q553 PolarHBondContact O-NE2 3.33Å; K525-Q553 HydrophobicContact CD-CG 4.03Å; K525-Q553 HydrophobicContact CG-CG 4.15Å
554	D	95.5	Very high	97.5	Very high	88 Å²	88	39.9 Å²	39.9	47%	0.471	22%	0.223	S	C	.	.	S	Bend	trans	-81.6	117.3	174	-173.3	-3.5	0	0	0	109.6	D552 E556 A557	D552-D554 VanDerWaalsContact C-N 3.26Å; D552-D554 PolarHBondContact O-N 3.15Å; D552-D554 PolarHBondContact OD1-N 2.91Å; D554-E556 PolarHBondContact O-N 3.29Å; D554-E556 PolarHBondContact OD1-N 3.26Å; D554-A557 HydrophobicContact CB-CB 4.05Å; D554-A557 PolarHBondContact O-N 3.3Å; D554-A557 VanDerWaalsContact O-N 3.17Å
555	A	96.2	Very high	97.6	Very high	19 Å²	19	39.8 Å²	39.8	16%	0.157	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-58.5	-30.5	177.1	0	0	0	0	0	111.9	R468 R558	R468-A555 HydrophobicContact CB-CB 4.23Å; R468-A555 WeakPolarHBondContact CD-O 3.38Å; R468-A555 WeakPolarHBondContact CG-O 3.38Å; R468-A555 PolarHBondContact NE-O 3.35Å; A555-R558 PolarHBondContact O-N 3.22Å
556	E	94.9	Very high	97.6	Very high	91 Å²	91	40.9 Å²	40.9	43%	0.425	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-72.5	-29	-179.3	-49.8	-133.8	112.5	0	0	113.8	R468 D554 R558 Y632	R468-E556 VanDerWaalsContact CZ-CA 3.49Å; R468-E556 IonicContact CZ-OE1 3.64Å; R468-E556 IonicContact NH1-OE1 3.02Å; R468-E556 PolarHBondContact NH1-OE1 3.41Å; R468-E556 IonicContact NH2-OE1 2.75Å; D554-E556 PolarHBondContact O-N 3.29Å; D554-E556 PolarHBondContact OD1-N 3.26Å; E556-R558 VanDerWaalsContact C-N 3.28Å; E556-Y632 PolarHBondContact OE2-OH 2.77Å
557	A	96.9	Very high	97.6	Very high	52 Å²	52	44.5 Å²	44.5	43%	0.43	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-77.8	-14.9	177.6	0	0	0	0	0	112.6	D552 D554	D552-A557 HydrophobicContact CB-CB 4.24Å; D554-A557 HydrophobicContact CB-CB 4.05Å; D554-A557 PolarHBondContact O-N 3.3Å; D554-A557 VanDerWaalsContact O-N 3.17Å
558	R	98.3	Very high	97.6	Very high	14 Å²	14	44.5 Å²	44.5	5%	0.053	24%	0.241	C	C	.	.	S	Bend	trans	-65.6	141.9	-179	-62.6	178.3	-164	143.4	14.7	111.8	E453 R468 V471 E549 C550 D552 A555 E556	E453-R558 IonicContact OE1-CZ 3.87Å; E453-R558 IonicContact OE1-NH1 3.94Å; E453-R558 PolarHBondContact OE1-NH1 2.73Å; E453-R558 IonicContact OE1-NH2 2.65Å; E453-R558 PolarHBondContact OE1-NH2 3.35Å; E453-R558 IonicContact OE2-CZ 2.94Å; E453-R558 IonicContact OE2-NH1 3.92Å; E453-R558 IonicContact OE2-NH2 3.4Å; E453-R558 PolarHBondContact OE2-NH2 3.3Å; R468-R558 PolarHBondContact O-NH1 2.87Å; V471-R558 HydrophobicContact CG1-CB 4.41Å; E549-R558 VanDerWaalsContact O-CA 3.27Å; E549-R558 WeakPolarHBondContact O-CA 3.46Å; C550-R558 VanDerWaalsContact O-CD 3.26Å; C550-R558 WeakPolarHBondContact O-CD 3.25Å; C550-R558 WeakPolarHBondContact O-CG 3.46Å; D552-R558 HydrophobicContact CB-CG 4.02Å; D552-R558 PolarHBondContact O-NE 3.05Å; D552-R558 PolarHBondContact O-NH2 2.76Å; A555-R558 PolarHBondContact O-N 3.22Å; E556-R558 VanDerWaalsContact C-N 3.28Å
559	L	97.9	Very high	97.5	Very high	17 Å²	17	41.7 Å²	41.7	9%	0.089	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-58.3	154.3	171.7	-64.3	173.1	0	0	0	111.5	V471 T546 E549 C563 V564	V471-L559 VanDerWaalsContact CG1-O 3.3Å; V471-L559 WeakPolarHBondContact CG1-O 3.41Å; V471-L559 WeakPolarHBondContact CG2-O 3.49Å; T546-L559 HydrophobicContact CG2-CD1 4.04Å; E549-L559 HydrophobicContact CB-CD1 3.71Å; E549-L559 HydrophobicContact CB-CD2 4.43Å; E549-L559 HydrophobicContact CB-CG 3.74Å; E549-L559 PolarHBondContact O-N 2.02Å; E549-L559 WeakPolarHBondContact OE2-CD2 3.22Å; L559-C563 HydrophobicContact CB-CB 4.49Å; L559-C563 HydrophobicContact CD2-CB 4.37Å; L559-V564 HydrophobicContact CB-CG2 3.61Å; L559-V564 HydrophobicContact CD1-CG2 3.77Å; L559-V564 HydrophobicContact CG-CG2 4.35Å
560	S	98.3	Very high	97.5	Very high	74 Å²	74	42.4 Å²	42.4	52%	0.517	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-81.7	151.1	162.6	69.1	0	0	0	0	110.3	G562 C563 V564	S560-G562 PolarHBondContact O-N 3.14Å; S560-G562 VanDerWaalsContact O-N 3.13Å; S560-C563 WeakPolarHBondContact O-CA 3.31Å; S560-C563 WeakPolarHBondContact O-CB 3.46Å; S560-C563 PolarHBondContact O-N 2.94Å; S560-C563 PolarHBondContact OG-N 3.08Å; S560-V564 WeakPolarHBondContact O-CG2 3.41Å; S560-V564 PolarHBondContact O-N 3.4Å
561	A	98.4	Very high	97.3	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-54.8	-33.6	175.6	0	0	0	0	0	112.7	L387 A388 V564 T565	L387-A561 HydrophobicContact CB-CB 4.09Å; L387-A561 HydrophobicContact CD2-CB 4.04Å; L387-A561 HydrophobicContact CG-CB 3.94Å; A388-A561 HydrophobicContact CB-CB 4.02Å; A561-V564 PolarHBondContact O-N 3.13Å; A561-T565 WeakPolarHBondContact O-CB 3.47Å; A561-T565 PolarHBondContact O-N 2.9Å; A561-T565 PolarHBondContact O-OG1 3.34Å
562	G	97.7	Very high	97.2	Very high	30 Å²	30	44.6 Å²	44.6	31%	0.309	25%	0.251	S	S	.	.	H	α-helix	trans	-67.1	-36.6	173.2	0	0	0	0	0	113.9	S560 T565 K566	S560-G562 PolarHBondContact O-N 3.14Å; S560-G562 VanDerWaalsContact O-N 3.13Å; G562-T565 WeakPolarHBondContact O-CB 3.28Å; G562-K566 WeakPolarHBondContact O-CG 3.35Å; G562-K566 PolarHBondContact O-N 3.22Å
563	C	98	Very high	97	Very high	44 Å²	44	49.1 Å²	49.1	30%	0.297	26%	0.264	S	S	.	.	H	α-helix	trans	-66.5	-44.8	173.9	-168.7	0	0	0	0	111.1	L559 S560 T565 K566 R567	L559-C563 HydrophobicContact CB-CB 4.49Å; L559-C563 HydrophobicContact CD2-CB 4.37Å; S560-C563 WeakPolarHBondContact O-CA 3.31Å; S560-C563 WeakPolarHBondContact O-CB 3.46Å; S560-C563 PolarHBondContact O-N 2.94Å; S560-C563 PolarHBondContact OG-N 3.08Å; C563-T565 VanDerWaalsContact C-N 3.32Å; C563-T565 PolarHBondContact O-N 2.97Å; C563-K566 PolarHBondContact O-N 3.03Å; C563-K566 VanDerWaalsContact O-N 3.15Å; C563-R567 PolarHBondContact O-N 3.49Å
564	V	98.6	Very high	96.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-59.2	-44.7	176.1	179.6	0	0	0	0	111	A384 M474 F478 T546 C550 L559 S560 A561 K566 R567 L568	A384-V564 HydrophobicContact CB-CB 4.48Å; A384-V564 HydrophobicContact CB-CG1 4.01Å; M474-V564 HydrophobicContact CE-CB 3.94Å; M474-V564 HydrophobicContact CE-CG1 3.78Å; M474-V564 HydrophobicContact CE-CG2 3.8Å; F478-V564 HydrophobicContact CE2-CG1 3.63Å; F478-V564 HydrophobicContact CZ-CG1 3.99Å; T546-V564 HydrophobicContact CG2-CG1 3.95Å; T546-V564 HydrophobicContact CG2-CG2 4.39Å; C550-V564 VanDerWaalsContact SG-CG2 3.59Å; L559-V564 HydrophobicContact CB-CG2 3.61Å; L559-V564 HydrophobicContact CD1-CG2 3.77Å; L559-V564 HydrophobicContact CG-CG2 4.35Å; S560-V564 WeakPolarHBondContact O-CG2 3.41Å; S560-V564 PolarHBondContact O-N 3.4Å; A561-V564 PolarHBondContact O-N 3.13Å; V564-K566 VanDerWaalsContact C-N 3.32Å; V564-K566 PolarHBondContact O-N 2.9Å; V564-R567 PolarHBondContact O-N 3.14Å; V564-L568 HydrophobicContact CG1-CD1 3.68Å; V564-L568 HydrophobicContact CG1-CG 4.16Å; V564-L568 WeakPolarHBondContact O-CG 3.42Å; V564-L568 PolarHBondContact O-N 2.88Å
565	T	98.4	Very high	96.7	Very high	22 Å²	22	47.5 Å²	47.5	14%	0.135	26%	0.257	C	S	.	.	H	α-helix	trans	-53.7	-46.6	174.2	-64.6	0	0	0	0	112.2	A384 Q385 A561 G562 C563 T569	A384-T565 WeakPolarHBondContact CB-OG1 3.43Å; A384-T565 PolarHBondContact O-OG1 3.24Å; A384-T565 VanDerWaalsContact O-OG1 3.13Å; Q385-T565 HydrophobicContact CG-CG2 3.49Å; Q385-T565 VanDerWaalsContact CG-CG2 3.49Å; Q385-T565 PolarHBondContact N-OG1 3.06Å; A561-T565 WeakPolarHBondContact O-CB 3.47Å; A561-T565 PolarHBondContact O-N 2.9Å; A561-T565 PolarHBondContact O-OG1 3.34Å; G562-T565 WeakPolarHBondContact O-CB 3.28Å; C563-T565 VanDerWaalsContact C-N 3.32Å; C563-T565 PolarHBondContact O-N 2.97Å; T565-T569 VanDerWaalsContact O-CB 3.25Å; T565-T569 WeakPolarHBondContact O-CB 2.56Å; T565-T569 PolarHBondContact O-N 2.85Å; T565-T569 PolarHBondContact O-OG1 3.2Å
566	K	97.5	Very high	96.4	Very high	125 Å²	125	49 Å²	49	54%	0.543	26%	0.264	S	S	.	.	H	α-helix	trans	-63.4	-46.2	178.9	-70.6	178.7	-178.5	-173.6	0	111.6	G562 C563 V564 T570	G562-K566 WeakPolarHBondContact O-CG 3.35Å; G562-K566 PolarHBondContact O-N 3.22Å; C563-K566 PolarHBondContact O-N 3.03Å; C563-K566 VanDerWaalsContact O-N 3.15Å; V564-K566 VanDerWaalsContact C-N 3.32Å; V564-K566 PolarHBondContact O-N 2.9Å; K566-T570 PolarHBondContact O-N 2.74Å; K566-T570 VanDerWaalsContact O-N 3.09Å; K566-T570 PolarHBondContact O-OG1 3.45Å; K566-T570 VanDerWaalsContact O-OG1 3.07Å
567	R	97.6	Very high	96	Very high	81 Å²	81	48.7 Å²	48.7	31%	0.306	27%	0.268	S	S	.	.	H	α-helix	trans	-59.8	-50.3	178.4	-70.8	-172.7	178.8	-171.3	4.2	111.8	E549 C563 V564 T570 L571	E549-R567 IonicContact OE1-CZ 2.73Å; E549-R567 IonicContact OE1-NH1 3.79Å; E549-R567 PolarHBondContact OE1-NH1 3.1Å; E549-R567 IonicContact OE1-NH2 3.29Å; E549-R567 PolarHBondContact OE1-NH2 2.85Å; E549-R567 IonicContact OE2-CZ 3.8Å; E549-R567 IonicContact OE2-NH1 2.88Å; E549-R567 PolarHBondContact OE2-NH1 2.7Å; E549-R567 IonicContact OE2-NH2 2.71Å; E549-R567 PolarHBondContact OE2-NH2 2.79Å; C563-R567 PolarHBondContact O-N 3.49Å; V564-R567 PolarHBondContact O-N 3.14Å; R567-T570 PolarHBondContact O-N 3.19Å; R567-L571 PolarHBondContact O-N 2.9Å
568	L	98.1	Very high	95.4	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-66.4	-40.4	-179	-66	175.2	0	0	0	112.6	C380 T381 A384 F478 L543 V564 T570 L571 L572	C380-L568 HydrophobicContact CB-CD1 3.85Å; C380-L568 HydrophobicContact CB-CD2 4.33Å; C380-L568 WeakPolarHBondContact O-CD1 3.45Å; T381-L568 WeakPolarHBondContact OG1-CB 3.43Å; A384-L568 HydrophobicContact CB-CD1 3.93Å; F478-L568 HydrophobicContact CE1-CD1 4.49Å; F478-L568 HydrophobicContact CE2-CD1 3.83Å; F478-L568 HydrophobicContact CZ-CD1 3.59Å; L543-L568 HydrophobicContact CD1-CD2 3.44Å; L543-L568 VanDerWaalsContact CD1-CD2 3.44Å; V564-L568 HydrophobicContact CG1-CD1 3.68Å; V564-L568 HydrophobicContact CG1-CG 4.16Å; V564-L568 WeakPolarHBondContact O-CG 3.42Å; V564-L568 PolarHBondContact O-N 2.88Å; L568-T570 VanDerWaalsContact C-N 3.29Å; L568-T570 PolarHBondContact O-N 3.17Å; L568-L571 PolarHBondContact O-N 3.27Å; L568-L572 VanDerWaalsContact O-CB 3.3Å; L568-L572 WeakPolarHBondContact O-CB 3.2Å; L568-L572 PolarHBondContact O-N 3.28Å
569	T	97.3	Very high	94.5	Very high	31 Å²	31	51.4 Å²	51.4	19%	0.19	27%	0.274	C	S	.	.	H	α-helix	trans	-60.8	-41.3	176	-59.8	0	0	0	0	111.1	T565 R573	T565-T569 VanDerWaalsContact O-CB 3.25Å; T565-T569 WeakPolarHBondContact O-CB 2.56Å; T565-T569 PolarHBondContact O-N 2.85Å; T565-T569 PolarHBondContact O-OG1 3.2Å; T569-R573 WeakPolarHBondContact O-CB 3.38Å; T569-R573 VanDerWaalsContact O-CG 3.24Å; T569-R573 WeakPolarHBondContact O-CG 3.34Å; T569-R573 PolarHBondContact O-N 3.13Å
570	T	96.7	Very high	93.6	Very high	78 Å²	78	56.4 Å²	56.4	48%	0.479	30%	0.297	S	S	.	.	H	α-helix	trans	-64.9	-47.4	175.3	-62.1	0	0	0	0	111.2	K566 R567 L568 L572 R573 L574	K566-T570 PolarHBondContact O-N 2.74Å; K566-T570 VanDerWaalsContact O-N 3.09Å; K566-T570 PolarHBondContact O-OG1 3.45Å; K566-T570 VanDerWaalsContact O-OG1 3.07Å; R567-T570 PolarHBondContact O-N 3.19Å; L568-T570 VanDerWaalsContact C-N 3.29Å; L568-T570 PolarHBondContact O-N 3.17Å; T570-L572 VanDerWaalsContact C-N 3.34Å; T570-L572 PolarHBondContact O-N 3.46Å; T570-R573 PolarHBondContact O-N 2.93Å; T570-L574 HydrophobicContact CG2-CD1 4.05Å; T570-L574 HydrophobicContact CG2-CG 4.49Å; T570-L574 WeakPolarHBondContact O-CG 3.39Å; T570-L574 PolarHBondContact O-N 2.75Å
571	L	95.6	Very high	92.5	Very high	20 Å²	20	60.2 Å²	60.2	11%	0.105	30%	0.301	C	S	.	.	H	α-helix	trans	-61.8	-40.7	179.2	-174.4	57.5	0	0	0	112.3	W373 L377 T542 L543 R567 L568 L574 S575	W373-L571 HydrophobicContact CH2-CD2 4.08Å; W373-L571 HydrophobicContact CZ2-CD1 4.33Å; W373-L571 HydrophobicContact CZ2-CD2 4.08Å; W373-L571 HydrophobicContact CZ2-CG 4.15Å; L377-L571 HydrophobicContact CD1-CG 4Å; L377-L571 HydrophobicContact CD2-CD2 3.71Å; L377-L571 HydrophobicContact CD2-CG 4.01Å; T542-L571 HydrophobicContact CG2-CD1 4.35Å; T542-L571 HydrophobicContact CG2-CD2 4.22Å; L543-L571 HydrophobicContact CB-CD2 4.3Å; R567-L571 PolarHBondContact O-N 2.9Å; L568-L571 PolarHBondContact O-N 3.27Å; L571-L574 PolarHBondContact O-N 3.22Å; L571-S575 WeakPolarHBondContact O-CB 3.33Å; L571-S575 PolarHBondContact O-N 3.43Å; L571-S575 PolarHBondContact O-OG 3.26Å
572	L	95.7	Very high	91.4	Very high	37 Å²	37	63.9 Å²	63.9	19%	0.194	32%	0.321	C	S	.	.	H	α-helix	trans	-63.4	-47.3	175.3	178.1	59.2	0	0	0	111.4	I374 L377 L568 T570 L574 S575 V576	I374-L572 HydrophobicContact CG2-CD1 4.17Å; L377-L572 HydrophobicContact CB-CB 4.21Å; L377-L572 HydrophobicContact CB-CD1 3.8Å; L377-L572 HydrophobicContact CB-CG 4.5Å; L377-L572 HydrophobicContact CD1-CB 4.33Å; L377-L572 HydrophobicContact CD1-CD1 4.36Å; L568-L572 VanDerWaalsContact O-CB 3.3Å; L568-L572 WeakPolarHBondContact O-CB 3.2Å; L568-L572 PolarHBondContact O-N 3.28Å; T570-L572 VanDerWaalsContact C-N 3.34Å; T570-L572 PolarHBondContact O-N 3.46Å; L572-L574 PolarHBondContact O-N 2.95Å; L572-S575 PolarHBondContact O-N 3.15Å; L572-V576 HydrophobicContact CD1-CG2 4.07Å; L572-V576 WeakPolarHBondContact O-CG2 3.16Å; L572-V576 PolarHBondContact O-N 3.33Å
573	R	94.4	Very high	90.3	Very high	155 Å²	155	65.4 Å²	65.4	59%	0.585	32%	0.322	S	S	*	.	H	α-helix	trans	-58.5	-46.9	177	-75.9	172.5	179.6	-174.1	-1	111.8	T569 T570 S575 V576 V577	T569-R573 WeakPolarHBondContact O-CB 3.38Å; T569-R573 VanDerWaalsContact O-CG 3.24Å; T569-R573 WeakPolarHBondContact O-CG 3.34Å; T569-R573 PolarHBondContact O-N 3.13Å; T570-R573 PolarHBondContact O-N 2.93Å; R573-S575 VanDerWaalsContact C-N 3.34Å; R573-S575 PolarHBondContact O-N 3.48Å; R573-V576 PolarHBondContact O-N 3.26Å; R573-V577 WeakPolarHBondContact O-CG2 3.33Å; R573-V577 PolarHBondContact O-N 3.06Å; R573-V577 VanDerWaalsContact O-N 3.16Å
574	L	92.6	Very high	89	Confident	100 Å²	100	66.6 Å²	66.6	52%	0.524	33%	0.331	S	S	.	.	H	α-helix	trans	-62.1	-42.1	177.9	-68.2	173	0	0	0	111.7	T570 L571 L572 V577 N578	T570-L574 HydrophobicContact CG2-CD1 4.05Å; T570-L574 HydrophobicContact CG2-CG 4.49Å; T570-L574 WeakPolarHBondContact O-CG 3.39Å; T570-L574 PolarHBondContact O-N 2.75Å; L571-L574 PolarHBondContact O-N 3.22Å; L572-L574 PolarHBondContact O-N 2.95Å; L574-V577 PolarHBondContact O-N 3.31Å; L574-N578 WeakPolarHBondContact O-CB 3.37Å; L574-N578 VanDerWaalsContact O-CG 3.27Å; L574-N578 PolarHBondContact O-N 3.1Å; L574-N578 PolarHBondContact O-ND2 3.41Å
575	S	91.2	Very high	87.5	Confident	7 Å²	7	73.5 Å²	73.5	5%	0.049	36%	0.358	C	S	.	.	H	α-helix	trans	-66	-41.8	-179.5	-59	0	0	0	0	112.5	W373 I374 L377 L571 L572 R573 N578 Q579	W373-S575 PolarHBondContact NE1-OG 3.16Å; I374-S575 VanDerWaalsContact CD1-CB 3.5Å; L377-S575 WeakPolarHBondContact CD1-OG 3.35Å; L571-S575 WeakPolarHBondContact O-CB 3.33Å; L571-S575 PolarHBondContact O-N 3.43Å; L571-S575 PolarHBondContact O-OG 3.26Å; L572-S575 PolarHBondContact O-N 3.15Å; R573-S575 VanDerWaalsContact C-N 3.34Å; R573-S575 PolarHBondContact O-N 3.48Å; S575-N578 PolarHBondContact O-N 2.78Å; S575-Q579 PolarHBondContact O-N 2.75Å
576	V	89.9	Confident	85.8	Confident	51 Å²	51	77 Å²	77	31%	0.309	38%	0.375	S	S	.	.	H	α-helix	trans	-64.6	-43	177.2	172.2	0	0	0	0	111.4	I374 L572 R573 Q579 Q580	I374-V576 HydrophobicContact CD1-CG2 4.11Å; I374-V576 HydrophobicContact CG2-CG2 4.44Å; L572-V576 HydrophobicContact CD1-CG2 4.07Å; L572-V576 WeakPolarHBondContact O-CG2 3.16Å; L572-V576 PolarHBondContact O-N 3.33Å; R573-V576 PolarHBondContact O-N 3.26Å; V576-Q579 PolarHBondContact O-N 3.18Å; V576-Q580 WeakPolarHBondContact O-CG 3.21Å; V576-Q580 PolarHBondContact O-N 2.88Å; V576-Q580 VanDerWaalsContact O-N 3.07Å
577	V	87.8	Confident	84	Confident	84 Å²	84	76.1 Å²	76.1	51%	0.509	38%	0.377	S	S	.	.	H	α-helix	trans	-62.7	-44.1	177.5	172.1	0	0	0	0	111.1	R573 L574 Q579 Q580 Y581	R573-V577 WeakPolarHBondContact O-CG2 3.33Å; R573-V577 PolarHBondContact O-N 3.06Å; R573-V577 VanDerWaalsContact O-N 3.16Å; L574-V577 PolarHBondContact O-N 3.31Å; V577-Q579 VanDerWaalsContact C-N 3.33Å; V577-Q579 PolarHBondContact O-N 3.46Å; V577-Q580 PolarHBondContact O-N 2.82Å; V577-Y581 PolarHBondContact O-N 3.44Å; V577-Y581 VanDerWaalsContact O-N 3.1Å
578	N	83.7	Confident	82	Confident	54 Å²	54	77.8 Å²	77.8	29%	0.289	39%	0.392	S	S	.	.	H	α-helix	trans	-63.7	-38.3	177.7	-72.5	-19.4	0	0	0	112.2	L574 S575 Y581 N582	L574-N578 WeakPolarHBondContact O-CB 3.37Å; L574-N578 VanDerWaalsContact O-CG 3.27Å; L574-N578 PolarHBondContact O-N 3.1Å; L574-N578 PolarHBondContact O-ND2 3.41Å; S575-N578 PolarHBondContact O-N 2.78Å; N578-Y581 PolarHBondContact O-N 2.83Å; N578-N582 PolarHBondContact O-N 3.49Å; N578-N582 PolarHBondContact O-ND2 3.42Å
579	Q	80	Confident	80	Confident	69 Å²	69	80.9 Å²	80.9	32%	0.322	41%	0.414	S	S	.	.	H	α-helix	trans	-64.3	-44.9	176.6	-177.1	171	-8.3	0	0	111.9	S575 V576 V577 Y581 N582 D583	S575-Q579 PolarHBondContact O-N 2.75Å; V576-Q579 PolarHBondContact O-N 3.18Å; V577-Q579 VanDerWaalsContact C-N 3.33Å; V577-Q579 PolarHBondContact O-N 3.46Å; Q579-Y581 VanDerWaalsContact C-N 3.28Å; Q579-Y581 PolarHBondContact O-N 3.07Å; Q579-N582 PolarHBondContact O-N 3.14Å; Q579-D583 WeakPolarHBondContact O-CB 2.89Å; Q579-D583 PolarHBondContact O-N 3.27Å
580	Q	78.7	Confident	77.8	Confident	121 Å²	121	85.9 Å²	85.9	57%	0.565	44%	0.439	S	S	*	.	H	α-helix	trans	-61.2	-37.4	177	-71.2	176.6	-15.9	0	0	112.3	V576 V577 S584	V576-Q580 WeakPolarHBondContact O-CG 3.21Å; V576-Q580 PolarHBondContact O-N 2.88Å; V576-Q580 VanDerWaalsContact O-N 3.07Å; V577-Q580 PolarHBondContact O-N 2.82Å; Q580-S584 WeakPolarHBondContact O-CB 3.39Å; Q580-S584 PolarHBondContact O-N 3.48Å; Q580-S584 VanDerWaalsContact O-N 3.11Å; Q580-S584 PolarHBondContact O-OG 3.22Å
581	Y	75.4	Confident	75.5	Confident	154 Å²	154	88.4 Å²	88.4	60%	0.604	45%	0.45	S	S	*	.	H	α-helix	trans	-66.1	-47.2	175.6	-174.3	-94.8	0	0	0	112	V577 N578 Q579 D583 S584 Y585	V577-Y581 PolarHBondContact O-N 3.44Å; V577-Y581 VanDerWaalsContact O-N 3.1Å; N578-Y581 PolarHBondContact O-N 2.83Å; Q579-Y581 VanDerWaalsContact C-N 3.28Å; Q579-Y581 PolarHBondContact O-N 3.07Å; Y581-D583 PolarHBondContact O-N 3.13Å; Y581-S584 PolarHBondContact O-N 3.47Å; Y581-Y585 PolarHBondContact O-N 2.91Å
582	N	74.2	Confident	73.1	Confident	79 Å²	79	94.2 Å²	94.2	42%	0.422	48%	0.481	S	S	.	.	H	α-helix	trans	-64.7	-40.5	179.2	-72.2	-21.9	0	0	0	112.5	N578 Q579 S584 Y585 N586	N578-N582 PolarHBondContact O-N 3.49Å; N578-N582 PolarHBondContact O-ND2 3.42Å; Q579-N582 PolarHBondContact O-N 3.14Å; N582-S584 VanDerWaalsContact C-N 3.3Å; N582-S584 PolarHBondContact O-N 2.94Å; N582-Y585 PolarHBondContact O-N 3.32Å; N582-N586 PolarHBondContact O-N 2.92Å; N582-N586 VanDerWaalsContact O-N 3.09Å; N582-N586 PolarHBondContact O-ND2 2.83Å
583	D	75	Confident	70.4	Confident	61 Å²	61	100.7 Å²	100.7	33%	0.326	52%	0.516	S	S	.	.	H	α-helix	trans	-67.8	-33.2	178	-64.7	-17.5	0	0	0	110.9	K491 Q579 Y581 N587	K491-D583 IonicContact NZ-OD1 3.34Å; K491-D583 PolarHBondContact NZ-OD1 2.97Å; K491-D583 IonicContact NZ-OD2 3.44Å; Q579-D583 WeakPolarHBondContact O-CB 2.89Å; Q579-D583 PolarHBondContact O-N 3.27Å; Y581-D583 PolarHBondContact O-N 3.13Å; D583-N587 PolarHBondContact O-N 2.89Å; D583-N587 PolarHBondContact O-ND2 3.19Å
584	S	71	Confident	67.7	Low	70 Å²	70	96.7 Å²	96.7	49%	0.49	52%	0.523	S	S	.	.	H	α-helix	trans	-69.9	-39.7	173.6	-58.7	0	0	0	0	112.9	Q580 Y581 N582 N587 N588	Q580-S584 WeakPolarHBondContact O-CB 3.39Å; Q580-S584 PolarHBondContact O-N 3.48Å; Q580-S584 VanDerWaalsContact O-N 3.11Å; Q580-S584 PolarHBondContact O-OG 3.22Å; Y581-S584 PolarHBondContact O-N 3.47Å; N582-S584 VanDerWaalsContact C-N 3.3Å; N582-S584 PolarHBondContact O-N 2.94Å; S584-N587 PolarHBondContact O-N 3.13Å; S584-N588 PolarHBondContact O-N 3.47Å
585	Y	67	Low	65.1	Low	145 Å²	145	100.2 Å²	100.2	57%	0.569	54%	0.542	S	S	*	.	H	α-helix	trans	-67.7	-39.5	179.2	-171.7	-94.7	0	0	0	112.5	Y581 N582 N588 S589	Y581-Y585 PolarHBondContact O-N 2.91Å; N582-Y585 PolarHBondContact O-N 3.32Å; Y585-N588 PolarHBondContact O-N 3.46Å; Y585-S589 PolarHBondContact O-N 3.29Å; Y585-S589 PolarHBondContact O-OG 3.43Å; Y585-S589 VanDerWaalsContact O-OG 3.06Å
586	N	61.9	Low	62.4	Low	94 Å²	94	103.1 Å²	103.1	50%	0.503	57%	0.573	S	S	.	*	H	α-helix	trans	-68.4	-34.9	177.6	-73.2	-20	0	0	0	112.4	N582 N588 S589	N582-N586 PolarHBondContact O-N 2.92Å; N582-N586 VanDerWaalsContact O-N 3.09Å; N582-N586 PolarHBondContact O-ND2 2.83Å; N586-N588 VanDerWaalsContact C-N 3.33Å; N586-N588 PolarHBondContact O-N 2.04Å; N586-S589 PolarHBondContact O-N 3.05Å
587	N	59.7	Low	59.9	Low	108 Å²	108	108.9 Å²	108.9	58%	0.578	60%	0.6	S	S	*	*	H	α-helix	trans	-69.7	-28.4	176.1	-74.9	-25.1	0	0	0	113.3	D583 S584 N591	D583-N587 PolarHBondContact O-N 2.89Å; D583-N587 PolarHBondContact O-ND2 3.19Å; S584-N587 PolarHBondContact O-N 3.13Å; N587-N591 PolarHBondContact O-ND2 2.82Å
588	N	56.9	Low	57.3	Low	116 Å²	116	112.5 Å²	112.5	62%	0.62	62%	0.617	S	S	*	*	H	α-helix	trans	-80.7	-24.7	175.1	-76.1	-13.9	0	0	0	113.4	S584 Y585 N586	S584-N588 PolarHBondContact O-N 3.47Å; Y585-N588 PolarHBondContact O-N 3.46Å; N586-N588 VanDerWaalsContact C-N 3.33Å; N586-N588 PolarHBondContact O-N 2.04Å
589	S	55.9	Low	55	Low	65 Å²	65	119.4 Å²	119.4	46%	0.455	65%	0.647	S	S	.	*	H	α-helix	trans	-78	-20.6	179.6	-58.2	0	0	0	0	113.5	Y585 N586	Y585-S589 PolarHBondContact O-N 3.29Å; Y585-S589 PolarHBondContact O-OG 3.43Å; Y585-S589 VanDerWaalsContact O-OG 3.06Å; N586-S589 PolarHBondContact O-N 3.05Å
590	N	50	Low	52.9	Low	136 Å²	136	124.9 Å²	124.9	73%	0.727	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.2	6.6	-179.1	-71.4	-17.8	0	0	0	114.5
591	N	49.9	Very low	50.8	Low	131 Å²	131	125.8 Å²	125.8	70%	0.701	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	8.9	-178.6	-79.6	-33.1	0	0	0	114.7	N587	N587-N591 PolarHBondContact O-ND2 2.82Å
592	N	43.4	Very low	48.9	Very low	141 Å²	141	126.3 Å²	126.3	75%	0.754	69%	0.692	S	S	*	*			trans	-118.8	64.2	-179.8	-71	-24.7	0	0	0	112
593	D	39.8	Very low	46.9	Very low	174 Å²	174	129.6 Å²	129.6	93%	0.93	71%	0.71	S	S	*	*			trans	-113.4	91.4	158.1	-80.8	-33.3	0	0	0	107.7
594	G	37.5	Very low	45	Very low	71 Å²	71	133.7 Å²	133.7	73%	0.732	73%	0.731	S	S	*	*	S	Bend	trans	168.9	110.3	178.6	0	0	0	0	0	113.4
595	D	38.4	Very low	43.2	Very low	174 Å²	174	137.1 Å²	137.1	93%	0.93	75%	0.745	S	S	*	*			trans	68.6	114.8	168.4	-73.1	-20.2	0	0	0	119.5
596	G	34	Very low	41.5	Very low	68 Å²	68	136.4 Å²	136.4	70%	0.701	75%	0.751	S	S	*	*			trans	-80.7	155.8	166.1	0	0	0	0	0	112.5
597	I	37.7	Very low	40	Very low	172 Å²	172	139.4 Å²	139.4	88%	0.882	77%	0.767	S	S	*	*			trans	-170.1	135.9	135.9	-88.3	144.6	0	0	0	106.5
598	N	32.9	Very low	38.7	Very low	159 Å²	159	138.1 Å²	138.1	85%	0.85	76%	0.762	S	S	*	*			trans	-65	133.2	177.4	-64.7	-58.1	0	0	0	111.9
599	E	35.5	Very low	37.4	Very low	200 Å²	200	138.3 Å²	138.3	94%	0.935	76%	0.762	S	S	*	*			trans	-150.1	138.5	146.5	-124.1	171.8	-167.9	0	0	111.9
600	K	36.9	Very low	36.3	Very low	183 Å²	183	143 Å²	143	80%	0.796	78%	0.779	S	S	*	*			trans	-81.5	159.6	-171.9	-72.8	171.8	170.5	172.1	0	111.5
601	D	34.5	Very low	35.5	Very low	140 Å²	140	140.1 Å²	140.1	75%	0.749	77%	0.77	S	S	*	*			trans	64.8	96	153.2	-56.5	-29.8	0	0	0	117.4
602	N	35.8	Very low	34.5	Very low	166 Å²	166	137.8 Å²	137.8	89%	0.888	76%	0.757	S	S	*	*				-166	125.9	123	-101.6	-36	0	0	0	112.7	N604	N602-N604 PolarHBondContact O-N 2.95Å
603	N	32.2	Very low	34	Very low	148 Å²	148	139.1 Å²	139.1	79%	0.791	75%	0.753	S	S	*	*			trans	-51	121.3	169.5	-84.9	-39.2	0	0	0	111.6
604	N	34.1	Very low	33.7	Very low	146 Å²	146	136.4 Å²	136.4	78%	0.781	74%	0.737	S	S	*	*			trans	-143.7	84.5	155.3	-101.1	-22.7	0	0	0	108.9	N602 N606	N602-N604 PolarHBondContact O-N 2.95Å; N604-N606 PolarHBondContact O-N 3.34Å; N604-N606 VanDerWaalsContact O-N 3.12Å
605	N	32.6	Very low	33.4	Very low	143 Å²	143	137.2 Å²	137.2	77%	0.765	73%	0.728	S	S	*	*			trans	-75.5	85.5	167.3	-81.8	-23.2	0	0	0	109
606	N	32.3	Very low	32.9	Very low	130 Å²	130	135.2 Å²	135.2	70%	0.695	72%	0.718	S	S	*	*			trans	-135.8	23.9	173.3	-88.4	-23.3	0	0	0	113.7	N604	N604-N606 PolarHBondContact O-N 3.34Å; N604-N606 VanDerWaalsContact O-N 3.12Å
607	N	30.7	Very low	32.7	Very low	157 Å²	157	137.8 Å²	137.8	84%	0.84	73%	0.725	S	S	*	*	S	Bend	trans	-127.5	32.9	-178.3	-77.2	-15.8	0	0	0	114.7
608	T	30.9	Very low	32.3	Very low	80 Å²	80	137.5 Å²	137.5	49%	0.491	72%	0.72	S	S	.	*			trans	-125.7	16.9	-173.2	-28.9	0	0	0	0	115.1	N612	T608-N612 PolarHBondContact O-ND2 2.89Å
609	I	31.3	Very low	32	Very low	120 Å²	120	140.2 Å²	140.2	62%	0.615	72%	0.724	S	S	*	*	S	Bend	trans	-99.5	-18.4	-169.8	-63.5	176.9	0	0	0	114.3
610	M	32.7	Very low	31.7	Very low	165 Å²	165	136.7 Å²	136.7	81%	0.813	72%	0.717	S	S	*	*	S	Bend	trans	-106.6	-19.3	-176.9	-139.2	89.4	179.7	0	0	115.1
611	S	31.8	Very low	31.3	Very low	75 Å²	75	135 Å²	135	52%	0.524	72%	0.716	S	S	.	*	G	3₁₀ helix	trans	-82.1	-11.2	-179.1	44.9	0	0	0	0	114.3	T615	S611-T615 PolarHBondContact O-OG1 3.18Å
612	N	30.1	Very low	30.9	Very low	82 Å²	82	135 Å²	135	44%	0.439	73%	0.726	S	S	.	*	G	3₁₀ helix	trans	-87.7	-6.4	-179.3	-73.7	-20	0	0	0	114.3	T608 T615	T608-N612 PolarHBondContact O-ND2 2.89Å; N612-T615 WeakPolarHBondContact CA-OG1 3.49Å
613	Y	32	Very low	30.5	Very low	168 Å²	168	135.5 Å²	135.5	66%	0.659	72%	0.72	S	S	*	*	G	3₁₀ helix	trans	-82	-11.9	-180	-81.9	-81.3	0	0	0	114.2	T698	Y613-T698 VanDerWaalsContact OH-CG2 3.29Å; Y613-T698 WeakPolarHBondContact OH-CG2 3.38Å
614	L	34.7	Very low	30.4	Very low	117 Å²	117	134 Å²	134	61%	0.613	72%	0.719	S	S	*	*	S	Bend	trans	-117.8	-2.4	176.3	-80.6	159.9	0	0	0	113.9
615	T	31.2	Very low	30.2	Very low	88 Å²	88	132.5 Å²	132.5	54%	0.54	72%	0.717	S	S	.	*	S	Bend	trans	-115.9	5.8	-169.5	51.3	0	0	0	0	114.8	S611 N612	S611-T615 PolarHBondContact O-OG1 3.18Å; N612-T615 WeakPolarHBondContact CA-OG1 3.49Å
616	N	28	Very low	29.9	Very low	132 Å²	132	130.1 Å²	130.1	71%	0.706	71%	0.709	S	S	*	*			trans	-102.5	26	179.4	-104.9	-0.8	0	0	0	115.6	Q618	N616-Q618 VanDerWaalsContact C-N 3.31Å; N616-Q618 PolarHBondContact O-N 2.78Å
617	S	29.4	Very low	29.8	Very low	123 Å²	123	129.5 Å²	129.5	86%	0.86	71%	0.712	S	S	*	*			trans	-91.8	67.4	160.5	-67	0	0	0	0	109.8	K619	S617-K619 PolarHBondContact O-N 2.97Å
618	Q	29.3	Very low	29.7	Very low	165 Å²	165	130.6 Å²	130.6	77%	0.771	71%	0.706	S	S	*	*			trans	-67.5	114.5	163.2	-80.9	-171.1	-17.1	0	0	108.7	N616 T620	N616-Q618 VanDerWaalsContact C-N 3.31Å; N616-Q618 PolarHBondContact O-N 2.78Å; Q618-T620 PolarHBondContact O-N 3.26Å
619	K	26	Very low	29.3	Very low	216 Å²	216	136.6 Å²	136.6	94%	0.939	72%	0.721	S	S	*	*			trans	17.7	87.7	154.8	-79.3	178.9	172.4	176.9	0	115	S617	S617-K619 PolarHBondContact O-N 2.97Å
620	T	28.8	Very low	29.1	Very low	127 Å²	127	140.2 Å²	140.2	78%	0.779	73%	0.728	S	S	*	*			trans	-131.9	125.9	155.2	55.3	0	0	0	0	107.7	Q618 C622	Q618-T620 PolarHBondContact O-N 3.26Å; T620-C622 PolarHBondContact O-N 3.46Å
621	D	29.7	Very low	28.7	Very low	147 Å²	147	137.9 Å²	137.9	79%	0.786	73%	0.727	S	S	*	*			trans	-37.7	130	179.5	-71.9	-45.3	0	0	0	112.7	K623	D621-K623 PolarHBondContact O-N 2.85Å
622	C	24.9	Very low	28.4	Very low	141 Å²	141	141.9 Å²	141.9	95%	0.953	73%	0.731	S	S	*	*			trans	-61.9	85.4	169.3	-61.7	0	0	0	0	109.6	T620	T620-C622 PolarHBondContact O-N 3.46Å
623	K	27.9	Very low	28.2	Very low	175 Å²	175	146 Å²	146	76%	0.761	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-98.3	137.9	161.2	-77.3	-177.2	178.6	177.1	0	108.2	D621	D621-K623 PolarHBondContact O-N 2.85Å
624	P	30.2	Very low	27.9	Very low	118 Å²	118	142 Å²	142	77%	0.766	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-60.2	139.8	179.3	25.1	-32.8	0	0	0	110.3
625	P	29.1	Very low	27.7	Very low	113 Å²	113	142.4 Å²	142.4	73%	0.734	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-66.5	147.6	175.1	27.3	-31.6	0	0	0	110.6
626	P	27.4	Very low	27.6	Very low	94 Å²	94	147.9 Å²	147.9	61%	0.61	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-67.4	154.9	175.3	30	-33.5	0	0	0	110.8	Y628	P626-Y628 PolarHBondContact O-N 3.36Å
627	P	29.4	Very low	27.7	Very low	117 Å²	117	149.5 Å²	149.5	76%	0.76	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-66.6	119.6	-174.7	27.3	-32.7	0	0	0	110.6
628	Y	29.6	Very low	27.6	Very low	179 Å²	179	149.3 Å²	149.3	70%	0.702	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-83.9	121.7	168.7	-84.1	-85.6	0	0	0	109.8	P626	P626-Y628 PolarHBondContact O-N 3.36Å
629	Y	22.3	Very low	27.6	Very low	207 Å²	207	147.9 Å²	147.9	81%	0.812	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-63.8	124.6	174	-75.6	-101.7	0	0	0	111
630	Y	27.7	Very low	27.7	Very low	196 Å²	196	142.6 Å²	142.6	77%	0.769	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-103	125.5	168.3	-76.2	-80.1	0	0	0	110.8	Y632	Y630-Y632 PolarHBondContact O-N 3.33Å
631	C	22.8	Very low	27.6	Very low	115 Å²	115	142.7 Å²	142.7	78%	0.777	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-69.7	121.9	172.9	-72.2	0	0	0	0	111.3
632	Y	25.9	Very low	27.5	Very low	159 Å²	159	142 Å²	142	62%	0.624	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-76.1	121.8	168.3	-75.9	-81.3	0	0	0	111.6	E556 Y630	E556-Y632 PolarHBondContact OE2-OH 2.77Å; Y630-Y632 PolarHBondContact O-N 3.33Å
633	Y	26.3	Very low	27.4	Very low	169 Å²	169	140.7 Å²	140.7	66%	0.663	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-103.5	119.2	157.7	-96	-87.7	0	0	0	109.6
634	S	25.2	Very low	27.3	Very low	85 Å²	85	139.8 Å²	139.8	59%	0.594	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-103.1	123.7	171.2	174.5	0	0	0	0	108.8	Y636	S634-Y636 PolarHBondContact O-N 2.85Å; S634-Y636 WeakPolarHBondContact OG-CD2 3.39Å
635	P	30.6	Very low	27	Very low	125 Å²	125	139.8 Å²	139.8	81%	0.812	75%	0.745	S	S	*	*			trans	-94.6	87.6	170.3	33.9	-25.7	0	0	0	109.5
636	Y	28.8	Very low	27	Very low	202 Å²	202	140.9 Å²	140.9	79%	0.792	75%	0.75	S	S	*	*			trans	-116.1	94.7	155.3	-74.5	-74.5	0	0	0	108.6	S634	S634-Y636 PolarHBondContact O-N 2.85Å; S634-Y636 WeakPolarHBondContact OG-CD2 3.39Å
637	N	30.3	Very low	26.9	Very low	167 Å²	167	142.1 Å²	142.1	89%	0.893	76%	0.756	S	S	*	*			trans	-103.5	91.4	162.1	-130	-0.7	0	0	0	107.9	T639	N637-T639 PolarHBondContact O-N 2.87Å
638	T	28	Very low	27	Very low	118 Å²	118	142.1 Å²	142.1	72%	0.724	75%	0.754	S	S	*	*			trans	-70.1	109.5	166.8	43.6	0	0	0	0	108.6	S640	T638-S640 PolarHBondContact O-N 3.41Å
639	T	28.6	Very low	27	Very low	136 Å²	136	139.6 Å²	139.6	83%	0.834	76%	0.758	S	S	*	*			trans	-70.1	110.8	169.4	6.9	0	0	0	0	109.4	N637 T641	N637-T639 PolarHBondContact O-N 2.87Å; T639-T641 PolarHBondContact O-N 3.22Å
640	S	27.9	Very low	27	Very low	105 Å²	105	136.1 Å²	136.1	73%	0.734	76%	0.758	S	S	*	*			trans	-81.6	104	166.5	-23.4	0	0	0	0	108.5	T638 T642	T638-S640 PolarHBondContact O-N 3.41Å; S640-T642 PolarHBondContact O-N 3.29Å
641	T	26.7	Very low	27	Very low	129 Å²	129	133.5 Å²	133.5	79%	0.791	76%	0.763	S	S	*	*			trans	-76	110.4	170.1	-38.4	0	0	0	0	109.5	T639	T639-T641 PolarHBondContact O-N 3.22Å
642	T	27.7	Very low	27	Very low	133 Å²	133	134.1 Å²	134.1	82%	0.816	76%	0.763	S	S	*	*			trans	-98.9	107.4	163.7	-48.2	0	0	0	0	108	S640	S640-T642 PolarHBondContact O-N 3.29Å
643	T	22.7	Very low	27.1	Very low	113 Å²	113	132.8 Å²	132.8	69%	0.693	77%	0.771	S	S	*	*			trans	-78.7	130.6	169.2	-43.6	0	0	0	0	108.8
644	I	26.9	Very low	26.8	Very low	155 Å²	155	130.7 Å²	130.7	80%	0.795	78%	0.776	S	S	*	*			trans	-169	107.3	137.3	-88.4	145.4	0	0	0	107.9
645	T	23.5	Very low	27	Very low	118 Å²	118	132.9 Å²	132.9	72%	0.724	79%	0.786	S	S	*	*			trans	14.6	125.1	149.5	36.8	0	0	0	0	120.2
646	T	28.9	Very low	26.5	Very low	136 Å²	136	132.9 Å²	132.9	83%	0.834	78%	0.784	S	S	*	*				-164.5	129.3	116.1	17.8	0	0	0	0	111.4
647	T	26	Very low	26.6	Very low	120 Å²	120	130.2 Å²	130.2	74%	0.736	79%	0.789	S	S	*	*			trans	-16.3	141.5	154.1	38.9	0	0	0	0	115.3
648	T	30	Very low	26.2	Very low	118 Å²	118	128.1 Å²	128.1	72%	0.724	78%	0.783	S	S	*	*				-179.4	148.9	55	-9.2	0	0	0	0	111.4
649	T	29.4	Very low	26.2	Very low	126 Å²	126	129.9 Å²	129.9	77%	0.773	79%	0.787	S	S	*	*			trans	63.6	113.7	148.8	44.1	0	0	0	0	123.6
650	T	23.4	Very low	26.2	Very low	133 Å²	133	130.8 Å²	130.8	82%	0.816	79%	0.786	S	S	*	*			trans	-38.9	139.2	153.3	17	0	0	0	0	117.2
651	T	28	Very low	25.9	Very low	141 Å²	141	133.4 Å²	133.4	87%	0.865	79%	0.791	S	S	*	*			trans	-159	126.6	132.7	-15	0	0	0	0	111.6
652	T	22.3	Very low	25.9	Very low	129 Å²	129	132.4 Å²	132.4	79%	0.791	80%	0.796	S	S	*	*			trans	-81.8	138.9	171.7	26.3	0	0	0	0	111.1
653	V	27.1	Very low	25.8	Very low	131 Å²	131	130.9 Å²	130.9	79%	0.794	79%	0.791	S	S	*	*			trans	-140.5	121.9	157.7	-178.8	0	0	0	0	109.7
654	T	21.7	Very low	26.1	Very low	124 Å²	124	135.3 Å²	135.3	76%	0.761	80%	0.801	S	S	*	*			trans	-93.9	141.5	169.7	-43.4	0	0	0	0	108.4
655	T	27.6	Very low	26	Very low	131 Å²	131	134.6 Å²	134.6	80%	0.804	80%	0.798	S	S	*	*			trans	-148	118.9	161.4	5	0	0	0	0	110.4
656	T	22.1	Very low	26.1	Very low	125 Å²	125	137.6 Å²	137.6	77%	0.767	81%	0.809	S	S	*	*			trans	-89.4	149.1	169.2	25.3	0	0	0	0	109.9
657	T	29	Very low	25.9	Very low	146 Å²	146	135.6 Å²	135.6	90%	0.896	80%	0.801	S	S	*	*			trans	-149.4	129	158.5	0.5	0	0	0	0	109.9
658	T	23.6	Very low	25.9	Very low	124 Å²	124	137.7 Å²	137.7	76%	0.761	81%	0.807	S	S	*	*			trans	-99	-179.3	-179.6	43	0	0	0	0	111.1
659	L	27.3	Very low	25.8	Very low	155 Å²	155	135.9 Å²	135.9	81%	0.812	81%	0.812	S	S	*	*			trans	124.1	135.6	160.9	-63	162.8	0	0	0	110.7
660	L	28.3	Very low	25.5	Very low	155 Å²	155	132.9 Å²	132.9	81%	0.812	81%	0.806	S	S	*	*			cis	-174.4	149.8	-4.5	-113.4	168.1	0	0	0	107.5
661	D	22	Very low	25.5	Very low	160 Å²	160	137 Å²	137	86%	0.856	81%	0.808	S	S	*	*			trans	-73.4	158	178.6	-71	-52.5	0	0	0	115.9
662	A	27.5	Very low	25.2	Very low	108 Å²	108	136.6 Å²	136.6	89%	0.893	81%	0.806	S	S	*	*			trans	-154.7	117.9	147.2	0	0	0	0	0	112.4
663	S	24.9	Very low	25.3	Very low	100 Å²	100	136.3 Å²	136.3	70%	0.699	80%	0.804	S	S	*	*			trans	-95.8	155.2	172.3	139.6	0	0	0	0	111.2
664	K	28.7	Very low	25.1	Very low	207 Å²	207	137.1 Å²	137.1	90%	0.9	81%	0.81	S	S	*	*			trans	-163.3	132.4	146.4	-110.9	170.9	-172.7	-179.1	0	114
665	D	23.9	Very low	25.2	Very low	140 Å²	140	135.3 Å²	135.3	75%	0.749	80%	0.802	S	S	*	*			trans	-66.4	155.3	-179.5	-57.7	-67.9	0	0	0	116.2
666	L	26.7	Very low	25	Very low	181 Å²	181	137.3 Å²	137.3	95%	0.948	81%	0.807	S	S	*	*			trans	-167	132.6	133.5	-107.4	134.7	0	0	0	112
667	S	24.8	Very low	25.1	Very low	94 Å²	94	140.6 Å²	140.6	66%	0.657	81%	0.805	S	S	*	*			trans	-107.2	162.4	-172.5	49.4	0	0	0	0	113.3
668	N	26.6	Very low	24.9	Very low	163 Å²	163	139.4 Å²	139.4	87%	0.872	79%	0.794	S	S	*	*			trans	111	130.3	152.7	-68	-18.1	0	0	0	120.4
669	G	26.2	Very low	25	Very low	80 Å²	80	142.4 Å²	142.4	83%	0.825	79%	0.792	S	S	*	*			trans	102.9	102.2	170	0	0	0	0	0	111.7
670	G	22.9	Very low	24.9	Very low	64 Å²	64	137.2 Å²	137.2	66%	0.66	77%	0.769	S	S	*	*				96.4	125.7	55.4	0	0	0	0	0	108.3
671	Y	24.8	Very low	24.9	Very low	218 Å²	218	140.7 Å²	140.7	86%	0.855	77%	0.771	S	S	*	*			trans	97.6	94.4	-179.6	-50.7	-68.2	0	0	0	118
672	T	21.4	Very low	25	Very low	134 Å²	134	138.6 Å²	138.6	82%	0.822	76%	0.764	S	S	*	*			trans	29.8	93.6	135.2	57.3	0	0	0	0	119.1
673	T	23.7	Very low	24.9	Very low	123 Å²	123	140.4 Å²	140.4	76%	0.755	76%	0.759	S	S	*	*			trans	-153.7	124.4	157	47.8	0	0	0	0	111.4	S675	T673-S675 PolarHBondContact O-N 2.96Å
674	T	23	Very low	25	Very low	148 Å²	148	142.9 Å²	142.9	91%	0.908	76%	0.764	S	S	*	*			trans	1	110.5	142.8	-23.4	0	0	0	0	115
675	S	24.7	Very low	24.8	Very low	86 Å²	86	141.1 Å²	141.1	60%	0.601	76%	0.763	S	S	*	*			trans	-112.6	93.3	-179	165.8	0	0	0	0	111.9	T673 R677	T673-S675 PolarHBondContact O-N 2.96Å; S675-R677 PolarHBondContact O-N 3.19Å
676	L	23.1	Very low	24.9	Very low	172 Å²	172	136.5 Å²	136.5	90%	0.901	75%	0.748	S	S	*	*			trans	-46.1	114.1	140.8	-85.4	146.3	0	0	0	109.7
677	R	23.5	Very low	24.9	Very low	195 Å²	195	133.9 Å²	133.9	74%	0.736	74%	0.739	S	S	*	*			trans	-138.5	81.7	158.9	-85.3	-172.2	-167	-178.5	2.9	109.2	Y224 S675	Y224-R677 VanDerWaalsContact CD1-C 3.49Å; Y224-R677 HydrophobicContact CD1-CB 4.46Å; Y224-R677 WeakPolarHBondContact CD1-O 3.46Å; Y224-R677 HydrophobicContact CE1-CB 3.93Å; Y224-R677 WeakPolarHBondContact CE1-O 3.3Å; S675-R677 PolarHBondContact O-N 3.19Å
678	N	26.4	Very low	25	Very low	121 Å²	121	137 Å²	137	65%	0.647	74%	0.738	S	S	*	*				76.2	159.7	101.3	-157.4	14.5	0	0	0	112.7	Y224	Y224-N678 HydrophobicContact CD1-CB 4.35Å; Y224-N678 WeakPolarHBondContact CD1-O 3.33Å; Y224-N678 WeakPolarHBondContact CD2-O 3.34Å; Y224-N678 HydrophobicContact CE1-CB 3.22Å; Y224-N678 WeakPolarHBondContact CE1-O 3.41Å; Y224-N678 HydrophobicContact CE2-CB 4.21Å; Y224-N678 WeakPolarHBondContact CE2-O 3.46Å; Y224-N678 VanDerWaalsContact CG-C 3.46Å; Y224-N678 VanDerWaalsContact CZ-O 3.27Å; Y224-N678 WeakPolarHBondContact OH-CB 3.29Å; Y224-N678 PolarHBondContact OH-ND2 3.27Å; Y224-N678 PolarHBondContact OH-OD1 3.29Å
679	Y	24.9	Very low	25	Very low	187 Å²	187	134.1 Å²	134.1	73%	0.733	72%	0.723	S	S	*	*			trans	-138.1	129.5	-173.2	-109.4	-95.7	0	0	0	110.7
680	S	24.6	Very low	25.1	Very low	45 Å²	45	132.1 Å²	132.1	32%	0.315	70%	0.696	S	S	.	*			trans	-120.8	115.9	175.4	54.8	0	0	0	0	106.5	N222 E223 Y224	N222-S680 VanDerWaalsContact C-OG 3.24Å; N222-S680 WeakPolarHBondContact O-CB 3.46Å; N222-S680 PolarHBondContact O-OG 3.03Å; E223-S680 PolarHBondContact O-OG 2.99Å; Y224-S680 WeakPolarHBondContact CD2-OG 3.43Å
681	R	29.1	Very low	25.5	Very low	229 Å²	229	132.8 Å²	132.8	86%	0.864	69%	0.69	S	S	*	*			trans	-122.7	108.3	-173.8	-133.4	179.9	-175.6	176.8	0.1	106.9
682	T	24.1	Very low	25.8	Very low	115 Å²	115	127.2 Å²	127.2	71%	0.706	68%	0.675	S	S	*	*			trans	-114	134	163	47.9	0	0	0	0	108
683	D	24.8	Very low	26.3	Very low	147 Å²	147	124.2 Å²	124.2	79%	0.786	66%	0.657	S	S	*	*	S	Bend	trans	71.4	77.1	161.5	-48.5	-24.8	0	0	0	117.5
684	D	26.4	Very low	26.6	Very low	151 Å²	151	123.5 Å²	123.5	81%	0.807	65%	0.648	S	S	*	*	S	Bend		-162.7	138.7	122.3	-100.4	-30.5	0	0	0	111.2	G686	D684-G686 PolarHBondContact O-N 2.89Å
685	I	26	Very low	26.9	Very low	170 Å²	170	120.6 Å²	120.6	87%	0.872	63%	0.633	S	S	*	*			trans	-38	97.3	-173.4	-59.7	165.6	0	0	0	112.5
686	G	25.7	Very low	27.1	Very low	43 Å²	43	121.2 Å²	121.2	44%	0.443	63%	0.634	S	S	.	*			trans	-86.6	109.2	-177.4	0	0	0	0	0	113.1	D684 Y688	D684-G686 PolarHBondContact O-N 2.89Å; G686-Y688 VanDerWaalsContact C-N 3.33Å; G686-Y688 WeakPolarHBondContact O-CD2 3.49Å; G686-Y688 PolarHBondContact O-N 3.3Å
687	V	25.9	Very low	27.4	Very low	126 Å²	126	117 Å²	117	76%	0.764	62%	0.615	S	S	*	*			trans	-68.6	94.4	154.5	179.9	0	0	0	0	107.1	N689	V687-N689 PolarHBondContact O-N 3.43Å
688	Y	26.9	Very low	27.5	Very low	159 Å²	159	112.8 Å²	112.8	62%	0.624	61%	0.611	S	S	*	*			trans	-74.1	113.5	170	-74.1	-85.7	0	0	0	108.6	G686	G686-Y688 VanDerWaalsContact C-N 3.33Å; G686-Y688 WeakPolarHBondContact O-CD2 3.49Å; G686-Y688 PolarHBondContact O-N 3.3Å
689	N	27.8	Very low	27.8	Very low	103 Å²	103	111 Å²	111	55%	0.551	60%	0.604	S	S	*	*			trans	-83.8	136.5	168.7	-153.9	-8.5	0	0	0	107.7	V687 S691 D692	V687-N689 PolarHBondContact O-N 3.43Å; N689-S691 PolarHBondContact O-N 2.93Å; N689-D692 PolarHBondContact O-N 2.81Å
690	C	28	Very low	28.1	Very low	39 Å²	39	109.2 Å²	109.2	26%	0.264	61%	0.613	S	S	.	*	G	3₁₀ helix	trans	-55	-12.6	-176	-78.5	0	0	0	0	114.3	D692 C725	C690-D692 VanDerWaalsContact C-N 3.34Å; C690-C725 PolarHBondContact SG-O 2.98Å
691	S	30.2	Very low	28.5	Very low	78 Å²	78	112.1 Å²	112.1	55%	0.545	63%	0.625	S	S	.	*	G	3₁₀ helix	trans	-67.5	-27.3	172.8	-40.6	0	0	0	0	114	N689	N689-S691 PolarHBondContact O-N 2.93Å
692	D	31.3	Very low	28.8	Very low	100 Å²	100	107.1 Å²	107.1	54%	0.535	62%	0.616	S	S	.	*	G	3₁₀ helix	trans	-87	-9.1	-175.2	-69.5	-30	0	0	0	113.6	N689 C690	N689-D692 PolarHBondContact O-N 2.81Å; C690-D692 VanDerWaalsContact C-N 3.34Å
693	V	32.1	Very low	29.3	Very low	72 Å²	72	106.8 Å²	106.8	44%	0.436	61%	0.61	S	S	.	*	S	Bend	trans	-94.7	-12.2	178.3	-179.4	0	0	0	0	112
694	L	30.6	Very low	30.1	Very low	108 Å²	108	101.8 Å²	101.8	57%	0.565	59%	0.586	S	S	*	*	S	Bend	trans	-120.6	2.9	-170.2	-77.6	149.7	0	0	0	114.6	M730	L694-M730 HydrophobicContact CD1-CE 3.43Å; L694-M730 VanDerWaalsContact CD1-CE 3.43Å; L694-M730 HydrophobicContact CD2-CE 4.27Å
695	S	29.2	Very low	30.8	Very low	87 Å²	87	97.4 Å²	97.4	61%	0.608	56%	0.563	S	S	*	*	S	Bend	trans	-90.4	5.1	-176.2	59.1	0	0	0	0	115
696	T	27.9	Very low	31.5	Very low	99 Å²	99	91.8 Å²	91.8	61%	0.607	53%	0.534	S	S	*	.	S	Bend	trans	-139.4	94.8	175	47.4	0	0	0	0	110.2
697	T	29.5	Very low	32.4	Very low	84 Å²	84	94.5 Å²	94.5	52%	0.515	54%	0.539	S	S	.	.			trans	149.2	102.2	138.9	51.5	0	0	0	0	111.3	T699	T697-T699 WeakPolarHBondContact CB-OG1 3.09Å; T697-T699 PolarHBondContact O-N 2.79Å
698	T	26.9	Very low	33.4	Very low	106 Å²	106	93.1 Å²	93.1	65%	0.65	52%	0.522	S	S	*	.			trans	-66.5	71.9	152.5	37.1	0	0	0	0	109.4	Y613	Y613-T698 VanDerWaalsContact OH-CG2 3.29Å; Y613-T698 WeakPolarHBondContact OH-CG2 3.38Å
699	T	30.9	Very low	34.2	Very low	82 Å²	82	89.6 Å²	89.6	50%	0.503	51%	0.513	S	S	.	.			trans	-141.9	124.9	168.9	49.9	0	0	0	0	109.3	T697 D701	T697-T699 WeakPolarHBondContact CB-OG1 3.09Å; T697-T699 PolarHBondContact O-N 2.79Å; T699-D701 PolarHBondContact O-N 3.31Å
700	T	31.9	Very low	34.9	Very low	150 Å²	150	88.1 Å²	88.1	92%	0.92	51%	0.505	S	S	*	.			trans	-64.1	29.4	-179.6	39.2	0	0	0	0	114.9
701	D	32.9	Very low	35.7	Very low	106 Å²	106	89 Å²	89	57%	0.567	51%	0.51	S	S	*	.			trans	-104.7	88	-176.7	-110.9	-27.4	0	0	0	111.5	T699 N703 S704	T699-D701 PolarHBondContact O-N 3.31Å; D701-N703 PolarHBondContact O-N 2.81Å; D701-N703 VanDerWaalsContact O-N 3.1Å; D701-S704 PolarHBondContact O-N 3.2Å; D701-S704 PolarHBondContact O-OG 3.28Å
702	N	35	Very low	36.3	Very low	125 Å²	125	89 Å²	89	67%	0.668	50%	0.503	S	S	*	.	H	α-helix	trans	-57.1	-21.1	179.7	-78.9	-27.5	0	0	0	114	I706	N702-I706 WeakPolarHBondContact O-CD1 3.14Å; N702-I706 WeakPolarHBondContact O-CG1 3.23Å
703	N	35.6	Very low	36.7	Very low	107 Å²	107	88.4 Å²	88.4	57%	0.572	50%	0.499	S	S	*	.	H	α-helix	trans	-79	-32	-179.2	-70	-21.9	0	0	0	113.2	D701 N705 I706 D707	D701-N703 PolarHBondContact O-N 2.81Å; D701-N703 VanDerWaalsContact O-N 3.1Å; N703-N705 VanDerWaalsContact C-N 3.31Å; N703-N705 PolarHBondContact O-N 3.32Å; N703-I706 PolarHBondContact O-N 2.88Å; N703-D707 PolarHBondContact O-N 3.31Å
704	S	41.7	Very low	36.9	Very low	42 Å²	42	88.9 Å²	88.9	29%	0.294	51%	0.506	S	S	.	.	H	α-helix	trans	-71.4	-26.9	-177.7	79.2	0	0	0	0	113.4	D701 K708	D701-S704 PolarHBondContact O-N 3.2Å; D701-S704 PolarHBondContact O-OG 3.28Å; S704-K708 WeakPolarHBondContact O-CG 3.2Å; S704-K708 PolarHBondContact O-N 3.37Å
705	N	39.8	Very low	37.3	Very low	60 Å²	60	93.4 Å²	93.4	32%	0.321	52%	0.515	S	S	.	.	H	α-helix	trans	-75.1	-33.8	176.2	-72	-30	0	0	0	111.6	N703 I709	N703-N705 VanDerWaalsContact C-N 3.31Å; N703-N705 PolarHBondContact O-N 3.32Å; N705-I709 WeakPolarHBondContact O-CD1 3.25Å; N705-I709 VanDerWaalsContact O-CG1 3.23Å; N705-I709 WeakPolarHBondContact O-CG1 2.99Å; N705-I709 PolarHBondContact O-N 2.64Å; N705-I709 VanDerWaalsContact O-N 3.12Å
706	I	42.5	Very low	37.5	Very low	51 Å²	51	91.5 Å²	91.5	26%	0.262	51%	0.51	S	S	.	.	H	α-helix	trans	-69.5	-41.3	177.8	-67.2	169.1	0	0	0	110.6	N702 N703 I709 N710 T736	N702-I706 WeakPolarHBondContact O-CD1 3.14Å; N702-I706 WeakPolarHBondContact O-CG1 3.23Å; N703-I706 PolarHBondContact O-N 2.88Å; I706-I709 PolarHBondContact O-N 3.19Å; I706-N710 WeakPolarHBondContact CG2-ND2 3.45Å; I706-N710 WeakPolarHBondContact O-CB 3.26Å; I706-N710 VanDerWaalsContact O-CG 3.28Å; I706-N710 PolarHBondContact O-N 2.87Å; I706-N710 PolarHBondContact O-ND2 3.35Å; I706-T736 HydrophobicContact CD1-CG2 4.44Å; I706-T736 VanDerWaalsContact CD1-OG1 3.3Å; I706-T736 WeakPolarHBondContact CD1-OG1 3.27Å
707	D	44.2	Very low	37.6	Very low	101 Å²	101	91.6 Å²	91.6	54%	0.54	52%	0.515	S	S	.	.	H	α-helix	trans	-67.3	-37	177.7	-75	-22.5	0	0	0	112.8	N703 N710 T711	N703-D707 PolarHBondContact O-N 3.31Å; D707-N710 PolarHBondContact O-N 2.69Å; D707-T711 WeakPolarHBondContact O-CB 3.47Å; D707-T711 PolarHBondContact O-N 2.84Å; D707-T711 PolarHBondContact O-OG1 2.9Å
708	K	46.2	Very low	37.6	Very low	97 Å²	97	94.3 Å²	94.3	42%	0.422	53%	0.531	S	S	.	.	H	α-helix	trans	-64.4	-42.2	173.4	-74.7	174.1	-177.8	173.2	0	111.6	S704 T711 I712	S704-K708 WeakPolarHBondContact O-CG 3.2Å; S704-K708 PolarHBondContact O-N 3.37Å; K708-T711 PolarHBondContact O-N 3.43Å; K708-I712 WeakPolarHBondContact O-CD1 3.46Å; K708-I712 VanDerWaalsContact O-CG1 3.23Å; K708-I712 WeakPolarHBondContact O-CG1 3.26Å; K708-I712 PolarHBondContact O-N 3.47Å
709	I	43.9	Very low	37.7	Very low	84 Å²	84	92.7 Å²	92.7	43%	0.431	54%	0.535	S	S	.	.	H	α-helix	trans	-65.7	-44.5	175.6	-68.9	166.6	0	0	0	110.7	N705 I706 T711 I712 L713	N705-I709 WeakPolarHBondContact O-CD1 3.25Å; N705-I709 VanDerWaalsContact O-CG1 3.23Å; N705-I709 WeakPolarHBondContact O-CG1 2.99Å; N705-I709 PolarHBondContact O-N 2.64Å; N705-I709 VanDerWaalsContact O-N 3.12Å; I706-I709 PolarHBondContact O-N 3.19Å; I709-T711 VanDerWaalsContact C-N 3.29Å; I709-T711 PolarHBondContact O-N 2.95Å; I709-I712 PolarHBondContact O-N 2.71Å; I709-L713 HydrophobicContact CG2-CD1 3.72Å; I709-L713 HydrophobicContact CG2-CG 4.34Å; I709-L713 WeakPolarHBondContact O-CB 3.36Å; I709-L713 VanDerWaalsContact O-CG 3.24Å; I709-L713 WeakPolarHBondContact O-CG 3.19Å; I709-L713 PolarHBondContact O-N 3.35Å
710	N	43	Very low	37.5	Very low	72 Å²	72	95 Å²	95	39%	0.385	55%	0.553	S	S	.	*	H	α-helix	trans	-63.9	-32.6	175.9	-73.7	-25.1	0	0	0	112.6	I706 D707 L713 S714	I706-N710 WeakPolarHBondContact CG2-ND2 3.45Å; I706-N710 WeakPolarHBondContact O-CB 3.26Å; I706-N710 VanDerWaalsContact O-CG 3.28Å; I706-N710 PolarHBondContact O-N 2.87Å; I706-N710 PolarHBondContact O-ND2 3.35Å; D707-N710 PolarHBondContact O-N 2.69Å; N710-L713 PolarHBondContact O-N 3.35Å; N710-S714 VanDerWaalsContact O-CB 3.32Å; N710-S714 WeakPolarHBondContact O-CB 3.46Å; N710-S714 PolarHBondContact O-N 3.07Å; N710-S714 PolarHBondContact O-OG 2.02Å
711	T	44.1	Very low	37.5	Very low	58 Å²	58	90.8 Å²	90.8	36%	0.356	53%	0.529	S	S	.	.	H	α-helix	trans	-71	-35.8	175	-56.4	0	0	0	0	111.9	D707 K708 I709 S714 R715	D707-T711 WeakPolarHBondContact O-CB 3.47Å; D707-T711 PolarHBondContact O-N 2.84Å; D707-T711 PolarHBondContact O-OG1 2.9Å; K708-T711 PolarHBondContact O-N 3.43Å; I709-T711 VanDerWaalsContact C-N 3.29Å; I709-T711 PolarHBondContact O-N 2.95Å; T711-S714 WeakPolarHBondContact CA-OG 3.3Å; T711-S714 PolarHBondContact O-OG 3.32Å; T711-R715 WeakPolarHBondContact O-CG 3.19Å; T711-R715 PolarHBondContact O-N 3.34Å
712	I	44.2	Very low	37.5	Very low	77 Å²	77	88.8 Å²	88.8	40%	0.395	52%	0.521	S	S	.	.	H	α-helix	trans	-70.1	-38.9	174.2	-67.8	163.5	0	0	0	110.3	K708 I709	K708-I712 WeakPolarHBondContact O-CD1 3.46Å; K708-I712 VanDerWaalsContact O-CG1 3.23Å; K708-I712 WeakPolarHBondContact O-CG1 3.26Å; K708-I712 PolarHBondContact O-N 3.47Å; I709-I712 PolarHBondContact O-N 2.71Å
713	L	37.7	Very low	37.7	Very low	88 Å²	88	85.8 Å²	85.8	46%	0.461	51%	0.507	S	S	.	.	H	α-helix	trans	-74.3	-26.6	179	-67.9	169.8	0	0	0	113.8	I709 N710 L765	I709-L713 HydrophobicContact CG2-CD1 3.72Å; I709-L713 HydrophobicContact CG2-CG 4.34Å; I709-L713 WeakPolarHBondContact O-CB 3.36Å; I709-L713 VanDerWaalsContact O-CG 3.24Å; I709-L713 WeakPolarHBondContact O-CG 3.19Å; I709-L713 PolarHBondContact O-N 3.35Å; N710-L713 PolarHBondContact O-N 3.35Å; L713-L765 HydrophobicContact CD2-CD1 4.46Å
714	S	38.2	Very low	37.9	Very low	83 Å²	83	83.1 Å²	83.1	58%	0.58	49%	0.493	S	S	*	.	H	α-helix	trans	-88.7	-11	-179.7	51.3	0	0	0	0	114.9	N710 T711	N710-S714 VanDerWaalsContact O-CB 3.32Å; N710-S714 WeakPolarHBondContact O-CB 3.46Å; N710-S714 PolarHBondContact O-N 3.07Å; N710-S714 PolarHBondContact O-OG 2.02Å; T711-S714 WeakPolarHBondContact CA-OG 3.3Å; T711-S714 PolarHBondContact O-OG 3.32Å
715	R	38	Very low	37.8	Very low	202 Å²	202	83.1 Å²	83.1	76%	0.762	49%	0.492	S	S	*	.	S	Bend	trans	-95	-2.6	-180	-73	179.3	173.6	-179.4	-1.1	114.5	T711 S717	T711-R715 WeakPolarHBondContact O-CG 3.19Å; T711-R715 PolarHBondContact O-N 3.34Å; R715-S717 PolarHBondContact O-N 2.82Å; R715-S717 VanDerWaalsContact O-N 3.12Å
716	G	33.1	Very low	37.9	Very low	48 Å²	48	81.7 Å²	81.7	50%	0.495	49%	0.485	S	S	.	.			trans	-84	70.8	177.3	0	0	0	0	0	112.5
717	S	30.4	Very low	38	Very low	101 Å²	101	82.1 Å²	82.1	71%	0.706	49%	0.49	S	S	*	.	S	Bend	trans	-134.6	34.2	175.6	-61.5	0	0	0	0	112.5	R715	R715-S717 PolarHBondContact O-N 2.82Å; R715-S717 VanDerWaalsContact O-N 3.12Å
718	T	29.9	Very low	38	Very low	141 Å²	141	83 Å²	83	87%	0.865	49%	0.487	S	S	*	.	S	Bend	trans	-174.8	112.1	162	41.9	0	0	0	0	107.8
719	G	28	Very low	37.8	Very low	71 Å²	71	82.7 Å²	82.7	73%	0.732	50%	0.497	S	S	*	.	S	Bend	trans	91.7	140.5	179.8	0	0	0	0	0	114
720	C	27	Very low	37.9	Very low	130 Å²	130	81.7 Å²	81.7	88%	0.878	49%	0.491	S	S	*	.			trans	-39.4	128.3	-169.6	-68.2	0	0	0	0	115.1
721	P	31.9	Very low	38	Very low	63 Å²	63	85.4 Å²	85.4	41%	0.409	51%	0.511	S	S	.	.			trans	-72.4	145.1	179.3	29.4	-32.1	0	0	0	111.7
722	P	33.5	Very low	38.2	Very low	63 Å²	63	85.8 Å²	85.8	41%	0.409	51%	0.511	S	S	.	.			trans	-66.8	133	178.9	26.2	-32.6	0	0	0	111.8	I724	P722-I724 PolarHBondContact O-N 3.28Å
723	T	38	Very low	38.2	Very low	62 Å²	62	88 Å²	88	38%	0.38	52%	0.523	S	S	.	.			trans	-68.9	111.2	169.2	-53.6	0	0	0	0	109.5	C760 N762	T723-C760 HydrophobicContact CG2-CB 3.9Å; T723-N762 HydrophobicContact CG2-CB 4.24Å; T723-N762 PolarHBondContact OG1-ND2 2.94Å
724	I	40	Very low	38.6	Very low	51 Å²	51	85.3 Å²	85.3	26%	0.262	51%	0.508	S	S	.	.			trans	-92.5	118.6	170.8	-60.7	172.2	0	0	0	108	P722 C760 F761	P722-I724 PolarHBondContact O-N 3.28Å; I724-C760 CarbonylContact O-C 3.57Å; I724-C760 WeakPolarHBondContact O-CA 3.45Å; I724-F761 HydrophobicContact CB-CB 4.2Å; I724-F761 HydrophobicContact CB-CD2 4.28Å; I724-F761 HydrophobicContact CG2-CD2 4.22Å; I724-F761 PolarHBondContact O-N 2.91Å
725	C	39.8	Very low	38.8	Very low	43 Å²	43	85.9 Å²	85.9	29%	0.291	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	125.1	173.6	-61.5	0	0	0	0	110.5	C690 T758 L759 C760	C690-C725 PolarHBondContact SG-O 2.98Å; C725-T758 HydrophobicContact CB-CG2 3.82Å; C725-L759 CarbonylContact C-O 3.59Å; C725-L759 VanDerWaalsContact CA-O 3.23Å; C725-L759 WeakPolarHBondContact CA-O 3.26Å; C725-C760 HydrophobicContact CB-CB 4.3Å; C725-C760 WeakPolarHBondContact CB-SG 3.22Å; C725-C760 WeakPolarHBondContact SG-CB 3.32Å; C725-C760 CovalentContact SG-SG 2.07Å; C725-C760 PolarHBondContact SG-SG 3.04Å
726	L	43.1	Very low	38.8	Very low	30 Å²	30	80 Å²	80	16%	0.157	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	129	176.5	-68.2	179.9	0	0	0	110.9	M730 I732 T758 L759 F761	L726-M730 HydrophobicContact CD2-SD 4.01Å; L726-I732 HydrophobicContact CD1-CD1 3.36Å; L726-I732 HydrophobicContact CD2-CD1 3.9Å; L726-I732 HydrophobicContact CG-CD1 4.28Å; L726-T758 WeakPolarHBondContact O-CG2 3.33Å; L726-L759 PolarHBondContact N-O 3.27Å; L726-L759 PolarHBondContact O-N 3.41Å; L726-F761 HydrophobicContact CD1-CE2 3.55Å; L726-F761 HydrophobicContact CD1-CZ 4.22Å; L726-F761 HydrophobicContact CG-CE2 3.9Å
727	P	43.9	Very low	39.1	Very low	59 Å²	59	80.6 Å²	80.6	38%	0.383	49%	0.49	S	S	.	.			trans	-64.5	143	171.4	-4.6	15.5	0	0	0	110.9	S729 M730	P727-S729 PolarHBondContact O-N 3.46Å; P727-M730 PolarHBondContact O-N 2.96Å
728	Y	45.1	Very low	39.5	Very low	120 Å²	120	83 Å²	83	47%	0.471	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-19.9	177.6	67.6	-92.7	0	0	0	113.5	M730	Y728-M730 VanDerWaalsContact C-N 3.32Å; Y728-M730 PolarHBondContact O-N 2.87Å
729	S	41.3	Very low	40.3	Very low	90 Å²	90	80.3 Å²	80.3	63%	0.629	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-8.8	178.3	57.2	0	0	0	0	114.5	P727	P727-S729 PolarHBondContact O-N 3.46Å
730	M	44.8	Very low	41.2	Very low	63 Å²	63	85.2 Å²	85.2	31%	0.31	48%	0.484	S	S	.	.			trans	-80.7	124.7	178.9	-87.2	-168.5	152.9	0	0	113	L694 L726 P727 Y728 I732 K753	L694-M730 HydrophobicContact CD1-CE 3.43Å; L694-M730 VanDerWaalsContact CD1-CE 3.43Å; L694-M730 HydrophobicContact CD2-CE 4.27Å; L726-M730 HydrophobicContact CD2-SD 4.01Å; P727-M730 PolarHBondContact O-N 2.96Å; Y728-M730 VanDerWaalsContact C-N 3.32Å; Y728-M730 PolarHBondContact O-N 2.87Å; M730-I732 HydrophobicContact CB-CG1 4.31Å; M730-I732 PolarHBondContact O-N 2.02Å; M730-K753 WeakPolarHBondContact O-CE 3.2Å; M730-K753 PolarHBondContact O-NZ 3.36Å
731	N	46.4	Very low	42.3	Very low	150 Å²	150	86.5 Å²	86.5	80%	0.802	47%	0.471	S	S	*	.			trans	-88.1	97.3	165.6	-89.5	-29	0	0	0	110	K753	N731-K753 PolarHBondContact OD1-NZ 3.39Å
732	I	47	Very low	43.2	Very low	67 Å²	67	84.1 Å²	84.1	34%	0.344	46%	0.455	S	S	.	.			trans	-101.6	125.8	170.2	-53.4	-175	0	0	0	108.7	L726 M730 F734	L726-I732 HydrophobicContact CD1-CD1 3.36Å; L726-I732 HydrophobicContact CD2-CD1 3.9Å; L726-I732 HydrophobicContact CG-CD1 4.28Å; M730-I732 HydrophobicContact CB-CG1 4.31Å; M730-I732 PolarHBondContact O-N 2.02Å; I732-F734 HydrophobicContact CB-CD2 4.29Å; I732-F734 HydrophobicContact CB-CE1 4.48Å; I732-F734 HydrophobicContact CB-CE2 3.67Å; I732-F734 HydrophobicContact CB-CZ 3.81Å; I732-F734 HydrophobicContact CD1-CZ 4.17Å; I732-F734 HydrophobicContact CG2-CD1 4.05Å; I732-F734 HydrophobicContact CG2-CD2 4.11Å; I732-F734 HydrophobicContact CG2-CE1 3.69Å; I732-F734 HydrophobicContact CG2-CE2 3.7Å; I732-F734 HydrophobicContact CG2-CG 4.28Å; I732-F734 HydrophobicContact CG2-CZ 3.51Å
733	N	45	Very low	44	Very low	122 Å²	122	87 Å²	87	65%	0.652	47%	0.467	S	S	*	.			trans	-90.4	105	173.8	-172.7	-6.6	0	0	0	109	S735	N733-S735 VanDerWaalsContact C-N 3.28Å; N733-S735 VanDerWaalsContact CG-OG 3.24Å; N733-S735 PolarHBondContact ND2-OG 2.71Å; N733-S735 PolarHBondContact O-N 2.8Å; N733-S735 VanDerWaalsContact OD1-CB 3.23Å; N733-S735 WeakPolarHBondContact OD1-CB 3.45Å; N733-S735 PolarHBondContact OD1-N 2.99Å; N733-S735 PolarHBondContact OD1-OG 3.41Å
734	F	47.1	Very low	44.8	Very low	33 Å²	33	88.5 Å²	88.5	15%	0.145	47%	0.473	C	S	.	.			trans	-86.7	10.8	-179	-67.8	-75.2	0	0	0	114	I732 T736 L737 I745 V749	I732-F734 HydrophobicContact CB-CD2 4.29Å; I732-F734 HydrophobicContact CB-CE1 4.48Å; I732-F734 HydrophobicContact CB-CE2 3.67Å; I732-F734 HydrophobicContact CB-CZ 3.81Å; I732-F734 HydrophobicContact CD1-CZ 4.17Å; I732-F734 HydrophobicContact CG2-CD1 4.05Å; I732-F734 HydrophobicContact CG2-CD2 4.11Å; I732-F734 HydrophobicContact CG2-CE1 3.69Å; I732-F734 HydrophobicContact CG2-CE2 3.7Å; I732-F734 HydrophobicContact CG2-CG 4.28Å; I732-F734 HydrophobicContact CG2-CZ 3.51Å; F734-T736 PolarHBondContact O-N 3.2Å; F734-L737 HydrophobicContact CB-CD1 4.35Å; F734-L737 HydrophobicContact CD1-CD1 3.57Å; F734-L737 HydrophobicContact CE1-CD1 4.34Å; F734-L737 HydrophobicContact CG-CD1 4.39Å; F734-L737 PolarHBondContact O-N 3.46Å; F734-I745 HydrophobicContact CD1-CG2 4.24Å; F734-I745 HydrophobicContact CE1-CG2 3.94Å; F734-I745 HydrophobicContact CZ-CG2 4.1Å; F734-V749 HydrophobicContact CD2-CG2 4.46Å; F734-V749 HydrophobicContact CE2-CB 4.24Å; F734-V749 HydrophobicContact CE2-CG1 4.03Å; F734-V749 HydrophobicContact CE2-CG2 3.63Å; F734-V749 HydrophobicContact CZ-CG2 3.99Å
735	S	41.3	Very low	45.6	Very low	95 Å²	95	87.3 Å²	87.3	66%	0.664	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-5.8	-177.5	54.5	0	0	0	0	115.5	N733	N733-S735 VanDerWaalsContact C-N 3.28Å; N733-S735 VanDerWaalsContact CG-OG 3.24Å; N733-S735 PolarHBondContact ND2-OG 2.71Å; N733-S735 PolarHBondContact O-N 2.8Å; N733-S735 VanDerWaalsContact OD1-CB 3.23Å; N733-S735 WeakPolarHBondContact OD1-CB 3.45Å; N733-S735 PolarHBondContact OD1-N 2.99Å; N733-S735 PolarHBondContact OD1-OG 3.41Å
736	T	39.1	Very low	46.3	Very low	77 Å²	77	87.9 Å²	87.9	47%	0.472	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-2.8	-179.6	45.6	0	0	0	0	114.6	I706 F734 T738	I706-T736 HydrophobicContact CD1-CG2 4.44Å; I706-T736 VanDerWaalsContact CD1-OG1 3.3Å; I706-T736 WeakPolarHBondContact CD1-OG1 3.27Å; F734-T736 PolarHBondContact O-N 3.2Å; T736-T738 PolarHBondContact O-N 2.77Å
737	L	37.8	Very low	47.1	Very low	62 Å²	62	89.1 Å²	89.1	33%	0.325	48%	0.48	S	S	.	.			trans	-84.1	110.7	176	-77.6	168.2	0	0	0	110.6	F734 S742	F734-L737 HydrophobicContact CB-CD1 4.35Å; F734-L737 HydrophobicContact CD1-CD1 3.57Å; F734-L737 HydrophobicContact CE1-CD1 4.34Å; F734-L737 HydrophobicContact CG-CD1 4.39Å; F734-L737 PolarHBondContact O-N 3.46Å; L737-S742 VanDerWaalsContact CB-OG 3.24Å; L737-S742 WeakPolarHBondContact CB-OG 3.47Å; L737-S742 WeakPolarHBondContact O-CB 3.41Å; L737-S742 PolarHBondContact O-OG 2.86Å
738	T	39.1	Very low	47.7	Very low	151 Å²	151	87.5 Å²	87.5	93%	0.926	47%	0.467	S	S	*	.			trans	-91.8	11.6	-178.8	53.8	0	0	0	0	114.6	T736	T736-T738 PolarHBondContact O-N 2.77Å
739	D	47.5	Very low	48.3	Very low	85 Å²	85	82.7 Å²	82.7	46%	0.455	45%	0.45	S	S	.	.	S	Bend	trans	-96.2	149.7	-179.2	-168.3	-5.7	0	0	0	110.8	R741 S742	D739-R741 HydrophobicContact CB-CB 4.47Å; D739-R741 PolarHBondContact O-N 3.3Å; D739-S742 WeakPolarHBondContact O-CB 3.42Å; D739-S742 PolarHBondContact O-N 3.35Å
740	H	47.1	Very low	49.2	Very low	173 Å²	173	81 Å²	81	80%	0.801	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-18.4	175.6	-139	-69.2	0	0	0	112.4
741	R	50.5	Low	49.8	Very low	158 Å²	158	80 Å²	80	60%	0.596	43%	0.433	S	S	*	.	H	α-helix	trans	-74.5	-19.4	172.8	-66.6	177.2	167.4	171.1	-6	114.4	D739 N743 L744 I745	D739-R741 HydrophobicContact CB-CB 4.47Å; D739-R741 PolarHBondContact O-N 3.3Å; R741-N743 PolarHBondContact O-N 2.79Å; R741-L744 PolarHBondContact O-N 2.98Å; R741-I745 WeakPolarHBondContact O-CG1 3.41Å; R741-I745 PolarHBondContact O-N 2.95Å
742	S	49.1	Very low	50.1	Low	13 Å²	13	73.5 Å²	73.5	9%	0.091	40%	0.399	C	S	.	.	H	α-helix	trans	-60.4	-42.4	178.8	-175.7	0	0	0	0	112.8	L737 D739 I745 T746	L737-S742 VanDerWaalsContact CB-OG 3.24Å; L737-S742 WeakPolarHBondContact CB-OG 3.47Å; L737-S742 WeakPolarHBondContact O-CB 3.41Å; L737-S742 PolarHBondContact O-OG 2.86Å; D739-S742 WeakPolarHBondContact O-CB 3.42Å; D739-S742 PolarHBondContact O-N 3.35Å; S742-I745 PolarHBondContact O-N 3.38Å; S742-T746 VanDerWaalsContact O-CB 3.28Å; S742-T746 WeakPolarHBondContact O-CB 3.26Å; S742-T746 PolarHBondContact O-N 2.86Å; S742-T746 PolarHBondContact O-OG1 2.93Å
743	N	51.7	Low	50.5	Low	122 Å²	122	73.8 Å²	73.8	65%	0.652	40%	0.398	S	S	*	.	H	α-helix	trans	-67.4	-37.2	178.7	-72	-24.8	0	0	0	112.2	R741 S747	R741-N743 PolarHBondContact O-N 2.79Å; N743-S747 VanDerWaalsContact O-CB 3.31Å; N743-S747 WeakPolarHBondContact O-CB 3.18Å; N743-S747 PolarHBondContact O-N 3.4Å
744	L	54.7	Low	51.1	Low	95 Å²	95	77.1 Å²	77.1	50%	0.497	40%	0.401	S	S	.	.	H	α-helix	trans	-67.2	-48.4	177.5	-164.1	76.6	0	0	0	110.5	R741 T746 S747 E748 I764	R741-L744 PolarHBondContact O-N 2.98Å; L744-T746 VanDerWaalsContact C-N 3.34Å; L744-T746 PolarHBondContact O-N 3.11Å; L744-S747 PolarHBondContact O-N 2.87Å; L744-E748 WeakPolarHBondContact O-CG 3.37Å; L744-E748 PolarHBondContact O-N 2.83Å; L744-I764 HydrophobicContact CD2-CG2 4.42Å
745	I	55.4	Low	51.4	Low	25 Å²	25	80.2 Å²	80.2	13%	0.128	42%	0.415	C	S	.	.	H	α-helix	trans	-61.1	-43.6	177	-65.8	165.9	0	0	0	110.7	F734 R741 S742 S747 E748 V749 F761 I764	F734-I745 HydrophobicContact CD1-CG2 4.24Å; F734-I745 HydrophobicContact CE1-CG2 3.94Å; F734-I745 HydrophobicContact CZ-CG2 4.1Å; R741-I745 WeakPolarHBondContact O-CG1 3.41Å; R741-I745 PolarHBondContact O-N 2.95Å; S742-I745 PolarHBondContact O-N 3.38Å; I745-S747 PolarHBondContact O-N 3.31Å; I745-E748 PolarHBondContact O-N 2.85Å; I745-V749 HydrophobicContact CG2-CG2 4.17Å; I745-V749 WeakPolarHBondContact O-CB 3.03Å; I745-V749 WeakPolarHBondContact O-CG2 3.35Å; I745-V749 PolarHBondContact O-N 3.41Å; I745-F761 HydrophobicContact CG2-CE1 4.39Å; I745-F761 HydrophobicContact CG2-CZ 4.42Å; I745-I764 HydrophobicContact CG1-CG2 4.3Å
746	T	55.8	Low	51.8	Low	55 Å²	55	81.3 Å²	81.3	34%	0.337	41%	0.413	S	S	.	.	H	α-helix	trans	-64.9	-39.1	178.9	-57.3	0	0	0	0	112	S742 L744 S750	S742-T746 VanDerWaalsContact O-CB 3.28Å; S742-T746 WeakPolarHBondContact O-CB 3.26Å; S742-T746 PolarHBondContact O-N 2.86Å; S742-T746 PolarHBondContact O-OG1 2.93Å; L744-T746 VanDerWaalsContact C-N 3.34Å; L744-T746 PolarHBondContact O-N 3.11Å; T746-S750 VanDerWaalsContact O-CB 3.28Å; T746-S750 WeakPolarHBondContact O-CB 3.3Å; T746-S750 PolarHBondContact O-N 3.23Å; T746-S750 PolarHBondContact O-OG 3.06Å
747	S	58.6	Low	52.2	Low	57 Å²	57	80.9 Å²	80.9	40%	0.399	41%	0.406	S	S	.	.	H	α-helix	trans	-64.8	-48.3	175.3	-178.9	0	0	0	0	111.8	N743 L744 I745 S750 Q751	N743-S747 VanDerWaalsContact O-CB 3.31Å; N743-S747 WeakPolarHBondContact O-CB 3.18Å; N743-S747 PolarHBondContact O-N 3.4Å; L744-S747 PolarHBondContact O-N 2.87Å; I745-S747 PolarHBondContact O-N 3.31Å; S747-S750 PolarHBondContact O-N 2.9Å; S747-Q751 WeakPolarHBondContact O-CB 3.41Å; S747-Q751 PolarHBondContact O-N 2.89Å
748	E	58.3	Low	52.6	Low	24 Å²	24	81.5 Å²	81.5	11%	0.112	41%	0.412	C	S	.	.	H	α-helix	trans	-66.2	-41.8	180	-68.8	-57	149.4	0	0	112	L744 I745 S750 Q751 C752 L759 I764	L744-E748 WeakPolarHBondContact O-CG 3.37Å; L744-E748 PolarHBondContact O-N 2.83Å; I745-E748 PolarHBondContact O-N 2.85Å; E748-S750 VanDerWaalsContact C-N 3.33Å; E748-S750 PolarHBondContact O-N 2.8Å; E748-Q751 PolarHBondContact O-N 2.74Å; E748-C752 WeakPolarHBondContact O-CB 3.32Å; E748-C752 PolarHBondContact O-N 2.91Å; E748-C752 PolarHBondContact O-SG 2.92Å; E748-L759 HydrophobicContact CB-CD1 4.27Å; E748-I764 HydrophobicContact CB-CD1 4.39Å; E748-I764 HydrophobicContact CG-CD1 4.5Å
749	V	57.3	Low	53	Low	19 Å²	19	75.1 Å²	75.1	12%	0.115	37%	0.372	C	S	.	.	H	α-helix	trans	-60.3	-43.8	172.8	170.5	0	0	0	0	110.9	F734 I745 Q751 C752 K753 L759	F734-V749 HydrophobicContact CD2-CG2 4.46Å; F734-V749 HydrophobicContact CE2-CB 4.24Å; F734-V749 HydrophobicContact CE2-CG1 4.03Å; F734-V749 HydrophobicContact CE2-CG2 3.63Å; F734-V749 HydrophobicContact CZ-CG2 3.99Å; I745-V749 HydrophobicContact CG2-CG2 4.17Å; I745-V749 WeakPolarHBondContact O-CB 3.03Å; I745-V749 WeakPolarHBondContact O-CG2 3.35Å; I745-V749 PolarHBondContact O-N 3.41Å; V749-Q751 VanDerWaalsContact C-N 3.28Å; V749-Q751 PolarHBondContact O-N 3.17Å; V749-C752 PolarHBondContact O-N 3.42Å; V749-K753 HydrophobicContact CG1-CD 4.37Å; V749-K753 WeakPolarHBondContact O-CB 3.07Å; V749-K753 WeakPolarHBondContact O-CG 3.34Å; V749-K753 PolarHBondContact O-N 3.22Å; V749-L759 HydrophobicContact CG2-CD2 3.65Å
750	S	58.7	Low	52.9	Low	54 Å²	54	72.5 Å²	72.5	38%	0.378	36%	0.36	S	S	.	.	H	α-helix	trans	-66.7	-31.5	178	-60.7	0	0	0	0	112.1	T746 S747 E748 R754	T746-S750 VanDerWaalsContact O-CB 3.28Å; T746-S750 WeakPolarHBondContact O-CB 3.3Å; T746-S750 PolarHBondContact O-N 3.23Å; T746-S750 PolarHBondContact O-OG 3.06Å; S747-S750 PolarHBondContact O-N 2.9Å; E748-S750 VanDerWaalsContact C-N 3.33Å; E748-S750 PolarHBondContact O-N 2.8Å; S750-R754 WeakPolarHBondContact O-CB 3.42Å; S750-R754 WeakPolarHBondContact O-CG 3.15Å; S750-R754 PolarHBondContact O-N 2.89Å; S750-R754 VanDerWaalsContact O-N 3.13Å; S750-R754 PolarHBondContact O-NE 3.21Å
751	Q	58.1	Low	53	Low	43 Å²	43	66 Å²	66	20%	0.201	33%	0.33	C	S	.	.	H	α-helix	trans	-73.6	-43.5	174.8	-178.8	157.9	-34.2	0	0	112	S747 E748 V749 R754 K755 Y774	S747-Q751 WeakPolarHBondContact O-CB 3.41Å; S747-Q751 PolarHBondContact O-N 2.89Å; E748-Q751 PolarHBondContact O-N 2.74Å; V749-Q751 VanDerWaalsContact C-N 3.28Å; V749-Q751 PolarHBondContact O-N 3.17Å; Q751-R754 PolarHBondContact O-N 3.34Å; Q751-K755 HydrophobicContact CG-CD 4.23Å; Q751-K755 WeakPolarHBondContact O-CB 3.26Å; Q751-K755 WeakPolarHBondContact O-CG 3.48Å; Q751-K755 PolarHBondContact O-N 3.04Å; Q751-K755 VanDerWaalsContact O-N 3.1Å; Q751-Y774 PolarHBondContact NE2-OH 3.46Å
752	C	52.8	Low	52.6	Low	13 Å²	13	60.2 Å²	60.2	9%	0.088	31%	0.311	C	S	.	.	H	α-helix	trans	-65	-40	174.7	-73.6	0	0	0	0	112	E748 V749 R754 K755 N756 Q757 L759	E748-C752 WeakPolarHBondContact O-CB 3.32Å; E748-C752 PolarHBondContact O-N 2.91Å; E748-C752 PolarHBondContact O-SG 2.92Å; V749-C752 PolarHBondContact O-N 3.42Å; C752-R754 PolarHBondContact O-N 3.24Å; C752-K755 CarbonylContact O-C 3.54Å; C752-K755 PolarHBondContact O-N 3.4Å; C752-K755 VanDerWaalsContact O-N 3.13Å; C752-N756 PolarHBondContact O-N 2.86Å; C752-Q757 HydrophobicContact CB-CB 4.21Å; C752-Q757 PolarHBondContact O-N 3.36Å; C752-L759 HydrophobicContact CB-CD1 4.49Å; C752-L759 VanDerWaalsContact SG-CD1 3.52Å
753	K	56.4	Low	52.2	Low	74 Å²	74	64 Å²	64	32%	0.322	33%	0.33	S	S	.	.	H	α-helix	trans	-60.5	-42.9	171.6	-79.4	-173.3	176.2	-171.6	0	112.2	M730 N731 V749 K755	M730-K753 WeakPolarHBondContact O-CE 3.2Å; M730-K753 PolarHBondContact O-NZ 3.36Å; N731-K753 PolarHBondContact OD1-NZ 3.39Å; V749-K753 HydrophobicContact CG1-CD 4.37Å; V749-K753 WeakPolarHBondContact O-CB 3.07Å; V749-K753 WeakPolarHBondContact O-CG 3.34Å; V749-K753 PolarHBondContact O-N 3.22Å; K753-K755 PolarHBondContact O-N 3.38Å
754	R	56.3	Low	51.8	Low	191 Å²	191	60 Å²	60	72%	0.721	31%	0.308	S	S	*	.	H	α-helix	trans	-64.8	-23.7	175.5	-81	-176	-72	-179.9	-0.1	113.4	S750 Q751 C752	S750-R754 WeakPolarHBondContact O-CB 3.42Å; S750-R754 WeakPolarHBondContact O-CG 3.15Å; S750-R754 PolarHBondContact O-N 2.89Å; S750-R754 VanDerWaalsContact O-N 3.13Å; S750-R754 PolarHBondContact O-NE 3.21Å; Q751-R754 PolarHBondContact O-N 3.34Å; C752-R754 PolarHBondContact O-N 3.24Å
755	K	53.1	Low	51.2	Low	99 Å²	99	59.5 Å²	59.5	43%	0.43	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	3.6	-175.6	-67.2	179.3	177.3	177.2	0	114.2	Q751 C752 K753 Q757	Q751-K755 HydrophobicContact CG-CD 4.23Å; Q751-K755 WeakPolarHBondContact O-CB 3.26Å; Q751-K755 WeakPolarHBondContact O-CG 3.48Å; Q751-K755 PolarHBondContact O-N 3.04Å; Q751-K755 VanDerWaalsContact O-N 3.1Å; C752-K755 CarbonylContact O-C 3.54Å; C752-K755 PolarHBondContact O-N 3.4Å; C752-K755 VanDerWaalsContact O-N 3.13Å; K753-K755 PolarHBondContact O-N 3.38Å; K755-Q757 HydrophobicContact CB-CB 4.36Å; K755-Q757 HydrophobicContact CB-CG 3.75Å; K755-Q757 PolarHBondContact O-N 3.4Å
756	N	50.9	Low	50.5	Low	118 Å²	118	63.8 Å²	63.8	63%	0.631	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	41.7	-170.7	-70.6	-18.1	0	0	0	113.1	C752	C752-N756 PolarHBondContact O-N 2.86Å
757	Q	47.1	Very low	49.4	Very low	68 Å²	68	64.6 Å²	64.6	32%	0.318	35%	0.348	S	S	.	.			trans	-106.7	142.6	-175.4	-73.6	174.7	-18.5	0	0	111.9	C752 K755	C752-Q757 HydrophobicContact CB-CB 4.21Å; C752-Q757 PolarHBondContact O-N 3.36Å; K755-Q757 HydrophobicContact CB-CB 4.36Å; K755-Q757 HydrophobicContact CB-CG 3.75Å; K755-Q757 PolarHBondContact O-N 3.4Å
758	T	46.2	Very low	48.2	Very low	75 Å²	75	66.6 Å²	66.6	46%	0.46	36%	0.358	S	S	.	.			trans	-73.2	129.9	168.8	-57.3	0	0	0	0	109.4	C725 L726	C725-T758 HydrophobicContact CB-CG2 3.82Å; L726-T758 WeakPolarHBondContact O-CG2 3.33Å
759	L	46.6	Very low	47.1	Very low	17 Å²	17	75.1 Å²	75.1	9%	0.089	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	118.6	177.8	-174.4	81.5	0	0	0	109.5	C725 L726 E748 V749 C752 F761 I764	C725-L759 CarbonylContact C-O 3.59Å; C725-L759 VanDerWaalsContact CA-O 3.23Å; C725-L759 WeakPolarHBondContact CA-O 3.26Å; L726-L759 PolarHBondContact N-O 3.27Å; L726-L759 PolarHBondContact O-N 3.41Å; E748-L759 HydrophobicContact CB-CD1 4.27Å; V749-L759 HydrophobicContact CG2-CD2 3.65Å; C752-L759 HydrophobicContact CB-CD1 4.49Å; C752-L759 VanDerWaalsContact SG-CD1 3.52Å; L759-F761 HydrophobicContact CD2-CD2 4.4Å; L759-F761 HydrophobicContact CD2-CE2 3.78Å; L759-F761 HydrophobicContact CD2-CZ 3.95Å; L759-I764 HydrophobicContact CD1-CD1 4.32Å
760	C	45.5	Very low	46	Very low	29 Å²	29	81.3 Å²	81.3	20%	0.196	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122.7	174.4	-64.8	0	0	0	0	110.8	T723 I724 C725 N762	T723-C760 HydrophobicContact CG2-CB 3.9Å; I724-C760 CarbonylContact O-C 3.57Å; I724-C760 WeakPolarHBondContact O-CA 3.45Å; C725-C760 HydrophobicContact CB-CB 4.3Å; C725-C760 WeakPolarHBondContact CB-SG 3.22Å; C725-C760 WeakPolarHBondContact SG-CB 3.32Å; C725-C760 CovalentContact SG-SG 2.07Å; C725-C760 PolarHBondContact SG-SG 3.04Å; C760-N762 PolarHBondContact O-N 3.04Å; C760-N762 VanDerWaalsContact O-N 3.15Å
761	F	49	Very low	44.8	Very low	36 Å²	36	86.2 Å²	86.2	16%	0.158	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	1.3	-168.5	-89.9	-90.8	0	0	0	116	I724 L726 I745 L759 D763	I724-F761 HydrophobicContact CB-CB 4.2Å; I724-F761 HydrophobicContact CB-CD2 4.28Å; I724-F761 HydrophobicContact CG2-CD2 4.22Å; I724-F761 PolarHBondContact O-N 2.91Å; L726-F761 HydrophobicContact CD1-CE2 3.55Å; L726-F761 HydrophobicContact CD1-CZ 4.22Å; L726-F761 HydrophobicContact CG-CE2 3.9Å; I745-F761 HydrophobicContact CG2-CE1 4.39Å; I745-F761 HydrophobicContact CG2-CZ 4.42Å; L759-F761 HydrophobicContact CD2-CD2 4.4Å; L759-F761 HydrophobicContact CD2-CE2 3.78Å; L759-F761 HydrophobicContact CD2-CZ 3.95Å; F761-D763 VanDerWaalsContact C-N 3.33Å; F761-D763 PolarHBondContact O-N 2.84Å
762	N	43.7	Very low	43.6	Very low	38 Å²	38	88.5 Å²	88.5	20%	0.203	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-16.9	-177.2	-125.2	-15.2	0	0	0	113.7	T723 C760	T723-N762 HydrophobicContact CG2-CB 4.24Å; T723-N762 PolarHBondContact OG1-ND2 2.94Å; C760-N762 PolarHBondContact O-N 3.04Å; C760-N762 VanDerWaalsContact O-N 3.15Å
763	D	40.6	Very low	42.5	Very low	92 Å²	92	96.6 Å²	96.6	49%	0.492	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-12.3	-177.1	-62	-34.4	0	0	0	113.8	F761	F761-D763 VanDerWaalsContact C-N 3.33Å; F761-D763 PolarHBondContact O-N 2.84Å
764	I	43.6	Very low	41.3	Very low	39 Å²	39	97.8 Å²	97.8	20%	0.2	50%	0.499	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-22.4	-177.7	-62.6	174.2	0	0	0	111.9	L744 I745 E748 L759	L744-I764 HydrophobicContact CD2-CG2 4.42Å; I745-I764 HydrophobicContact CG1-CG2 4.3Å; E748-I764 HydrophobicContact CB-CD1 4.39Å; E748-I764 HydrophobicContact CG-CD1 4.5Å; L759-I764 HydrophobicContact CD1-CD1 4.32Å
765	L	41.8	Very low	39.9	Very low	83 Å²	83	97.7 Å²	97.7	44%	0.435	50%	0.504	S	S	.	.	S	Bend	trans	-92.5	-18	-173	-68.9	169.3	0	0	0	114.2	L713 G767	L713-L765 HydrophobicContact CD2-CD1 4.46Å; L765-G767 PolarHBondContact O-N 3.49Å
766	N	41	Very low	38.7	Very low	115 Å²	115	102.7 Å²	102.7	62%	0.615	52%	0.522	S	S	*	.	S	Bend	trans	-102.2	52	-175.5	-73.9	-35.6	0	0	0	113.3	T768	N766-T768 PolarHBondContact O-N 3.49Å
767	G	32.4	Very low	37.6	Very low	72 Å²	72	104 Å²	104	74%	0.742	53%	0.529	S	S	*	.			trans	-39	106.2	-176.1	0	0	0	0	0	115.6	L765	L765-G767 PolarHBondContact O-N 3.49Å
768	T	32.8	Very low	36.8	Very low	100 Å²	100	105.3 Å²	105.3	61%	0.613	55%	0.545	S	S	*	.			trans	-134.2	127.8	134.7	51.2	0	0	0	0	105.5	N766 N770	N766-T768 PolarHBondContact O-N 3.49Å; T768-N770 PolarHBondContact O-N 3.01Å
769	E	35.6	Very low	35.8	Very low	202 Å²	202	108 Å²	108	94%	0.944	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.1	6.2	-170.2	-73.2	175.4	142.2	0	0	115.8
770	N	33.8	Very low	34.9	Very low	150 Å²	150	114.5 Å²	114.5	80%	0.802	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127	16.3	-165.9	-74.7	-31	0	0	0	116	T768	T768-N770 PolarHBondContact O-N 3.01Å
771	Q	33.4	Very low	34	Very low	157 Å²	157	122 Å²	122	73%	0.734	62%	0.617	S	S	*	*			trans	-136	27.4	-176.5	-71.2	-161	-12.3	0	0	117.2	Q773	Q771-Q773 PolarHBondContact O-N 3.32Å
772	I	32.2	Very low	32.8	Very low	90 Å²	90	128.5 Å²	128.5	46%	0.462	65%	0.653	S	S	.	*			trans	-77.5	90.3	168.4	-54.5	177.2	0	0	0	108.9	Y774	I772-Y774 HydrophobicContact CG2-CE2 4.06Å; I772-Y774 PolarHBondContact O-N 2.92Å
773	Q	30.2	Very low	32	Very low	183 Å²	183	135.8 Å²	135.8	86%	0.855	68%	0.683	S	S	*	*			trans	-81.2	106.1	172.4	-91.6	-174	-22.5	0	0	110.4	Q771 K775	Q771-Q773 PolarHBondContact O-N 3.32Å; Q773-K775 PolarHBondContact O-N 2.62Å
774	Y	30.4	Very low	31.4	Very low	99 Å²	99	136.9 Å²	136.9	39%	0.388	70%	0.695	S	S	.	*			trans	-68.6	110.3	163.3	-62.9	-86.4	0	0	0	108.9	Q751 I772 Y776	Q751-Y774 PolarHBondContact NE2-OH 3.46Å; I772-Y774 HydrophobicContact CG2-CE2 4.06Å; I772-Y774 PolarHBondContact O-N 2.92Å; Y774-Y776 PolarHBondContact O-N 3.26Å
775	K	28.3	Very low	30.7	Very low	190 Å²	190	143.1 Å²	143.1	83%	0.826	73%	0.729	S	S	*	*			trans	-82.4	113.2	171.9	-140.5	179	-176.9	-175.8	0	108.9	Q773	Q773-K775 PolarHBondContact O-N 2.62Å
776	Y	27.1	Very low	30	Very low	204 Å²	204	147.8 Å²	147.8	80%	0.8	75%	0.748	S	S	*	*			trans	-70	139.2	169.5	-82.1	-96.2	0	0	0	109.7	Y774	Y774-Y776 PolarHBondContact O-N 3.26Å
777	D	27.5	Very low	29.3	Very low	145 Å²	145	151.2 Å²	151.2	78%	0.775	76%	0.761	S	S	*	*			trans	-107.8	100.4	151.3	-136.2	-6.4	0	0	0	106.1
778	S	30.5	Very low	29	Very low	95 Å²	95	153 Å²	153	66%	0.664	76%	0.762	S	S	*	*			trans	-85.6	117.2	178.6	50.4	0	0	0	0	110
779	T	25.3	Very low	28.8	Very low	131 Å²	131	156.8 Å²	156.8	80%	0.804	77%	0.772	S	S	*	*			trans	-14.6	132.7	153.7	49.1	0	0	0	0	117.5
780	E	27.4	Very low	28.3	Very low	155 Å²	155	152.7 Å²	152.7	72%	0.724	76%	0.762	S	S	*	*				-168.2	132.2	129.7	-113.4	-177.1	160.9	0	0	114.7
781	Y	26.9	Very low	28	Very low	185 Å²	185	152.6 Å²	152.6	73%	0.725	76%	0.759	S	S	*	*			trans	78.7	80.5	163.9	-58.6	-71.5	0	0	0	122.1
782	L	24.7	Very low	27.8	Very low	174 Å²	174	150.6 Å²	150.6	91%	0.911	76%	0.758	S	S	*	*			trans	-70.4	119.2	139.3	-82.9	153.9	0	0	0	109.8
783	K	27.1	Very low	27.7	Very low	191 Å²	191	153.5 Å²	153.5	83%	0.83	77%	0.774	S	S	*	*			trans	-109	120	152.3	-86.3	-171.9	178.4	-179.9	0	108.1
784	P	26.7	Very low	27.6	Very low	114 Å²	114	153.6 Å²	153.6	74%	0.74	78%	0.775	S	S	*	*			trans	-83.2	118.5	176	30.9	-27.5	0	0	0	109.4	Q786	P784-Q786 PolarHBondContact O-N 3.27Å
785	N	30	Very low	27.6	Very low	171 Å²	171	157.8 Å²	157.8	91%	0.914	80%	0.798	S	S	*	*			trans	-81.5	110.3	164.2	-104.5	-8.5	0	0	0	108.8
786	Q	27.4	Very low	27.8	Very low	180 Å²	180	158.1 Å²	158.1	84%	0.841	80%	0.802	S	S	*	*			trans	-58.2	126.6	166	-66.2	172.8	-36.5	0	0	110.1	P784	P784-Q786 PolarHBondContact O-N 3.27Å
787	Q	26.2	Very low	28	Very low	187 Å²	187	153.3 Å²	153.3	87%	0.874	80%	0.798	S	S	*	*			trans	-163	137.9	134.6	-107.7	172.2	14.7	0	0	108.8
788	S	24.7	Very low	28.4	Very low	110 Å²	110	152.2 Å²	152.2	77%	0.769	80%	0.797	S	S	*	*			trans	78.3	95.8	174.2	70.4	0	0	0	0	117.7
789	Q	28.4	Very low	28.7	Very low	179 Å²	179	155.7 Å²	155.7	84%	0.836	80%	0.803	S	S	*	*				174.9	104.2	107.3	-90.6	176.1	1.4	0	0	111.4
790	T	26.6	Very low	29.1	Very low	117 Å²	117	158.4 Å²	158.4	72%	0.718	80%	0.8	S	S	*	*				36.9	104.2	119.4	-17.7	0	0	0	0	118.7
791	I	26.7	Very low	29.7	Very low	147 Å²	147	158.4 Å²	158.4	75%	0.754	80%	0.8	S	S	*	*			trans	68.7	120	139	-40	169.2	0	0	0	118.8
792	V	28.8	Very low	30.3	Very low	116 Å²	116	157.9 Å²	157.9	70%	0.703	80%	0.801	S	S	*	*				139.9	97	126.9	-176.3	0	0	0	0	112.3
793	N	31.6	Very low	30.9	Very low	151 Å²	151	155.8 Å²	155.8	81%	0.807	79%	0.79	S	S	*	*			trans	65.1	128.3	132.5	-54.9	-4.8	0	0	0	123.6
794	E	26.6	Very low	31.4	Very low	184 Å²	184	153 Å²	153	86%	0.86	78%	0.784	S	S	*	*			trans	-61.6	140.2	172.3	-65.4	160.2	138	0	0	113.7
795	E	31.1	Very low	31.9	Very low	187 Å²	187	152.4 Å²	152.4	87%	0.874	78%	0.782	S	S	*	*			trans	155.2	96.5	135.4	-89.1	-178.9	166.2	0	0	109.4
796	Q	33.5	Very low	32.3	Very low	198 Å²	198	149 Å²	149	93%	0.925	77%	0.772	S	S	*	*			trans	175.3	53.8	146.6	-95.5	174.6	24.6	0	0	111.9
797	S	29.8	Very low	32.6	Very low	102 Å²	102	144.7 Å²	144.7	71%	0.713	77%	0.767	S	S	*	*			trans	-100.1	75.1	174.5	168.8	0	0	0	0	111.5
798	T	36.4	Very low	32.9	Very low	123 Å²	123	141.1 Å²	141.1	76%	0.755	76%	0.763	S	S	*	*	S	Bend	trans	-142.5	-5.3	173	-13	0	0	0	0	116.4
799	E	37.2	Very low	33.3	Very low	168 Å²	168	143.1 Å²	143.1	79%	0.785	77%	0.765	S	S	*	*	S	Bend	trans	-111.8	-22.2	-178.8	-154.7	160.3	-168.8	0	0	113.6
800	Y	32.5	Very low	33.5	Very low	188 Å²	188	143.8 Å²	143.8	74%	0.737	77%	0.77	S	S	*	*	G	3₁₀ helix	trans	-81.1	-22.3	-178.7	-148.6	-100.6	0	0	0	113.8	K802 L804	Y800-K802 VanDerWaalsContact C-N 3.35Å; Y800-K802 PolarHBondContact O-N 2.72Å; Y800-L804 HydrophobicContact CD1-CD1 4.25Å; Y800-L804 HydrophobicContact CE1-CD1 4.24Å
801	Q	40.5	Very low	33.6	Very low	154 Å²	154	152 Å²	152	72%	0.72	80%	0.796	S	S	*	*	G	3₁₀ helix	trans	-79.8	-9.9	179.4	-78.9	-98.7	-24.4	0	0	114
802	K	40.1	Very low	34	Very low	175 Å²	175	152.3 Å²	152.3	76%	0.761	80%	0.798	S	S	*	*	G	3₁₀ helix	trans	-93.4	-11.9	176.7	-91	-179.9	176.7	175.7	0	114.6	Y800	Y800-K802 VanDerWaalsContact C-N 3.35Å; Y800-K802 PolarHBondContact O-N 2.72Å
803	L	36.8	Very low	34.3	Very low	130 Å²	130	154.2 Å²	154.2	68%	0.681	80%	0.804	S	S	*	*	S	Bend	trans	-96.9	-7.4	-178.1	-82.6	159.4	0	0	0	114
804	L	38.7	Very low	34.4	Very low	132 Å²	132	154.4 Å²	154.4	69%	0.691	80%	0.803	S	S	*	*	S	Bend	trans	-99	2.5	-177.9	-76.5	161.2	0	0	0	114.4	Y800	Y800-L804 HydrophobicContact CD1-CD1 4.25Å; Y800-L804 HydrophobicContact CE1-CD1 4.24Å
805	S	36.1	Very low	34.9	Very low	101 Å²	101	152.6 Å²	152.6	71%	0.706	80%	0.8	S	S	*	*	S	Bend	trans	-99.3	6.8	-179.3	56.5	0	0	0	0	115.1
806	S	38	Very low	35.1	Very low	99 Å²	99	150.5 Å²	150.5	69%	0.692	80%	0.795	S	S	*	*	S	Bend	trans	-121	8.7	-171.5	52.1	0	0	0	0	116.5
807	A	34.3	Very low	35.2	Very low	91 Å²	91	147.3 Å²	147.3	75%	0.752	79%	0.787	S	S	*	*			trans	-117.1	12.5	-176.3	0	0	0	0	0	116	N809	A807-N809 VanDerWaalsContact C-N 3.33Å; A807-N809 PolarHBondContact O-N 3.5Å
808	S	31.8	Very low	35.6	Very low	112 Å²	112	150.6 Å²	150.6	78%	0.783	79%	0.792	S	S	*	*			trans	-87.8	25.4	179.5	-60.1	0	0	0	0	115.5
809	N	33.6	Very low	35.5	Very low	152 Å²	152	152.7 Å²	152.7	81%	0.813	80%	0.795	S	S	*	*			trans	-142.7	93.1	177.3	-81.9	-37	0	0	0	110.2	A807	A807-N809 VanDerWaalsContact C-N 3.33Å; A807-N809 PolarHBondContact O-N 3.5Å
810	M	32.9	Very low	35.4	Very low	192 Å²	192	151.4 Å²	151.4	95%	0.946	80%	0.796	S	S	*	*			trans	167.5	104.9	134.1	-89.7	176.4	107.5	0	0	111.6
811	K	29.4	Very low	35.7	Very low	291 Å²	291	148.1 Å²	148.1	100%	1.265	80%	0.801	S	S	*	*			trans	73.1	0	171.8	-80.4	-173.1	176.9	-179.5	0	119.4

Retrieved 811 of 811 residues in 123.7 ms (Link to these results)

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