A0A5K4F0Z1_SCHMA Loading...

Dentin sialophosphoprotein-like

AlphaFold DB , UniProt , Accession A0A5K4F0Z1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,027 aa.

						>A0A5K4F0Z1_SCHMA|A0A5K4F0Z1
MHNDPLTPVPSERLLGPGYGQGVWPLRERLALATALLDVDNQQGSWAATSRRMMCFSRPGRPSTWCSSKACAKQYALLLDSIELVKRQKMPGSDSQSSQLSLAERVVKRLSAERAEELRSRIRCGQRYYSSLKSIISDVESGMYDSQLTNLLNVMNSISDFKMQPEVLDGEFVQTAASPNNDLSHQQTFAENDASSELQSKQLNQCSNKLTTENNPVNNKQSLVEFWKEIQKFYHIPDSTWYCAPGPINNRNFTGGYGSVTSRSRPSGVGSLNFSRLSTLLAEASSPALKPATQFRNSTNKSSSYKSSSHEIGHTTAVSRAAEAAKQRYLSKTSKHKLSSATSQPSRINKSSKKDSKSKHWPKKISRNNKYDYVTTSSSTSKEDHVNQDITRKSQPSDCRLSHQKSYNSIYKKSESEKQEPSDSETEQEDEGSTCDESSTDKQIDTPSSTPSTVAMCMSDVEDFLIRDDEKSEKTIANDDNATNSTLDNDRPATTIPDEDGIDGYNSESEKLTLSSDAVSSLSTEAVGETDCQVEEKISISSSPPVFVSTTNVPGIVAEVELKLDNLNQKSPVGKEFAISNESLPTGSKLNETNNDSENETGVPIITDLHCSTVSPVNIKIPVENLTILESKNFMNVESKMAHEVINNSHVTESSNVGPSTSKLENGLDKKLGLSSNFASQRREASKPTSKKAPSYSILPFLIKTGSNKSSQIITSDEKCDMKVKTNEKLDLNVCENMMNECNTDQLNTPVMDSSTPIHSNNESVQLNNSSISSGFKNHSLRLRLSRQGSQLIVLPLSDSTDSSFQSLNTSPKEAAFDNECHDTSWYSWANQLLSNGERIVSAWMLNNESMLLSPRFKNHTSPSDLKELVHELLSPIISDLNNELIKSKLQFVHRLLSILAHTVMTRASNTIRNLVAMELYHQWSEQLQTNLSEPDFSSTPCCYNSKTPPSWSVEIEDNSLNTCRDPPTLTLASSSFNSSSSQKSSETAKSIPLILLEDRSMNTPTESGKRKRSHSSVEDNNDDLDI
					

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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	33.9	Very low	34.8	Very low	224 Å²	224	132.7 Å²	132.7	100%	1.103	75%	0.746	S	S	*	*				0	92.9	0	-59.3	-48.3	-175.5	0	0	108
2	H	33.5	Very low	35.8	Very low	176 Å²	176	131.9 Å²	131.9	82%	0.815	73%	0.732	S	S	*	*			trans	-93.4	129.3	167.1	-77.7	101.7	0	0	0	107.2
3	N	36.7	Very low	36.5	Very low	151 Å²	151	132.2 Å²	132.2	81%	0.807	72%	0.715	S	S	*	*			trans	-104.8	86.8	179.2	-70	-18.7	0	0	0	108.2
4	D	39.4	Very low	37.6	Very low	131 Å²	131	128.1 Å²	128.1	70%	0.701	69%	0.692	S	S	*	*			trans	-71.4	131	176.4	-63	-42.2	0	0	0	110.4	L6	D4-L6 PolarHBondContact O-N 3.05Å
5	P	35.3	Very low	38.8	Very low	122 Å²	122	121.6 Å²	121.6	79%	0.792	66%	0.656	S	S	*	*			trans	-77.8	93.1	-173.1	29.9	-34.9	0	0	0	112.4	T7	P5-T7 PolarHBondContact O-N 3.16Å
6	L	31.2	Very low	39.4	Very low	164 Å²	164	115.5 Å²	115.5	86%	0.859	63%	0.631	S	S	*	*			trans	-73.9	71.9	179.1	-75.3	174	0	0	0	114.5	D4	D4-L6 PolarHBondContact O-N 3.05Å
7	T	33.5	Very low	40.1	Very low	121 Å²	121	114.5 Å²	114.5	74%	0.742	63%	0.631	S	S	*	*			trans	-144.7	86.7	161.2	49	0	0	0	0	112.8	P5 V9	P5-T7 PolarHBondContact O-N 3.16Å; T7-V9 PolarHBondContact O-N 2.78Å
8	P	36.3	Very low	40.6	Very low	118 Å²	118	109.2 Å²	109.2	77%	0.766	61%	0.607	S	S	*	*			trans	-70.6	120.9	162.6	29.5	-32	0	0	0	109.7
9	V	31.3	Very low	41.3	Very low	128 Å²	128	108.1 Å²	108.1	78%	0.776	59%	0.593	S	S	*	*			trans	-61.8	126.8	179	178	0	0	0	0	109.7	T7 S11	T7-V9 PolarHBondContact O-N 2.78Å; V9-S11 PolarHBondContact O-N 3.08Å
10	P	34.4	Very low	42.2	Very low	62 Å²	62	104.3 Å²	104.3	40%	0.403	58%	0.579	S	S	.	*			trans	-72.2	115.4	-178.6	-16	29.9	0	0	0	112	E12 L77	P10-E12 PolarHBondContact O-N 2.83Å; P10-L77 HydrophobicContact CB-CD2 3.22Å; P10-L77 HydrophobicContact CG-CD2 3.8Å
11	S	37.3	Very low	42.9	Very low	63 Å²	63	109.5 Å²	109.5	44%	0.441	60%	0.599	S	S	.	*			trans	-59.4	129.1	-178.4	-178.9	0	0	0	0	112.8	V9 R13 L14	V9-S11 PolarHBondContact O-N 3.08Å; S11-R13 PolarHBondContact O-N 3.34Å; S11-R13 WeakPolarHBondContact OG-CG 3.45Å; S11-R13 PolarHBondContact OG-N 3.06Å; S11-L14 PolarHBondContact O-N 2.97Å; S11-L14 VanDerWaalsContact O-N 3.17Å
12	E	47.1	Very low	44.5	Very low	123 Å²	123	100.7 Å²	100.7	58%	0.575	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-57.8	-19.3	176.2	-63.7	-164.1	130.1	0	0	113.1	P10 L14 L15 G16	P10-E12 PolarHBondContact O-N 2.83Å; E12-L14 PolarHBondContact O-N 3.06Å; E12-L14 VanDerWaalsContact O-N 3.14Å; E12-L15 CarbonylContact O-C 3.57Å; E12-L15 WeakPolarHBondContact O-CA 3.31Å; E12-L15 PolarHBondContact O-N 3.19Å; E12-G16 PolarHBondContact O-N 3.31Å
13	R	45.1	Very low	46.4	Very low	135 Å²	135	93.4 Å²	93.4	51%	0.509	53%	0.534	S	S	.	.	G	3₁₀ helix	trans	-52.5	-33.6	174.6	-65.3	179.1	-179.1	173.7	-2.8	112.4	S11 L15 G16 E191 D193	S11-R13 PolarHBondContact O-N 3.34Å; S11-R13 WeakPolarHBondContact OG-CG 3.45Å; S11-R13 PolarHBondContact OG-N 3.06Å; R13-L15 PolarHBondContact O-N 3.02Å; R13-G16 PolarHBondContact O-N 3.06Å; R13-E191 IonicContact NH1-OE1 3.75Å; R13-D193 IonicContact CZ-OD1 3.53Å; R13-D193 VanDerWaalsContact CZ-OD1 3.27Å; R13-D193 IonicContact CZ-OD2 3.56Å; R13-D193 IonicContact NE-OD1 3.76Å; R13-D193 IonicContact NH1-OD1 2.76Å; R13-D193 PolarHBondContact NH1-OD1 2.95Å; R13-D193 IonicContact NH1-OD2 3.77Å; R13-D193 PolarHBondContact NH1-OD2 3.13Å; R13-D193 IonicContact NH2-OD1 2.75Å; R13-D193 IonicContact NH2-OD2 3.48Å; R13-D193 PolarHBondContact NH2-OD2 3.17Å
14	L	51.2	Low	48.6	Very low	76 Å²	76	86.8 Å²	86.8	40%	0.398	50%	0.498	S	S	.	.	G	3₁₀ helix	trans	-70.6	-14.2	176.5	-63.6	-179.1	0	0	0	114.3	S11 E12 L77	S11-L14 PolarHBondContact O-N 2.97Å; S11-L14 VanDerWaalsContact O-N 3.17Å; E12-L14 PolarHBondContact O-N 3.06Å; E12-L14 VanDerWaalsContact O-N 3.14Å; L14-L77 HydrophobicContact CD1-CD1 4.33Å
15	L	55.9	Low	50.7	Low	30 Å²	30	80.8 Å²	80.8	16%	0.157	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-107.7	2.6	176.1	-59.8	177.3	0	0	0	112.6	E12 R13 R29 Q74 L77 L78 S81	E12-L15 CarbonylContact O-C 3.57Å; E12-L15 WeakPolarHBondContact O-CA 3.31Å; E12-L15 PolarHBondContact O-N 3.19Å; R13-L15 PolarHBondContact O-N 3.02Å; L15-R29 PolarHBondContact O-NH1 3.36Å; L15-R29 PolarHBondContact O-NH2 3.1Å; L15-Q74 VanDerWaalsContact CD2-NE2 3.32Å; L15-L77 HydrophobicContact CD1-CB 4.44Å; L15-L77 WeakPolarHBondContact CD1-O 3.4Å; L15-L77 HydrophobicContact CD2-CB 4.27Å; L15-L78 HydrophobicContact CD2-CD2 4.03Å; L15-S81 VanDerWaalsContact CD1-CB 3.44Å
16	G	47.8	Very low	53	Low	24 Å²	24	76.1 Å²	76.1	25%	0.247	43%	0.434	C	S	.	.	S	Bend	trans	-58.8	152.5	175.9	0	0	0	0	0	113.2	E12 R13 G18 R29	E12-G16 PolarHBondContact O-N 3.31Å; R13-G16 PolarHBondContact O-N 3.06Å; G16-G18 PolarHBondContact O-N 2.72Å; G16-R29 PolarHBondContact O-NH2 3.39Å
17	P	51.6	Low	55.6	Low	99 Å²	99	69.9 Å²	69.9	64%	0.643	40%	0.399	S	S	*	.	S	Bend	trans	-70.9	115.7	170.4	29.4	-32.4	0	0	0	109.7
18	G	50	Low	58.2	Low	18 Å²	18	64.1 Å²	64.1	19%	0.186	36%	0.364	C	S	.	.	S	Bend	trans	179.8	172.5	179.8	0	0	0	0	0	113.6	G16	G16-G18 PolarHBondContact O-N 2.72Å
19	Y	54.2	Low	60.8	Low	89 Å²	89	59 Å²	59	35%	0.349	33%	0.33	S	S	.	.			trans	-121.9	44.4	-178.7	-77.3	-79.5	0	0	0	112.1	P25 R121 Q199 P237	Y19-P25 HydrophobicContact CD1-CB 4.24Å; Y19-P25 HydrophobicContact CE1-CB 3.9Å; Y19-R121 PolarHBondContact OH-NH2 3.25Å; Y19-Q199 VanDerWaalsContact N-OE1 3.12Å; Y19-P237 HydrophobicContact CD1-CB 4.16Å; Y19-P237 HydrophobicContact CD1-CG 4.47Å; Y19-P237 HydrophobicContact CD2-CG 4.32Å; Y19-P237 HydrophobicContact CE1-CB 3.87Å; Y19-P237 HydrophobicContact CE1-CG 4.21Å; Y19-P237 HydrophobicContact CE2-CG 4.05Å
20	G	57.6	Low	63.5	Low	31 Å²	31	54.1 Å²	54.1	32%	0.32	30%	0.299	S	S	.	.			trans	-77.9	155.4	178.9	0	0	0	0	0	114.2	G22 V23	G20-G22 PolarHBondContact O-N 3.02Å; G20-V23 PolarHBondContact O-N 3.39Å; G20-V23 VanDerWaalsContact O-N 3.1Å
21	Q	57.7	Low	66.1	Low	214 Å²	214	51.8 Å²	51.8	100%	1	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	66.9	174.6	-168.1	173.2	5.8	0	0	111.1
22	G	66.6	Low	68.6	Low	40 Å²	40	48.8 Å²	48.8	41%	0.412	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	154.8	-20.6	-171	0	0	0	0	0	113.4	G20	G20-G22 PolarHBondContact O-N 3.02Å
23	V	75.3	Confident	70.6	Confident	22 Å²	22	43 Å²	43	13%	0.133	24%	0.237	C	C	.	.			trans	-88.6	133.4	178.7	-177.5	0	0	0	0	110.4	G20 P25	G20-V23 PolarHBondContact O-N 3.39Å; G20-V23 VanDerWaalsContact O-N 3.1Å; V23-P25 WeakPolarHBondContact O-CD 3.44Å
24	W	80.9	Confident	72.6	Confident	13 Å²	13	38.4 Å²	38.4	5%	0.049	22%	0.224	C	C	.	.			trans	-79.8	115.6	170.5	-77.6	59.6	0	0	0	109.7	E28 R29 L32 M53 W65 A70 Q74	W24-E28 HydrophobicContact CE3-CB 3.95Å; W24-R29 HydrophobicContact CB-CG 3.79Å; W24-R29 PolarHBondContact O-NE 2.88Å; W24-R29 PolarHBondContact O-NH2 3.34Å; W24-L32 HydrophobicContact CH2-CD2 4.48Å; W24-L32 HydrophobicContact CZ3-CB 4.43Å; W24-L32 HydrophobicContact CZ3-CD2 4Å; W24-M53 HydrophobicContact CZ3-CE 4.05Å; W24-W65 AromaticContact CD1-CH2 3.77Å; W24-W65 AromaticContact CD1-CZ2 3.46Å; W24-W65 VanDerWaalsContact CD1-CZ2 3.46Å; W24-W65 HydrophobicContact CD2-CZ2 4.2Å; W24-W65 AromaticContact CE2-CE2 3.94Å; W24-W65 AromaticContact CE2-NE1 3.97Å; W24-W65 AromaticContact CG-CZ2 3.86Å; W24-W65 HydrophobicContact CG-CZ2 3.86Å; W24-W65 WeakPolarHBondContact CZ2-O 3.42Å; W24-W65 AromaticContact NE1-CE2 3.78Å; W24-W65 AromaticContact NE1-CH2 3.93Å; W24-W65 AromaticContact NE1-CZ2 3.55Å; W24-A70 HydrophobicContact CZ2-CB 4.47Å; W24-Q74 HydrophobicContact CB-CG 4.39Å; W24-Q74 VanDerWaalsContact CD1-OE1 3.29Å; W24-Q74 HydrophobicContact CD2-CB 4.23Å; W24-Q74 HydrophobicContact CD2-CG 3.57Å; W24-Q74 HydrophobicContact CE3-CB 4.48Å; W24-Q74 HydrophobicContact CE3-CG 3.79Å; W24-Q74 HydrophobicContact CG-CG 3.84Å; W24-Q74 HydrophobicContact CH2-CB 4.4Å; W24-Q74 HydrophobicContact CZ2-CB 4.14Å; W24-Q74 HydrophobicContact CZ2-CG 4.39Å; W24-Q74 HydrophobicContact CZ3-CG 4.27Å
25	P	83.5	Confident	74.2	Confident	5 Å²	5	35.3 Å²	35.3	3%	0.032	21%	0.209	C	C	.	.			trans	-67.3	155	179.2	29.2	-35.5	0	0	0	110.3	Y19 V23 R27 E28 R29	Y19-P25 HydrophobicContact CD1-CB 4.24Å; Y19-P25 HydrophobicContact CE1-CB 3.9Å; V23-P25 WeakPolarHBondContact O-CD 3.44Å; P25-R27 PolarHBondContact O-N 2.77Å; P25-R27 VanDerWaalsContact O-N 3.08Å; P25-E28 HydrophobicContact CG-CB 4.05Å; P25-E28 HydrophobicContact CG-CG 3.79Å; P25-E28 WeakPolarHBondContact CG-OE1 3.35Å; P25-E28 PolarHBondContact O-N 3.15Å; P25-R29 PolarHBondContact O-N 2.99Å
26	L	85.5	Confident	75.4	Confident	24 Å²	24	34.8 Å²	34.8	13%	0.126	21%	0.207	C	C	.	.	H	α-helix	trans	-56.9	-31.9	-172.3	-175.7	54.3	0	0	0	113.5	L30 L110 E113 R114 E117	L26-L30 VanDerWaalsContact O-CB 3.3Å; L26-L30 WeakPolarHBondContact O-CB 3.39Å; L26-L30 PolarHBondContact O-N 2.83Å; L26-L110 HydrophobicContact CD1-CB 4.28Å; L26-L110 HydrophobicContact CD1-CD2 3.69Å; L26-E113 HydrophobicContact CD1-CB 4.33Å; L26-E113 HydrophobicContact CD2-CB 3.76Å; L26-R114 HydrophobicContact CD2-CB 4.08Å; L26-R114 HydrophobicContact CG-CB 4.19Å; L26-E117 HydrophobicContact CD2-CB 4.46Å
27	R	85	Confident	76.8	Confident	32 Å²	32	33.9 Å²	33.9	12%	0.121	20%	0.196	C	C	.	.	H	α-helix	trans	-61.1	-46.5	171.8	-173.9	-175.5	-174.1	-114.8	0.9	112.8	P25 A31 F56 S239 Y242	P25-R27 PolarHBondContact O-N 2.77Å; P25-R27 VanDerWaalsContact O-N 3.08Å; R27-A31 WeakPolarHBondContact O-CB 3.38Å; R27-A31 PolarHBondContact O-N 3.36Å; R27-F56 PolarHBondContact NH1-O 2.98Å; R27-S239 WeakPolarHBondContact CD-O 3.2Å; R27-S239 PolarHBondContact NH1-O 2.95Å; R27-Y242 PolarHBondContact NH1-O 3.36Å; R27-Y242 VanDerWaalsContact NH1-O 3.17Å; R27-Y242 PolarHBondContact NH2-O 3.09Å
28	E	88.5	Confident	77.5	Confident	1 Å²	1	33 Å²	33	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-70.3	-37.9	-179.8	-71	174.9	-137.6	0	0	110.8	W24 P25 A31 L32 M53 R61 W65	W24-E28 HydrophobicContact CE3-CB 3.95Å; P25-E28 HydrophobicContact CG-CB 4.05Å; P25-E28 HydrophobicContact CG-CG 3.79Å; P25-E28 WeakPolarHBondContact CG-OE1 3.35Å; P25-E28 PolarHBondContact O-N 3.15Å; E28-A31 PolarHBondContact O-N 3.09Å; E28-L32 WeakPolarHBondContact O-CB 3.4Å; E28-L32 PolarHBondContact O-N 3.09Å; E28-M53 HydrophobicContact CB-CE 4.12Å; E28-M53 HydrophobicContact CG-CE 4.46Å; E28-M53 WeakPolarHBondContact O-CE 3.49Å; E28-R61 IonicContact OE1-CZ 3.96Å; E28-R61 IonicContact OE1-NE 3.98Å; E28-R61 PolarHBondContact OE1-NE 2.93Å; E28-R61 IonicContact OE1-NH2 2.71Å; E28-R61 PolarHBondContact OE1-NH2 2.99Å; E28-R61 IonicContact OE2-CZ 3.19Å; E28-R61 IonicContact OE2-NE 3.51Å; E28-R61 PolarHBondContact OE2-NE 3.13Å; E28-R61 IonicContact OE2-NH2 3.7Å; E28-W65 PolarHBondContact OE2-NE1 3.02Å
29	R	89.2	Confident	78	Confident	11 Å²	11	33.9 Å²	33.9	4%	0.042	19%	0.187	C	C	.	.	H	α-helix	trans	-63.2	-45.7	173.2	-73.4	-173.5	-93.4	163.4	-21.7	113	L15 G16 W24 P25 L32 A33 L78 L110	L15-R29 PolarHBondContact O-NH1 3.36Å; L15-R29 PolarHBondContact O-NH2 3.1Å; G16-R29 PolarHBondContact O-NH2 3.39Å; W24-R29 HydrophobicContact CB-CG 3.79Å; W24-R29 PolarHBondContact O-NE 2.88Å; W24-R29 PolarHBondContact O-NH2 3.34Å; P25-R29 PolarHBondContact O-N 2.99Å; R29-L32 PolarHBondContact O-N 2.86Å; R29-A33 PolarHBondContact O-N 3.26Å; R29-L78 HydrophobicContact CB-CD1 4.31Å; R29-L78 HydrophobicContact CB-CD2 4.46Å; R29-L78 HydrophobicContact CG-CD2 4.45Å; R29-L110 HydrophobicContact CB-CD1 4.09Å
30	L	89.6	Confident	78.1	Confident	25 Å²	25	34.4 Å²	34.4	13%	0.131	20%	0.196	C	C	.	.	H	α-helix	trans	-65.6	-39.6	177.4	178.5	59.4	0	0	0	111.4	L26 T34 V107 L110 S111 R114	L26-L30 VanDerWaalsContact O-CB 3.3Å; L26-L30 WeakPolarHBondContact O-CB 3.39Å; L26-L30 PolarHBondContact O-N 2.83Å; L30-T34 VanDerWaalsContact O-CB 3.32Å; L30-T34 WeakPolarHBondContact O-CB 3.36Å; L30-T34 PolarHBondContact O-N 2.83Å; L30-T34 PolarHBondContact O-OG1 2.9Å; L30-V107 HydrophobicContact CD1-CG1 4.15Å; L30-L110 HydrophobicContact CB-CB 4.25Å; L30-L110 HydrophobicContact CD1-CB 3.86Å; L30-S111 WeakPolarHBondContact CD1-OG 3.29Å; L30-R114 HydrophobicContact CD2-CB 4.01Å; L30-R114 HydrophobicContact CD2-CG 4.05Å
31	A	88	Confident	77.7	Confident	13 Å²	13	39.1 Å²	39.1	11%	0.107	21%	0.214	C	C	.	.	H	α-helix	trans	-61.9	-45	174.6	0	0	0	0	0	111.9	R27 E28 T34 A35 M53 F56	R27-A31 WeakPolarHBondContact O-CB 3.38Å; R27-A31 PolarHBondContact O-N 3.36Å; E28-A31 PolarHBondContact O-N 3.09Å; A31-T34 PolarHBondContact O-N 3.41Å; A31-A35 WeakPolarHBondContact O-CB 3.36Å; A31-A35 PolarHBondContact O-N 3.09Å; A31-M53 HydrophobicContact CB-CE 4.1Å; A31-M53 HydrophobicContact CB-SD 3.83Å; A31-F56 HydrophobicContact CB-CB 4.44Å; A31-F56 HydrophobicContact CB-CD1 3.97Å; A31-F56 HydrophobicContact CB-CD2 4.06Å; A31-F56 HydrophobicContact CB-CE1 4.22Å; A31-F56 HydrophobicContact CB-CE2 4.31Å; A31-F56 HydrophobicContact CB-CG 3.89Å; A31-F56 HydrophobicContact CB-CZ 4.38Å
32	L	90	Very high	77.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-59.2	-49.2	176.9	176.1	63.1	0	0	0	112	W24 E28 R29 A35 L36 T49 M53 C71 Q74 L78	W24-L32 HydrophobicContact CH2-CD2 4.48Å; W24-L32 HydrophobicContact CZ3-CB 4.43Å; W24-L32 HydrophobicContact CZ3-CD2 4Å; E28-L32 WeakPolarHBondContact O-CB 3.4Å; E28-L32 PolarHBondContact O-N 3.09Å; R29-L32 PolarHBondContact O-N 2.86Å; L32-A35 PolarHBondContact O-N 3.24Å; L32-L36 HydrophobicContact CD1-CD1 4.33Å; L32-L36 WeakPolarHBondContact O-CG 3.5Å; L32-L36 PolarHBondContact O-N 3.11Å; L32-T49 HydrophobicContact CD1-CG2 3.76Å; L32-M53 HydrophobicContact CB-SD 3.96Å; L32-M53 HydrophobicContact CD1-CG 4.36Å; L32-M53 PolarHBondContact N-SD 3.43Å; L32-M53 VanDerWaalsContact N-SD 3.4Å; L32-C71 HydrophobicContact CD1-CB 3.87Å; L32-Q74 HydrophobicContact CD2-CB 3.76Å; L32-Q74 HydrophobicContact CD2-CG 3.75Å; L32-L78 HydrophobicContact CD2-CD1 4.49Å
33	A	88.7	Confident	76.9	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-67.4	-39.3	180	0	0	0	0	0	112.5	R29 L36 L37 Y75 V106 V107 L110	R29-A33 PolarHBondContact O-N 3.26Å; A33-L36 PolarHBondContact O-N 3.45Å; A33-L37 PolarHBondContact O-N 3.42Å; A33-Y75 HydrophobicContact CB-CE2 4.35Å; A33-V106 HydrophobicContact CB-CB 4.32Å; A33-V106 HydrophobicContact CB-CG1 3.52Å; A33-V107 VanDerWaalsContact C-CG2 3.49Å; A33-V107 HydrophobicContact CB-CG2 3.59Å; A33-L110 HydrophobicContact CB-CD1 4.06Å
34	T	87.2	Confident	76.1	Confident	39 Å²	39	45 Å²	45	24%	0.239	24%	0.239	C	C	.	.	H	α-helix	trans	-66.5	-41.1	176.6	-52.1	0	0	0	0	111.3	L30 A31 L36 L37 D38 L277	L30-T34 VanDerWaalsContact O-CB 3.32Å; L30-T34 WeakPolarHBondContact O-CB 3.36Å; L30-T34 PolarHBondContact O-N 2.83Å; L30-T34 PolarHBondContact O-OG1 2.9Å; A31-T34 PolarHBondContact O-N 3.41Å; T34-L36 PolarHBondContact O-N 3.19Å; T34-L36 VanDerWaalsContact O-N 3.12Å; T34-L37 PolarHBondContact O-N 2.71Å; T34-D38 PolarHBondContact O-N 2.97Å; T34-L277 HydrophobicContact CG2-CD1 4.38Å; T34-L277 HydrophobicContact CG2-CD2 4.37Å
35	A	85.1	Confident	75.7	Confident	11 Å²	11	47.5 Å²	47.5	9%	0.091	26%	0.259	C	S	.	.	H	α-helix	trans	-63.5	-17.3	178.7	0	0	0	0	0	113.8	A31 L32 V39 T49 R52	A31-A35 WeakPolarHBondContact O-CB 3.36Å; A31-A35 PolarHBondContact O-N 3.09Å; L32-A35 PolarHBondContact O-N 3.24Å; A35-V39 VanDerWaalsContact O-CG2 3.27Å; A35-V39 WeakPolarHBondContact O-CG2 3.42Å; A35-T49 HydrophobicContact CB-CG2 4.21Å; A35-R52 PolarHBondContact O-NH1 3.23Å
36	L	81.5	Confident	75.7	Confident	20 Å²	20	51.5 Å²	51.5	11%	0.105	27%	0.273	C	S	.	.	H	α-helix	trans	-94.5	-27.3	176.1	-69.4	165	0	0	0	113.4	L32 A33 T34 D38 V39 W46 T49 Y75	L32-L36 HydrophobicContact CD1-CD1 4.33Å; L32-L36 WeakPolarHBondContact O-CG 3.5Å; L32-L36 PolarHBondContact O-N 3.11Å; A33-L36 PolarHBondContact O-N 3.45Å; T34-L36 PolarHBondContact O-N 3.19Å; T34-L36 VanDerWaalsContact O-N 3.12Å; L36-D38 VanDerWaalsContact C-N 3.28Å; L36-D38 PolarHBondContact O-N 2.98Å; L36-V39 CarbonylContact O-C 3.57Å; L36-V39 VanDerWaalsContact O-CA 3.3Å; L36-V39 WeakPolarHBondContact O-CA 3.33Å; L36-V39 WeakPolarHBondContact O-CB 3.48Å; L36-V39 PolarHBondContact O-N 3.27Å; L36-W46 HydrophobicContact CD1-CH2 3.91Å; L36-W46 HydrophobicContact CD1-CZ3 3.83Å; L36-W46 HydrophobicContact CD2-CH2 4.27Å; L36-W46 HydrophobicContact CD2-CZ3 4.07Å; L36-T49 HydrophobicContact CD2-CG2 4.19Å; L36-T49 HydrophobicContact CG-CG2 4.22Å; L36-Y75 HydrophobicContact CB-CE2 4.5Å; L36-Y75 HydrophobicContact CD1-CD1 3.73Å; L36-Y75 HydrophobicContact CD1-CD2 3.37Å; L36-Y75 HydrophobicContact CD1-CE1 3.89Å; L36-Y75 HydrophobicContact CD1-CE2 3.57Å; L36-Y75 HydrophobicContact CD1-CG 3.44Å; L36-Y75 VanDerWaalsContact CD1-CG 3.44Å
37	L	76.7	Confident	75.6	Confident	4 Å²	4	52 Å²	52	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-68.8	-24.1	171.2	-78.3	-176.6	0	0	0	113.6	A33 T34 V39 A103 E104 V107 N273 L277	A33-L37 PolarHBondContact O-N 3.42Å; T34-L37 PolarHBondContact O-N 2.71Å; L37-V39 PolarHBondContact O-N 3.03Å; L37-A103 HydrophobicContact CD2-CB 3.5Å; L37-A103 HydrophobicContact CG-CB 4.33Å; L37-E104 HydrophobicContact CD1-CG 4.3Å; L37-E104 HydrophobicContact CD2-CG 3.84Å; L37-V107 HydrophobicContact CD1-CB 3.69Å; L37-V107 HydrophobicContact CD1-CG1 4.17Å; L37-V107 HydrophobicContact CD1-CG2 3.49Å; L37-V107 VanDerWaalsContact CD1-CG2 3.49Å; L37-V107 HydrophobicContact CG-CG2 4.09Å; L37-N273 PolarHBondContact O-ND2 3.25Å; L37-L277 HydrophobicContact CB-CD2 3.96Å; L37-L277 HydrophobicContact CD1-CD2 3.57Å; L37-L277 HydrophobicContact CG-CD2 4.44Å
38	D	66.7	Low	75.4	Confident	81 Å²	81	52 Å²	52	43%	0.433	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-3.3	166.5	-78.2	-23.9	0	0	0	112.8	T34 L36 R52 L277	T34-D38 PolarHBondContact O-N 2.97Å; L36-D38 VanDerWaalsContact C-N 3.28Å; L36-D38 PolarHBondContact O-N 2.98Å; D38-R52 IonicContact OD2-NH1 3.72Å; D38-L277 WeakPolarHBondContact OD1-CD1 3.4Å
39	V	60.3	Low	75.2	Confident	36 Å²	36	52 Å²	52	22%	0.218	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.5	21	-167.4	177.4	0	0	0	0	111.4	A35 L36 L37 N41	A35-V39 VanDerWaalsContact O-CG2 3.27Å; A35-V39 WeakPolarHBondContact O-CG2 3.42Å; L36-V39 CarbonylContact O-C 3.57Å; L36-V39 VanDerWaalsContact O-CA 3.3Å; L36-V39 WeakPolarHBondContact O-CA 3.33Å; L36-V39 WeakPolarHBondContact O-CB 3.48Å; L36-V39 PolarHBondContact O-N 3.27Å; L37-V39 PolarHBondContact O-N 3.03Å; V39-N41 PolarHBondContact O-N 2.72Å
40	D	56.4	Low	75.1	Confident	100 Å²	100	52 Å²	52	54%	0.535	29%	0.289	S	S	.	.			trans	-60.7	10	173.4	-73.4	-13.8	0	0	0	115
41	N	50	Low	74.7	Confident	131 Å²	131	58.3 Å²	58.3	70%	0.701	31%	0.311	S	S	*	.	S	Bend	trans	-112.7	129.1	170.3	-163.2	1.6	0	0	0	110.2	V39 Q43	V39-N41 PolarHBondContact O-N 2.72Å; N41-Q43 VanDerWaalsContact C-N 3.31Å; N41-Q43 PolarHBondContact O-N 2.78Å
42	Q	53.3	Low	74.4	Confident	176 Å²	176	63 Å²	63	82%	0.822	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	54.2	-151.3	-62	-176.1	-24.2	0	0	117
43	Q	52.7	Low	74.2	Confident	188 Å²	188	63.1 Å²	63.1	88%	0.879	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-164.3	9.1	167.9	-117.8	144.1	100.7	0	0	117.5	N41 S45	N41-Q43 VanDerWaalsContact C-N 3.31Å; N41-Q43 PolarHBondContact O-N 2.78Å; Q43-S45 PolarHBondContact O-N 2.75Å
44	G	59	Low	73.8	Confident	36 Å²	36	68.2 Å²	68.2	37%	0.371	35%	0.352	S	S	.	.			trans	-66.8	99.8	176.5	0	0	0	0	0	111.5
45	S	72.5	Confident	73.1	Confident	65 Å²	65	69.7 Å²	69.7	46%	0.455	36%	0.363	S	S	.	.			trans	-64.7	150.4	-169.1	69.4	0	0	0	0	112.9	Q43 A47 A48 T49	Q43-S45 PolarHBondContact O-N 2.75Å; S45-A47 PolarHBondContact O-N 2.82Å; S45-A48 WeakPolarHBondContact O-CA 3.49Å; S45-A48 WeakPolarHBondContact O-CB 3.28Å; S45-A48 PolarHBondContact O-N 3.14Å; S45-T49 PolarHBondContact O-N 3.22Å
46	W	83.9	Confident	72.6	Confident	88 Å²	88	72.6 Å²	72.6	33%	0.333	37%	0.374	S	S	.	.	H	α-helix	trans	-53.1	-24	173.2	-70.2	112.5	0	0	0	113.6	L36 S50 S68 C71 A72 Y75	L36-W46 HydrophobicContact CD1-CH2 3.91Å; L36-W46 HydrophobicContact CD1-CZ3 3.83Å; L36-W46 HydrophobicContact CD2-CH2 4.27Å; L36-W46 HydrophobicContact CD2-CZ3 4.07Å; W46-S50 WeakPolarHBondContact O-CB 3.32Å; W46-S50 PolarHBondContact O-N 2.84Å; W46-S68 WeakPolarHBondContact CB-OG 3.42Å; W46-C71 HydrophobicContact CE3-CB 3.99Å; W46-C71 HydrophobicContact CZ3-CB 4.32Å; W46-A72 HydrophobicContact CD2-CB 3.7Å; W46-A72 HydrophobicContact CE3-CB 4.02Å; W46-A72 HydrophobicContact CG-CB 4.14Å; W46-A72 HydrophobicContact CH2-CB 4.31Å; W46-A72 HydrophobicContact CZ2-CB 3.98Å; W46-A72 HydrophobicContact CZ3-CB 4.31Å; W46-Y75 AromaticContact CH2-CD1 3.84Å; W46-Y75 HydrophobicContact CH2-CD1 3.84Å; W46-Y75 HydrophobicContact CH2-CG 4.08Å
47	A	82.7	Confident	72.3	Confident	36 Å²	36	72.5 Å²	72.5	30%	0.298	38%	0.375	S	S	.	.	H	α-helix	trans	-71.1	-28.9	171.9	0	0	0	0	0	113.9	S45 R51	S45-A47 PolarHBondContact O-N 2.82Å; A47-R51 WeakPolarHBondContact O-CG 3.4Å; A47-R51 PolarHBondContact O-N 2.81Å; A47-R51 PolarHBondContact O-NH1 3.35Å
48	A	81.7	Confident	71.8	Confident	30 Å²	30	77.1 Å²	77.1	25%	0.248	39%	0.392	C	S	.	.	H	α-helix	trans	-73.9	-43.2	171.5	0	0	0	0	0	111.5	S45 R51 R52	S45-A48 WeakPolarHBondContact O-CA 3.49Å; S45-A48 WeakPolarHBondContact O-CB 3.28Å; S45-A48 PolarHBondContact O-N 3.14Å; A48-R51 PolarHBondContact O-N 3.49Å; A48-R52 PolarHBondContact O-N 2.9Å; A48-R52 VanDerWaalsContact O-N 3.1Å
49	T	84.6	Confident	71.8	Confident	1 Å²	1	77 Å²	77	1%	0.006	40%	0.396	C	S	.	.	H	α-helix	trans	-61.5	-44	173.4	-50.3	0	0	0	0	111.1	L32 A35 L36 S45 R51 R52 M53	L32-T49 HydrophobicContact CD1-CG2 3.76Å; A35-T49 HydrophobicContact CB-CG2 4.21Å; L36-T49 HydrophobicContact CD2-CG2 4.19Å; L36-T49 HydrophobicContact CG-CG2 4.22Å; S45-T49 PolarHBondContact O-N 3.22Å; T49-R51 PolarHBondContact O-N 2.84Å; T49-R52 WeakPolarHBondContact O-CB 3.4Å; T49-R52 PolarHBondContact O-N 3.29Å; T49-R52 VanDerWaalsContact O-N 3.14Å; T49-M53 WeakPolarHBondContact O-CG 3.36Å; T49-M53 PolarHBondContact O-N 3.42Å
50	S	86.2	Confident	72.3	Confident	12 Å²	12	79.5 Å²	79.5	8%	0.084	43%	0.429	C	S	.	.	H	α-helix	trans	-50.4	-52.4	171.4	167.1	0	0	0	0	112.7	W46 R52 M53 M54 C66	W46-S50 WeakPolarHBondContact O-CB 3.32Å; W46-S50 PolarHBondContact O-N 2.84Å; S50-R52 VanDerWaalsContact C-N 3.34Å; S50-R52 PolarHBondContact O-N 3.33Å; S50-M53 PolarHBondContact O-N 3.45Å; S50-M53 VanDerWaalsContact O-N 3.12Å; S50-M54 PolarHBondContact O-N 2.84Å; S50-M54 VanDerWaalsContact O-N 3.17Å; S50-C66 WeakPolarHBondContact CA-O 3.3Å; S50-C66 WeakPolarHBondContact CB-O 3.32Å; S50-C66 PolarHBondContact OG-O 3.07Å
51	R	82.7	Confident	73.1	Confident	157 Å²	157	77.6 Å²	77.6	59%	0.592	41%	0.414	S	S	*	.	H	α-helix	trans	-62.6	-36.5	177.2	-73.1	-173.2	-60.5	-90.3	5.2	113.2	A47 A48 T49	A47-R51 WeakPolarHBondContact O-CG 3.4Å; A47-R51 PolarHBondContact O-N 2.81Å; A47-R51 PolarHBondContact O-NH1 3.35Å; A48-R51 PolarHBondContact O-N 3.49Å; T49-R51 PolarHBondContact O-N 2.84Å
52	R	80.9	Confident	74.5	Confident	113 Å²	113	75.1 Å²	75.1	43%	0.426	41%	0.405	S	S	.	.	H	α-helix	trans	-65.2	-39.3	172.9	-69.4	177	175.9	-169.3	-5.5	111.7	A35 D38 A48 T49 S50 M54 F56	A35-R52 PolarHBondContact O-NH1 3.23Å; D38-R52 IonicContact OD2-NH1 3.72Å; A48-R52 PolarHBondContact O-N 2.9Å; A48-R52 VanDerWaalsContact O-N 3.1Å; T49-R52 WeakPolarHBondContact O-CB 3.4Å; T49-R52 PolarHBondContact O-N 3.29Å; T49-R52 VanDerWaalsContact O-N 3.14Å; S50-R52 VanDerWaalsContact C-N 3.34Å; S50-R52 PolarHBondContact O-N 3.33Å; R52-M54 PolarHBondContact O-N 3.48Å; R52-F56 VanDerWaalsContact O-CD2 3.31Å; R52-F56 WeakPolarHBondContact O-CD2 3.43Å
53	M	85.3	Confident	75.5	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.005	41%	0.406	C	S	.	.	H	α-helix	trans	-69.7	-27	-178.6	-77.4	-54.2	-49.9	0	0	114.5	W24 E28 A31 L32 T49 S50 C55 F56 S57	W24-M53 HydrophobicContact CZ3-CE 4.05Å; E28-M53 HydrophobicContact CB-CE 4.12Å; E28-M53 HydrophobicContact CG-CE 4.46Å; E28-M53 WeakPolarHBondContact O-CE 3.49Å; A31-M53 HydrophobicContact CB-CE 4.1Å; A31-M53 HydrophobicContact CB-SD 3.83Å; L32-M53 HydrophobicContact CB-SD 3.96Å; L32-M53 HydrophobicContact CD1-CG 4.36Å; L32-M53 PolarHBondContact N-SD 3.43Å; L32-M53 VanDerWaalsContact N-SD 3.4Å; T49-M53 WeakPolarHBondContact O-CG 3.36Å; T49-M53 PolarHBondContact O-N 3.42Å; S50-M53 PolarHBondContact O-N 3.45Å; S50-M53 VanDerWaalsContact O-N 3.12Å; M53-C55 PolarHBondContact O-N 3.29Å; M53-F56 HydrophobicContact CE-CB 4.22Å; M53-F56 PolarHBondContact O-N 2.88Å; M53-S57 PolarHBondContact O-OG 3.25Å
54	M	79.8	Confident	76.9	Confident	107 Å²	107	67.9 Å²	67.9	53%	0.527	39%	0.391	S	S	.	.	H	α-helix	trans	-54.9	-37.8	176.5	-71.2	170	175	0	0	112.2	S50 R52 F56 S57 C66	S50-M54 PolarHBondContact O-N 2.84Å; S50-M54 VanDerWaalsContact O-N 3.17Å; R52-M54 PolarHBondContact O-N 3.48Å; M54-F56 PolarHBondContact O-N 3.25Å; M54-F56 VanDerWaalsContact O-N 3.17Å; M54-S57 PolarHBondContact O-N 2.88Å; M54-C66 HydrophobicContact CE-CB 4.43Å; M54-C66 HydrophobicContact CG-CB 3.85Å
55	C	73.9	Confident	78.1	Confident	70 Å²	70	67.5 Å²	67.5	47%	0.473	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-9	178.5	-59.7	0	0	0	0	115.3	M53 A244	M53-C55 PolarHBondContact O-N 3.29Å; C55-A244 HydrophobicContact CB-CB 4.08Å
56	F	74.4	Confident	78.7	Confident	72 Å²	72	65.1 Å²	65.1	32%	0.316	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	-10.6	-178.6	-65.5	-86.5	0	0	0	113.8	R27 A31 R52 M53 M54	R27-F56 PolarHBondContact NH1-O 2.98Å; A31-F56 HydrophobicContact CB-CB 4.44Å; A31-F56 HydrophobicContact CB-CD1 3.97Å; A31-F56 HydrophobicContact CB-CD2 4.06Å; A31-F56 HydrophobicContact CB-CE1 4.22Å; A31-F56 HydrophobicContact CB-CE2 4.31Å; A31-F56 HydrophobicContact CB-CG 3.89Å; A31-F56 HydrophobicContact CB-CZ 4.38Å; R52-F56 VanDerWaalsContact O-CD2 3.31Å; R52-F56 WeakPolarHBondContact O-CD2 3.43Å; M53-F56 HydrophobicContact CE-CB 4.22Å; M53-F56 PolarHBondContact O-N 2.88Å; M54-F56 PolarHBondContact O-N 3.25Å; M54-F56 VanDerWaalsContact O-N 3.17Å
57	S	74.3	Confident	78.7	Confident	19 Å²	19	62.7 Å²	62.7	13%	0.133	36%	0.358	C	S	.	.	S	Bend	trans	-91	146.9	-170.9	-63	0	0	0	0	112.2	M53 M54 C66	M53-S57 PolarHBondContact O-OG 3.25Å; M54-S57 PolarHBondContact O-N 2.88Å; S57-C66 PolarHBondContact OG-SG 3.07Å
58	R	67.8	Low	79	Confident	100 Å²	100	63.5 Å²	63.5	38%	0.377	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-68.7	141.5	177.8	-161	-167.6	-174.7	-177.2	1.4	110.4	R61 D238	R58-R61 HydrophobicContact CB-CG 4.33Å; R58-D238 HydrophobicContact CG-CB 4.35Å; R58-D238 IonicContact CZ-OD1 3.73Å; R58-D238 IonicContact CZ-OD2 3.27Å; R58-D238 VanDerWaalsContact NE-CG 3.34Å; R58-D238 IonicContact NE-OD1 2.69Å; R58-D238 IonicContact NE-OD2 2.83Å; R58-D238 PolarHBondContact NE-OD2 3.46Å; R58-D238 IonicContact NH2-OD1 2.6Å; R58-D238 PolarHBondContact NH2-OD1 3.37Å; R58-D238 IonicContact NH2-OD2 3.97Å; R58-D238 PolarHBondContact NH2-OD2 2.8Å
59	P	64.9	Low	79.3	Confident	79 Å²	79	70.5 Å²	70.5	51%	0.513	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	150.8	159	25	-34.1	0	0	0	110.5	Y242	P59-Y242 HydrophobicContact CG-CE2 4.28Å
60	G	70.8	Confident	79.4	Confident	89 Å²	89	71.8 Å²	71.8	92%	0.918	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.4	4.7	-176	0	0	0	0	0	115.9
61	R	74.7	Confident	79.5	Confident	60 Å²	60	71.2 Å²	71.2	23%	0.226	39%	0.393	C	S	.	.	S	Bend	trans	-80.3	152.3	165.8	-69.5	-163.9	179	-74.1	9.8	111.4	E28 R58 W65	E28-R61 IonicContact OE1-CZ 3.96Å; E28-R61 IonicContact OE1-NE 3.98Å; E28-R61 PolarHBondContact OE1-NE 2.93Å; E28-R61 IonicContact OE1-NH2 2.71Å; E28-R61 PolarHBondContact OE1-NH2 2.99Å; E28-R61 IonicContact OE2-CZ 3.19Å; E28-R61 IonicContact OE2-NE 3.51Å; E28-R61 PolarHBondContact OE2-NE 3.13Å; E28-R61 IonicContact OE2-NH2 3.7Å; R58-R61 HydrophobicContact CB-CG 4.33Å; R61-W65 HydrophobicContact CB-CB 4.22Å; R61-W65 HydrophobicContact CB-CG 4.21Å; R61-W65 VanDerWaalsContact CD-NE1 3.33Å; R61-W65 VanDerWaalsContact CZ-CZ2 3.48Å; R61-W65 VanDerWaalsContact NH1-CZ2 3.27Å
62	P	78.1	Confident	79.8	Confident	79 Å²	79	65.1 Å²	65.1	51%	0.513	38%	0.376	S	S	.	.			trans	-56.1	145	174.7	-25.4	34.5	0	0	0	112.9	T64 W65	P62-T64 PolarHBondContact O-N 2.92Å; P62-T64 VanDerWaalsContact O-N 3.1Å; P62-W65 WeakPolarHBondContact O-CB 3.46Å; P62-W65 PolarHBondContact O-N 3.44Å
63	S	73.9	Confident	80.2	Confident	120 Å²	120	66.6 Å²	66.6	84%	0.839	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-27.8	178.1	57.3	0	0	0	0	113.6	W65	S63-W65 VanDerWaalsContact C-N 3.33Å
64	T	82.6	Confident	80.3	Confident	92 Å²	92	67.2 Å²	67.2	56%	0.564	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-11	176	52.9	0	0	0	0	114.4	P62 C66 S67 A70	P62-T64 PolarHBondContact O-N 2.92Å; P62-T64 VanDerWaalsContact O-N 3.1Å; T64-C66 PolarHBondContact O-N 3.26Å; T64-S67 WeakPolarHBondContact O-CB 3.07Å; T64-S67 PolarHBondContact O-N 3.17Å; T64-S67 PolarHBondContact O-OG 3.2Å; T64-A70 WeakPolarHBondContact O-CB 3.33Å
65	W	84.9	Confident	80.8	Confident	28 Å²	28	63.5 Å²	63.5	11%	0.106	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-49	-175	-171.9	-92.1	0	0	0	112.7	W24 E28 R61 P62 S63 S67 A70	W24-W65 AromaticContact CD1-CH2 3.77Å; W24-W65 AromaticContact CD1-CZ2 3.46Å; W24-W65 VanDerWaalsContact CD1-CZ2 3.46Å; W24-W65 HydrophobicContact CD2-CZ2 4.2Å; W24-W65 AromaticContact CE2-CE2 3.94Å; W24-W65 AromaticContact CE2-NE1 3.97Å; W24-W65 AromaticContact CG-CZ2 3.86Å; W24-W65 HydrophobicContact CG-CZ2 3.86Å; W24-W65 WeakPolarHBondContact CZ2-O 3.42Å; W24-W65 AromaticContact NE1-CE2 3.78Å; W24-W65 AromaticContact NE1-CH2 3.93Å; W24-W65 AromaticContact NE1-CZ2 3.55Å; E28-W65 PolarHBondContact OE2-NE1 3.02Å; R61-W65 HydrophobicContact CB-CB 4.22Å; R61-W65 HydrophobicContact CB-CG 4.21Å; R61-W65 VanDerWaalsContact CD-NE1 3.33Å; R61-W65 VanDerWaalsContact CZ-CZ2 3.48Å; R61-W65 VanDerWaalsContact NH1-CZ2 3.27Å; P62-W65 WeakPolarHBondContact O-CB 3.46Å; P62-W65 PolarHBondContact O-N 3.44Å; S63-W65 VanDerWaalsContact C-N 3.33Å; W65-S67 PolarHBondContact O-N 3.12Å; W65-A70 VanDerWaalsContact O-CB 3.23Å; W65-A70 WeakPolarHBondContact O-CB 3.39Å
66	C	84.1	Confident	81.5	Confident	14 Å²	14	62.2 Å²	62.2	10%	0.095	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	9.6	176.9	-58.2	0	0	0	0	112.9	S50 M54 S57 T64	S50-C66 WeakPolarHBondContact CA-O 3.3Å; S50-C66 WeakPolarHBondContact CB-O 3.32Å; S50-C66 PolarHBondContact OG-O 3.07Å; M54-C66 HydrophobicContact CE-CB 4.43Å; M54-C66 HydrophobicContact CG-CB 3.85Å; S57-C66 PolarHBondContact OG-SG 3.07Å; T64-C66 PolarHBondContact O-N 3.26Å
67	S	85.3	Confident	82.1	Confident	38 Å²	38	59.4 Å²	59.4	27%	0.266	35%	0.352	S	S	.	.			trans	-65.8	152	-173.6	68.9	0	0	0	0	112.2	T64 W65 K69 A70 C71	T64-S67 WeakPolarHBondContact O-CB 3.07Å; T64-S67 PolarHBondContact O-N 3.17Å; T64-S67 PolarHBondContact O-OG 3.2Å; W65-S67 PolarHBondContact O-N 3.12Å; S67-K69 PolarHBondContact O-N 3.47Å; S67-K69 VanDerWaalsContact O-N 3.16Å; S67-A70 PolarHBondContact O-N 3.13Å; S67-A70 VanDerWaalsContact OG-CB 3.31Å; S67-A70 WeakPolarHBondContact OG-CB 3.47Å; S67-A70 PolarHBondContact OG-N 2.7Å; S67-C71 PolarHBondContact O-N 3.4Å; S67-C71 PolarHBondContact O-SG 3.3Å
68	S	87.9	Confident	82.8	Confident	53 Å²	53	58.7 Å²	58.7	37%	0.371	35%	0.346	S	S	.	.	H	α-helix	trans	-41.3	-49.1	171.2	173	0	0	0	0	112.8	W46 A72	W46-S68 WeakPolarHBondContact CB-OG 3.42Å; S68-A72 WeakPolarHBondContact O-CB 3.05Å; S68-A72 PolarHBondContact O-N 2.98Å; S68-A72 VanDerWaalsContact O-N 3.07Å
69	K	87.6	Confident	83.8	Confident	176 Å²	176	55.9 Å²	55.9	77%	0.765	34%	0.339	S	S	*	.	H	α-helix	trans	-70.9	-36.6	-179.4	-169.3	174.5	-177.3	177.8	0	113.1	S67 K73	S67-K69 PolarHBondContact O-N 3.47Å; S67-K69 VanDerWaalsContact O-N 3.16Å; K69-K73 PolarHBondContact O-N 3.44Å
70	A	87.5	Confident	84.8	Confident	28 Å²	28	55.4 Å²	55.4	23%	0.231	33%	0.332	C	S	.	.	H	α-helix	trans	-69.4	-44.5	176.8	0	0	0	0	0	111.9	W24 T64 W65 S67 A72 K73 Q74	W24-A70 HydrophobicContact CZ2-CB 4.47Å; T64-A70 WeakPolarHBondContact O-CB 3.33Å; W65-A70 VanDerWaalsContact O-CB 3.23Å; W65-A70 WeakPolarHBondContact O-CB 3.39Å; S67-A70 PolarHBondContact O-N 3.13Å; S67-A70 VanDerWaalsContact OG-CB 3.31Å; S67-A70 WeakPolarHBondContact OG-CB 3.47Å; S67-A70 PolarHBondContact OG-N 2.7Å; A70-A72 VanDerWaalsContact C-N 3.33Å; A70-A72 PolarHBondContact O-N 3.25Å; A70-K73 PolarHBondContact O-N 2.72Å; A70-Q74 WeakPolarHBondContact O-CB 3.34Å; A70-Q74 PolarHBondContact O-N 2.84Å
71	C	89.1	Confident	85.3	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-58.5	-43.4	172.9	-65.9	0	0	0	0	111.9	L32 W46 S67 Y75	L32-C71 HydrophobicContact CD1-CB 3.87Å; W46-C71 HydrophobicContact CE3-CB 3.99Å; W46-C71 HydrophobicContact CZ3-CB 4.32Å; S67-C71 PolarHBondContact O-N 3.4Å; S67-C71 PolarHBondContact O-SG 3.3Å; C71-Y75 WeakPolarHBondContact O-CB 3.06Å; C71-Y75 PolarHBondContact O-N 3.17Å
72	A	88.2	Confident	85.6	Confident	29 Å²	29	49 Å²	49	24%	0.24	28%	0.282	C	S	.	.	H	α-helix	trans	-61.9	-50	176.6	0	0	0	0	0	112.2	W46 S68 A70 Q74 Y75 A76	W46-A72 HydrophobicContact CD2-CB 3.7Å; W46-A72 HydrophobicContact CE3-CB 4.02Å; W46-A72 HydrophobicContact CG-CB 4.14Å; W46-A72 HydrophobicContact CH2-CB 4.31Å; W46-A72 HydrophobicContact CZ2-CB 3.98Å; W46-A72 HydrophobicContact CZ3-CB 4.31Å; S68-A72 WeakPolarHBondContact O-CB 3.05Å; S68-A72 PolarHBondContact O-N 2.98Å; S68-A72 VanDerWaalsContact O-N 3.07Å; A70-A72 VanDerWaalsContact C-N 3.33Å; A70-A72 PolarHBondContact O-N 3.25Å; A72-Q74 PolarHBondContact O-N 3.19Å; A72-Y75 PolarHBondContact O-N 3.44Å; A72-A76 PolarHBondContact O-N 2.9Å; A72-A76 VanDerWaalsContact O-N 3.14Å
73	K	88.3	Confident	85.5	Confident	145 Å²	145	49 Å²	49	63%	0.63	28%	0.275	S	S	*	.	H	α-helix	trans	-58.6	-48.5	177.3	-173.8	179.4	-179.8	-177.5	0	111.1	K69 A70 Y75 A76 L77	K69-K73 PolarHBondContact O-N 3.44Å; A70-K73 PolarHBondContact O-N 2.72Å; K73-Y75 VanDerWaalsContact C-N 3.29Å; K73-Y75 PolarHBondContact O-N 2.96Å; K73-A76 PolarHBondContact O-N 3.35Å; K73-L77 WeakPolarHBondContact O-CG 3.36Å; K73-L77 PolarHBondContact O-N 3.01Å
74	Q	89	Confident	85.2	Confident	13 Å²	13	46.7 Å²	46.7	6%	0.061	25%	0.253	C	S	.	.	H	α-helix	trans	-64.9	-32.7	-177.5	-173.4	62.4	40.6	0	0	112.9	L15 W24 L32 A70 A72 L78	L15-Q74 VanDerWaalsContact CD2-NE2 3.32Å; W24-Q74 HydrophobicContact CB-CG 4.39Å; W24-Q74 VanDerWaalsContact CD1-OE1 3.29Å; W24-Q74 HydrophobicContact CD2-CB 4.23Å; W24-Q74 HydrophobicContact CD2-CG 3.57Å; W24-Q74 HydrophobicContact CE3-CB 4.48Å; W24-Q74 HydrophobicContact CE3-CG 3.79Å; W24-Q74 HydrophobicContact CG-CG 3.84Å; W24-Q74 HydrophobicContact CH2-CB 4.4Å; W24-Q74 HydrophobicContact CZ2-CB 4.14Å; W24-Q74 HydrophobicContact CZ2-CG 4.39Å; W24-Q74 HydrophobicContact CZ3-CG 4.27Å; L32-Q74 HydrophobicContact CD2-CB 3.76Å; L32-Q74 HydrophobicContact CD2-CG 3.75Å; A70-Q74 WeakPolarHBondContact O-CB 3.34Å; A70-Q74 PolarHBondContact O-N 2.84Å; A72-Q74 PolarHBondContact O-N 3.19Å; Q74-L78 WeakPolarHBondContact O-CG 3.37Å; Q74-L78 PolarHBondContact O-N 3.15Å
75	Y	89.5	Confident	84.2	Confident	29 Å²	29	45.5 Å²	45.5	11%	0.114	25%	0.245	C	C	.	.	H	α-helix	trans	-72.3	-37.6	176.3	-171.1	-112.7	0	0	0	112.5	A33 L36 W46 C71 A72 K73 L77 L78 L79 A103	A33-Y75 HydrophobicContact CB-CE2 4.35Å; L36-Y75 HydrophobicContact CB-CE2 4.5Å; L36-Y75 HydrophobicContact CD1-CD1 3.73Å; L36-Y75 HydrophobicContact CD1-CD2 3.37Å; L36-Y75 HydrophobicContact CD1-CE1 3.89Å; L36-Y75 HydrophobicContact CD1-CE2 3.57Å; L36-Y75 HydrophobicContact CD1-CG 3.44Å; L36-Y75 VanDerWaalsContact CD1-CG 3.44Å; W46-Y75 AromaticContact CH2-CD1 3.84Å; W46-Y75 HydrophobicContact CH2-CD1 3.84Å; W46-Y75 HydrophobicContact CH2-CG 4.08Å; C71-Y75 WeakPolarHBondContact O-CB 3.06Å; C71-Y75 PolarHBondContact O-N 3.17Å; A72-Y75 PolarHBondContact O-N 3.44Å; K73-Y75 VanDerWaalsContact C-N 3.29Å; K73-Y75 PolarHBondContact O-N 2.96Å; Y75-L77 VanDerWaalsContact C-N 3.35Å; Y75-L77 PolarHBondContact O-N 3.15Å; Y75-L78 HydrophobicContact CD2-CD1 4.46Å; Y75-L78 WeakPolarHBondContact O-CB 3.04Å; Y75-L78 PolarHBondContact O-N 2.91Å; Y75-L78 VanDerWaalsContact O-N 3.1Å; Y75-L79 HydrophobicContact CD1-CD1 3.98Å; Y75-L79 HydrophobicContact CD1-CG 4.29Å; Y75-L79 HydrophobicContact CE1-CD1 3.78Å; Y75-L79 HydrophobicContact CE1-CD2 4Å; Y75-L79 HydrophobicContact CE1-CG 4.05Å; Y75-L79 WeakPolarHBondContact O-CG 3.19Å; Y75-L79 PolarHBondContact O-N 3.38Å; Y75-L79 VanDerWaalsContact O-N 3.12Å; Y75-A103 WeakPolarHBondContact OH-CB 3.47Å
76	A	87.8	Confident	83.1	Confident	43 Å²	43	51.6 Å²	51.6	36%	0.355	27%	0.272	S	S	.	.	H	α-helix	trans	-55.7	-49.6	172.8	0	0	0	0	0	111.4	A72 K73 L78 L79 D80	A72-A76 PolarHBondContact O-N 2.9Å; A72-A76 VanDerWaalsContact O-N 3.14Å; K73-A76 PolarHBondContact O-N 3.35Å; A76-L78 PolarHBondContact O-N 2.82Å; A76-L78 VanDerWaalsContact O-N 3.14Å; A76-L79 WeakPolarHBondContact O-CA 3.48Å; A76-L79 WeakPolarHBondContact O-CB 3.5Å; A76-L79 PolarHBondContact O-N 3.39Å; A76-D80 VanDerWaalsContact O-CG 3.24Å; A76-D80 PolarHBondContact O-N 2.84Å
77	L	88.1	Confident	81.8	Confident	14 Å²	14	59.3 Å²	59.3	7%	0.073	30%	0.299	C	S	.	.	H	α-helix	trans	-53.6	-38	175.6	-58.6	178.7	0	0	0	113	P10 L14 L15 K73 Y75 S81	P10-L77 HydrophobicContact CB-CD2 3.22Å; P10-L77 HydrophobicContact CG-CD2 3.8Å; L14-L77 HydrophobicContact CD1-CD1 4.33Å; L15-L77 HydrophobicContact CD1-CB 4.44Å; L15-L77 WeakPolarHBondContact CD1-O 3.4Å; L15-L77 HydrophobicContact CD2-CB 4.27Å; K73-L77 WeakPolarHBondContact O-CG 3.36Å; K73-L77 PolarHBondContact O-N 3.01Å; Y75-L77 VanDerWaalsContact C-N 3.35Å; Y75-L77 PolarHBondContact O-N 3.15Å; L77-S81 WeakPolarHBondContact O-CB 3.26Å; L77-S81 PolarHBondContact O-N 2.91Å; L77-S81 VanDerWaalsContact O-N 3.09Å
78	L	88.9	Confident	80.4	Confident	3 Å²	3	65 Å²	65	2%	0.016	32%	0.322	C	S	.	.	H	α-helix	trans	-68.9	-36.5	178	-72.8	171.9	0	0	0	112.5	L15 R29 L32 Q74 Y75 A76 S81 I82 V106 L110	L15-L78 HydrophobicContact CD2-CD2 4.03Å; R29-L78 HydrophobicContact CB-CD1 4.31Å; R29-L78 HydrophobicContact CB-CD2 4.46Å; R29-L78 HydrophobicContact CG-CD2 4.45Å; L32-L78 HydrophobicContact CD2-CD1 4.49Å; Q74-L78 WeakPolarHBondContact O-CG 3.37Å; Q74-L78 PolarHBondContact O-N 3.15Å; Y75-L78 HydrophobicContact CD2-CD1 4.46Å; Y75-L78 WeakPolarHBondContact O-CB 3.04Å; Y75-L78 PolarHBondContact O-N 2.91Å; Y75-L78 VanDerWaalsContact O-N 3.1Å; A76-L78 PolarHBondContact O-N 2.82Å; A76-L78 VanDerWaalsContact O-N 3.14Å; L78-S81 PolarHBondContact O-OG 3.39Å; L78-I82 WeakPolarHBondContact O-CD1 3.33Å; L78-I82 WeakPolarHBondContact O-CG1 3.35Å; L78-V106 HydrophobicContact CB-CG1 4.04Å; L78-V106 HydrophobicContact CD1-CG1 4.28Å; L78-L110 HydrophobicContact CD1-CD1 4.16Å; L78-L110 HydrophobicContact CD2-CD1 4.04Å; L78-L110 HydrophobicContact CD2-CD2 4.13Å
79	L	87.8	Confident	78.7	Confident	42 Å²	42	67.9 Å²	67.9	22%	0.22	33%	0.328	C	S	.	.	H	α-helix	trans	-67.8	-49	174.3	-59.3	173.2	0	0	0	110.7	Y75 A76 S81 I82 E83 L102 V106	Y75-L79 HydrophobicContact CD1-CD1 3.98Å; Y75-L79 HydrophobicContact CD1-CG 4.29Å; Y75-L79 HydrophobicContact CE1-CD1 3.78Å; Y75-L79 HydrophobicContact CE1-CD2 4Å; Y75-L79 HydrophobicContact CE1-CG 4.05Å; Y75-L79 WeakPolarHBondContact O-CG 3.19Å; Y75-L79 PolarHBondContact O-N 3.38Å; Y75-L79 VanDerWaalsContact O-N 3.12Å; A76-L79 WeakPolarHBondContact O-CA 3.48Å; A76-L79 WeakPolarHBondContact O-CB 3.5Å; A76-L79 PolarHBondContact O-N 3.39Å; L79-S81 VanDerWaalsContact C-N 3.31Å; L79-S81 PolarHBondContact O-N 2.83Å; L79-I82 PolarHBondContact O-N 3.33Å; L79-E83 PolarHBondContact O-N 2.78Å; L79-L102 HydrophobicContact CB-CD2 4.19Å; L79-L102 HydrophobicContact CD2-CD2 3.82Å; L79-L102 HydrophobicContact CD2-CG 3.77Å; L79-L102 HydrophobicContact CG-CD2 4.47Å; L79-V106 HydrophobicContact CD2-CG2 3.88Å
80	D	86.2	Confident	76.3	Confident	69 Å²	69	67.1 Å²	67.1	37%	0.369	33%	0.329	S	S	.	.	H	α-helix	trans	-54.4	-47.3	179.6	-59.3	-29	0	0	0	111.2	A76 I82 E83 L84	A76-D80 VanDerWaalsContact O-CG 3.24Å; A76-D80 PolarHBondContact O-N 2.84Å; D80-I82 PolarHBondContact O-N 2.88Å; D80-E83 PolarHBondContact O-N 3.11Å; D80-E83 VanDerWaalsContact O-N 3.16Å; D80-L84 WeakPolarHBondContact O-CG 3.48Å; D80-L84 PolarHBondContact O-N 3.41Å
81	S	82	Confident	74.1	Confident	8 Å²	8	72 Å²	72	6%	0.056	36%	0.358	C	S	.	.	H	α-helix	trans	-60.6	-13.5	178.8	78.6	0	0	0	0	114.9	L15 L77 L78 L79 V85 R109	L15-S81 VanDerWaalsContact CD1-CB 3.44Å; L77-S81 WeakPolarHBondContact O-CB 3.26Å; L77-S81 PolarHBondContact O-N 2.91Å; L77-S81 VanDerWaalsContact O-N 3.09Å; L78-S81 PolarHBondContact O-OG 3.39Å; L79-S81 VanDerWaalsContact C-N 3.31Å; L79-S81 PolarHBondContact O-N 2.83Å; S81-V85 WeakPolarHBondContact O-CG2 3.46Å; S81-R109 PolarHBondContact O-NH1 2.93Å
82	I	81	Confident	72.2	Confident	6 Å²	6	76 Å²	76	3%	0.031	40%	0.399	C	S	.	.	H	α-helix	trans	-107.2	-29.6	-179.1	-68.3	173.3	0	0	0	111.1	L78 L79 D80 L84 V85 K86 L102 R105 V106	L78-I82 WeakPolarHBondContact O-CD1 3.33Å; L78-I82 WeakPolarHBondContact O-CG1 3.35Å; L79-I82 PolarHBondContact O-N 3.33Å; D80-I82 PolarHBondContact O-N 2.88Å; I82-L84 VanDerWaalsContact C-N 3.32Å; I82-V85 PolarHBondContact O-N 2.88Å; I82-K86 WeakPolarHBondContact O-CB 3.25Å; I82-K86 PolarHBondContact O-N 3.3Å; I82-L102 HydrophobicContact CB-CD1 4.37Å; I82-L102 HydrophobicContact CG2-CD1 3.73Å; I82-R105 HydrophobicContact CG2-CB 4.21Å; I82-R105 HydrophobicContact CG2-CG 3.86Å; I82-V106 HydrophobicContact CD1-CB 3.86Å; I82-V106 HydrophobicContact CD1-CG1 4.33Å; I82-V106 HydrophobicContact CD1-CG2 3.52Å
83	E	76.2	Confident	69.9	Low	79 Å²	79	78.9 Å²	78.9	37%	0.369	42%	0.418	S	S	.	.	H	α-helix	trans	-64.4	-39	165.4	-63.8	-142.5	160.7	0	0	111.7	L79 D80 K86 R87 L102	L79-E83 PolarHBondContact O-N 2.78Å; D80-E83 PolarHBondContact O-N 3.11Å; D80-E83 VanDerWaalsContact O-N 3.16Å; E83-K86 WeakPolarHBondContact O-CB 3.35Å; E83-K86 PolarHBondContact O-N 3.35Å; E83-R87 WeakPolarHBondContact O-CG 3.07Å; E83-R87 PolarHBondContact O-N 2.88Å; E83-R87 IonicContact OE2-CZ 3.19Å; E83-R87 IonicContact OE2-NH1 3.63Å; E83-R87 IonicContact OE2-NH2 2.67Å; E83-R87 PolarHBondContact OE2-NH2 3.41Å; E83-L102 HydrophobicContact CG-CD2 4.49Å
84	L	66.5	Low	67.9	Low	71 Å²	71	75 Å²	75	37%	0.372	40%	0.404	S	S	.	.	H	α-helix	trans	-60.6	-47.9	173.3	-68.6	171.9	0	0	0	111.7	D80 I82 K86 R87 Q88	D80-L84 WeakPolarHBondContact O-CG 3.48Å; D80-L84 PolarHBondContact O-N 3.41Å; I82-L84 VanDerWaalsContact C-N 3.32Å; L84-K86 VanDerWaalsContact C-N 3.3Å; L84-K86 PolarHBondContact O-N 3.03Å; L84-R87 PolarHBondContact O-N 3.23Å; L84-R87 VanDerWaalsContact O-N 3.09Å; L84-Q88 PolarHBondContact O-N 3.34Å
85	V	62.6	Low	65.9	Low	68 Å²	68	80 Å²	80	41%	0.412	44%	0.44	S	S	.	.	H	α-helix	trans	-62.9	-34.5	174.7	170.7	0	0	0	0	112.1	S81 I82 Q88 K89	S81-V85 WeakPolarHBondContact O-CG2 3.46Å; I82-V85 PolarHBondContact O-N 2.88Å; V85-Q88 PolarHBondContact O-N 3.26Å; V85-K89 PolarHBondContact O-N 3.17Å; V85-K89 VanDerWaalsContact O-N 3.13Å
86	K	60.8	Low	64	Low	155 Å²	155	86 Å²	86	67%	0.674	47%	0.469	S	S	*	.	H	α-helix	trans	-66.4	-37.1	172.9	-173.2	-170	171.9	-165.4	0	111.9	I82 E83 L84	I82-K86 WeakPolarHBondContact O-CB 3.25Å; I82-K86 PolarHBondContact O-N 3.3Å; E83-K86 WeakPolarHBondContact O-CB 3.35Å; E83-K86 PolarHBondContact O-N 3.35Å; L84-K86 VanDerWaalsContact C-N 3.3Å; L84-K86 PolarHBondContact O-N 3.03Å
87	R	57.1	Low	62.4	Low	176 Å²	176	85.9 Å²	85.9	66%	0.664	47%	0.466	S	S	*	.	H	α-helix	trans	-71.7	-34.5	176.5	-71.6	-179.7	-175	106.3	14	112.4	E83 L84	E83-R87 WeakPolarHBondContact O-CG 3.07Å; E83-R87 PolarHBondContact O-N 2.88Å; E83-R87 IonicContact OE2-CZ 3.19Å; E83-R87 IonicContact OE2-NH1 3.63Å; E83-R87 IonicContact OE2-NH2 2.67Å; E83-R87 PolarHBondContact OE2-NH2 3.41Å; L84-R87 PolarHBondContact O-N 3.23Å; L84-R87 VanDerWaalsContact O-N 3.09Å
88	Q	56	Low	60.7	Low	159 Å²	159	89.8 Å²	89.8	74%	0.743	49%	0.494	S	S	*	.	H	α-helix	trans	-75	-28.3	176.7	-72.4	-178	-6.3	0	0	113.9	L84 V85 M90	L84-Q88 PolarHBondContact O-N 3.34Å; V85-Q88 PolarHBondContact O-N 3.26Å; Q88-M90 PolarHBondContact O-N 2.65Å
89	K	53	Low	59.5	Low	113 Å²	113	97.6 Å²	97.6	49%	0.491	53%	0.53	S	S	.	.	S	Bend	trans	-83.3	101.6	-179.5	-166.3	170	179.8	-178.5	0	111.4	V85 D94	V85-K89 PolarHBondContact O-N 3.17Å; V85-K89 VanDerWaalsContact O-N 3.13Å; K89-D94 IonicContact NZ-OD1 3.08Å; K89-D94 PolarHBondContact NZ-OD1 3.07Å; K89-D94 IonicContact NZ-OD2 2.92Å; K89-D94 PolarHBondContact NZ-OD2 3.15Å
90	M	36.6	Very low	58.7	Low	160 Å²	160	97.2 Å²	97.2	79%	0.788	53%	0.528	S	S	*	.			trans	-39.8	137.7	178.8	-76.8	-71.7	-75.7	0	0	114.4	Q88 G92	Q88-M90 PolarHBondContact O-N 2.65Å; M90-G92 PolarHBondContact O-N 3.5Å; M90-G92 VanDerWaalsContact O-N 3.11Å
91	P	41.1	Very low	58.4	Low	129 Å²	129	96.7 Å²	96.7	84%	0.838	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	107.9	-178	28.9	-34.4	0	0	0	111.1
92	G	50.3	Low	58.4	Low	84 Å²	84	98.6 Å²	98.6	87%	0.866	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	165.9	-1.4	179.6	0	0	0	0	0	116.6	M90	M90-G92 PolarHBondContact O-N 3.5Å; M90-G92 VanDerWaalsContact O-N 3.11Å
93	S	40	Very low	58.5	Low	90 Å²	90	98.7 Å²	98.7	63%	0.629	54%	0.541	S	S	*	.			trans	-131.7	165.8	178.4	-149.9	0	0	0	0	112.5
94	D	44.3	Very low	59	Low	65 Å²	65	95.2 Å²	95.2	35%	0.348	53%	0.525	S	S	.	.			trans	68.3	61.4	171.3	-48.5	5.4	0	0	0	118	K89 Q96 S97	K89-D94 IonicContact NZ-OD1 3.08Å; K89-D94 PolarHBondContact NZ-OD1 3.07Å; K89-D94 IonicContact NZ-OD2 2.92Å; K89-D94 PolarHBondContact NZ-OD2 3.15Å; D94-Q96 PolarHBondContact O-N 3.26Å; D94-S97 VanDerWaalsContact CB-OG 3.3Å; D94-S97 WeakPolarHBondContact CB-OG 3.45Å; D94-S97 PolarHBondContact O-N 3.37Å; D94-S97 PolarHBondContact O-OG 3.07Å
95	S	47.9	Very low	59.9	Low	116 Å²	116	95 Å²	95	81%	0.811	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-8.3	170.5	59.8	0	0	0	0	115.5
96	Q	50.7	Low	61.1	Low	157 Å²	157	91.7 Å²	91.7	73%	0.734	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.5	-12.3	174.4	-66.1	-175.4	-36.9	0	0	113.9	D94 S98	D94-Q96 PolarHBondContact O-N 3.26Å; Q96-S98 VanDerWaalsContact C-N 3.35Å
97	S	52.8	Low	62.4	Low	40 Å²	40	84.4 Å²	84.4	28%	0.28	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-18.4	179.4	73.1	0	0	0	0	113.6	D94 R105	D94-S97 VanDerWaalsContact CB-OG 3.3Å; D94-S97 WeakPolarHBondContact CB-OG 3.45Å; D94-S97 PolarHBondContact O-N 3.37Å; D94-S97 PolarHBondContact O-OG 3.07Å; S97-R105 PolarHBondContact O-NH2 3.1Å
98	S	53.5	Low	63.9	Low	95 Å²	95	78.6 Å²	78.6	66%	0.664	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-19.2	-174.6	-51.4	0	0	0	0	114.5	Q96	Q96-S98 VanDerWaalsContact C-N 3.35Å
99	Q	63.6	Low	65.4	Low	167 Å²	167	75 Å²	75	78%	0.78	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-12.1	177.6	-69	-173.4	-46	0	0	113.6
100	L	71	Confident	67.2	Low	34 Å²	34	69.8 Å²	69.8	18%	0.178	41%	0.405	C	S	.	.	S	Bend	trans	-87.1	133.1	178.4	-63.7	-178.7	0	0	0	111	E104 R105 K108 L280	L100-E104 WeakPolarHBondContact CA-OE2 3.46Å; L100-E104 HydrophobicContact CB-CB 4.1Å; L100-E104 HydrophobicContact CD2-CB 4.37Å; L100-R105 PolarHBondContact O-NH2 3.39Å; L100-R105 VanDerWaalsContact O-NH2 3.09Å; L100-K108 HydrophobicContact CD1-CD 3.73Å; L100-L280 HydrophobicContact CD1-CD2 4.12Å; L100-L280 HydrophobicContact CD2-CD2 4.06Å
101	S	80.2	Confident	69.8	Low	58 Å²	58	62.6 Å²	62.6	41%	0.406	37%	0.37	S	S	.	.			trans	-56.1	154.5	169.6	176.9	0	0	0	0	110.8	A103 E104 R105	S101-A103 PolarHBondContact O-N 3.09Å; S101-E104 WeakPolarHBondContact CB-OE2 3.35Å; S101-E104 PolarHBondContact N-OE2 3.24Å; S101-E104 WeakPolarHBondContact O-CB 3.39Å; S101-E104 PolarHBondContact O-N 2.87Å; S101-R105 PolarHBondContact O-N 3.22Å
102	L	80.9	Confident	72	Confident	49 Å²	49	58.5 Å²	58.5	26%	0.257	35%	0.347	S	S	.	.	H	α-helix	trans	-57.5	-39.7	177.8	-172.6	60	0	0	0	111.1	L79 I82 E83 E104 R105 V106	L79-L102 HydrophobicContact CB-CD2 4.19Å; L79-L102 HydrophobicContact CD2-CD2 3.82Å; L79-L102 HydrophobicContact CD2-CG 3.77Å; L79-L102 HydrophobicContact CG-CD2 4.47Å; I82-L102 HydrophobicContact CB-CD1 4.37Å; I82-L102 HydrophobicContact CG2-CD1 3.73Å; E83-L102 HydrophobicContact CG-CD2 4.49Å; L102-E104 PolarHBondContact O-N 2.82Å; L102-R105 WeakPolarHBondContact O-CB 3.02Å; L102-R105 PolarHBondContact O-N 3.15Å; L102-V106 WeakPolarHBondContact O-CG2 3.49Å; L102-V106 PolarHBondContact O-N 3.22Å
103	A	84.5	Confident	73.8	Confident	8 Å²	8	57.6 Å²	57.6	7%	0.066	32%	0.32	C	S	.	.	H	α-helix	trans	-61.7	-39.4	174.5	0	0	0	0	0	113.3	L37 Y75 S101 R105 V106 V107	L37-A103 HydrophobicContact CD2-CB 3.5Å; L37-A103 HydrophobicContact CG-CB 4.33Å; Y75-A103 WeakPolarHBondContact OH-CB 3.47Å; S101-A103 PolarHBondContact O-N 3.09Å; A103-R105 VanDerWaalsContact C-N 3.32Å; A103-V106 WeakPolarHBondContact O-CB 3.46Å; A103-V106 PolarHBondContact O-N 2.84Å; A103-V107 PolarHBondContact O-N 2.97Å; A103-V107 VanDerWaalsContact O-N 3.07Å
104	E	84.8	Confident	76.1	Confident	5 Å²	5	54.9 Å²	54.9	2%	0.023	30%	0.296	C	S	.	.	H	α-helix	trans	-67.8	-35.8	175.1	-66.8	179.1	98.9	0	0	111.5	L37 L100 S101 L102 V106 V107 K108 R276 L280	L37-E104 HydrophobicContact CD1-CG 4.3Å; L37-E104 HydrophobicContact CD2-CG 3.84Å; L100-E104 WeakPolarHBondContact CA-OE2 3.46Å; L100-E104 HydrophobicContact CB-CB 4.1Å; L100-E104 HydrophobicContact CD2-CB 4.37Å; S101-E104 WeakPolarHBondContact CB-OE2 3.35Å; S101-E104 PolarHBondContact N-OE2 3.24Å; S101-E104 WeakPolarHBondContact O-CB 3.39Å; S101-E104 PolarHBondContact O-N 2.87Å; L102-E104 PolarHBondContact O-N 2.82Å; E104-V106 VanDerWaalsContact C-N 3.31Å; E104-V106 PolarHBondContact O-N 2.9Å; E104-V107 PolarHBondContact O-N 2.9Å; E104-K108 WeakPolarHBondContact O-CB 3.39Å; E104-K108 PolarHBondContact O-N 3.38Å; E104-R276 IonicContact OE1-CZ 2.63Å; E104-R276 VanDerWaalsContact OE1-CZ 3.24Å; E104-R276 IonicContact OE1-NE 3.87Å; E104-R276 PolarHBondContact OE1-NE 3.26Å; E104-R276 IonicContact OE1-NH2 2.57Å; E104-R276 PolarHBondContact OE1-NH2 3.14Å; E104-R276 IonicContact OE2-CZ 3.32Å; E104-R276 IonicContact OE2-NE 3.32Å; E104-R276 IonicContact OE2-NH2 2.76Å; E104-R276 PolarHBondContact OE2-NH2 3.49Å; E104-L280 HydrophobicContact CB-CD1 4.05Å; E104-L280 HydrophobicContact CG-CD1 3.99Å
105	R	85.5	Confident	78.1	Confident	66 Å²	66	52.6 Å²	52.6	25%	0.249	29%	0.286	C	S	.	.	H	α-helix	trans	-64.7	-35.4	173.5	-157.9	176.8	-64	107.9	8.6	111.2	I82 S97 L100 S101 L102 A103 R109	I82-R105 HydrophobicContact CG2-CB 4.21Å; I82-R105 HydrophobicContact CG2-CG 3.86Å; S97-R105 PolarHBondContact O-NH2 3.1Å; L100-R105 PolarHBondContact O-NH2 3.39Å; L100-R105 VanDerWaalsContact O-NH2 3.09Å; S101-R105 PolarHBondContact O-N 3.22Å; L102-R105 WeakPolarHBondContact O-CB 3.02Å; L102-R105 PolarHBondContact O-N 3.15Å; A103-R105 VanDerWaalsContact C-N 3.32Å; R105-R109 VanDerWaalsContact O-CB 3.3Å; R105-R109 WeakPolarHBondContact O-CB 3.18Å; R105-R109 PolarHBondContact O-N 2.89Å
106	V	88.1	Confident	79.9	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59	-58.6	169.4	-175.4	0	0	0	0	110.7	A33 L78 L79 I82 L102 A103 E104 K108 R109 L110	A33-V106 HydrophobicContact CB-CB 4.32Å; A33-V106 HydrophobicContact CB-CG1 3.52Å; L78-V106 HydrophobicContact CB-CG1 4.04Å; L78-V106 HydrophobicContact CD1-CG1 4.28Å; L79-V106 HydrophobicContact CD2-CG2 3.88Å; I82-V106 HydrophobicContact CD1-CB 3.86Å; I82-V106 HydrophobicContact CD1-CG1 4.33Å; I82-V106 HydrophobicContact CD1-CG2 3.52Å; L102-V106 WeakPolarHBondContact O-CG2 3.49Å; L102-V106 PolarHBondContact O-N 3.22Å; A103-V106 WeakPolarHBondContact O-CB 3.46Å; A103-V106 PolarHBondContact O-N 2.84Å; E104-V106 VanDerWaalsContact C-N 3.31Å; E104-V106 PolarHBondContact O-N 2.9Å; V106-K108 VanDerWaalsContact C-N 3.34Å; V106-K108 PolarHBondContact O-N 3.24Å; V106-R109 PolarHBondContact O-N 3.02Å; V106-L110 HydrophobicContact CG1-CD1 3.64Å; V106-L110 HydrophobicContact CG1-CG 4.14Å; V106-L110 WeakPolarHBondContact O-CG 3.39Å; V106-L110 PolarHBondContact O-N 3.23Å
107	V	88.8	Confident	81.6	Confident	1 Å²	1	45 Å²	45	1%	0.006	24%	0.238	C	C	.	.	H	α-helix	trans	-65.5	-37.9	-174.2	173.8	0	0	0	0	111.6	L30 A33 L37 A103 E104 S111	L30-V107 HydrophobicContact CD1-CG1 4.15Å; A33-V107 VanDerWaalsContact C-CG2 3.49Å; A33-V107 HydrophobicContact CB-CG2 3.59Å; L37-V107 HydrophobicContact CD1-CB 3.69Å; L37-V107 HydrophobicContact CD1-CG1 4.17Å; L37-V107 HydrophobicContact CD1-CG2 3.49Å; L37-V107 VanDerWaalsContact CD1-CG2 3.49Å; L37-V107 HydrophobicContact CG-CG2 4.09Å; A103-V107 PolarHBondContact O-N 2.97Å; A103-V107 VanDerWaalsContact O-N 3.07Å; E104-V107 PolarHBondContact O-N 2.9Å; V107-S111 WeakPolarHBondContact O-CB 3.44Å; V107-S111 PolarHBondContact O-N 3.32Å; V107-S111 PolarHBondContact O-OG 3.18Å
108	K	88	Confident	83.2	Confident	55 Å²	55	46.7 Å²	46.7	24%	0.239	24%	0.243	C	C	.	.	H	α-helix	trans	-63	-43.2	175.4	-172.5	168.3	177.4	167.3	0	112.2	L100 E104 V106 A112 L280 E283	L100-K108 HydrophobicContact CD1-CD 3.73Å; E104-K108 WeakPolarHBondContact O-CB 3.39Å; E104-K108 PolarHBondContact O-N 3.38Å; V106-K108 VanDerWaalsContact C-N 3.34Å; V106-K108 PolarHBondContact O-N 3.24Å; K108-A112 PolarHBondContact O-N 3.18Å; K108-L280 HydrophobicContact CD-CD2 4.12Å; K108-E283 WeakPolarHBondContact CE-OE1 3.35Å; K108-E283 WeakPolarHBondContact CE-OE2 3.26Å; K108-E283 IonicContact NZ-OE1 3.81Å; K108-E283 PolarHBondContact NZ-OE1 3.09Å; K108-E283 IonicContact NZ-OE2 2.7Å; K108-E283 PolarHBondContact NZ-OE2 3.42Å
109	R	88.5	Confident	84.7	Confident	84 Å²	84	45.8 Å²	45.8	32%	0.317	23%	0.225	S	C	.	.	H	α-helix	trans	-61.8	-58.2	173.9	176.6	-179.2	174.7	171.2	4.4	111.3	S81 R105 V106 S111 A112 E113	S81-R109 PolarHBondContact O-NH1 2.93Å; R105-R109 VanDerWaalsContact O-CB 3.3Å; R105-R109 WeakPolarHBondContact O-CB 3.18Å; R105-R109 PolarHBondContact O-N 2.89Å; V106-R109 PolarHBondContact O-N 3.02Å; R109-S111 PolarHBondContact O-N 2.73Å; R109-A112 PolarHBondContact O-N 3.1Å; R109-A112 VanDerWaalsContact O-N 3.08Å; R109-E113 HydrophobicContact CG-CG 4.48Å; R109-E113 VanDerWaalsContact CG-OE1 3.31Å; R109-E113 WeakPolarHBondContact CG-OE1 3.43Å; R109-E113 IonicContact CZ-OE1 3.24Å; R109-E113 IonicContact NE-OE1 2.68Å; R109-E113 PolarHBondContact NE-OE1 2.6Å; R109-E113 IonicContact NH2-OE1 2.99Å; R109-E113 PolarHBondContact NH2-OE1 2.83Å; R109-E113 WeakPolarHBondContact O-CG 3.48Å; R109-E113 PolarHBondContact O-N 3.13Å
110	L	90.4	Very high	85.5	Confident	3 Å²	3	40 Å²	40	2%	0.016	20%	0.203	C	C	.	.	H	α-helix	trans	-63	-30.1	-176.4	-63	179.9	0	0	0	112.4	L26 R29 L30 A33 L78 V106 R114	L26-L110 HydrophobicContact CD1-CB 4.28Å; L26-L110 HydrophobicContact CD1-CD2 3.69Å; R29-L110 HydrophobicContact CB-CD1 4.09Å; L30-L110 HydrophobicContact CB-CB 4.25Å; L30-L110 HydrophobicContact CD1-CB 3.86Å; A33-L110 HydrophobicContact CB-CD1 4.06Å; L78-L110 HydrophobicContact CD1-CD1 4.16Å; L78-L110 HydrophobicContact CD2-CD1 4.04Å; L78-L110 HydrophobicContact CD2-CD2 4.13Å; V106-L110 HydrophobicContact CG1-CD1 3.64Å; V106-L110 HydrophobicContact CG1-CG 4.14Å; V106-L110 WeakPolarHBondContact O-CG 3.39Å; V106-L110 PolarHBondContact O-N 3.23Å; L110-R114 WeakPolarHBondContact O-CB 3.22Å; L110-R114 PolarHBondContact O-N 3.46Å
111	S	89.8	Confident	86	Confident	9 Å²	9	41.9 Å²	41.9	6%	0.063	21%	0.208	C	C	.	.	H	α-helix	trans	-69.6	-39.7	174.2	-61.8	0	0	0	0	112.3	L30 V107 R109 R114 A115 L281	L30-S111 WeakPolarHBondContact CD1-OG 3.29Å; V107-S111 WeakPolarHBondContact O-CB 3.44Å; V107-S111 PolarHBondContact O-N 3.32Å; V107-S111 PolarHBondContact O-OG 3.18Å; R109-S111 PolarHBondContact O-N 2.73Å; S111-R114 PolarHBondContact O-N 3.46Å; S111-A115 VanDerWaalsContact O-CB 3.3Å; S111-A115 WeakPolarHBondContact O-CB 3.32Å; S111-A115 PolarHBondContact O-N 3.46Å; S111-L281 WeakPolarHBondContact OG-CD2 3.26Å
112	A	88.1	Confident	86.2	Confident	42 Å²	42	44 Å²	44	35%	0.347	21%	0.213	S	C	.	.	H	α-helix	trans	-68.8	-43.8	176.2	0	0	0	0	0	111.3	K108 R109 R114 A115 E116 A284	K108-A112 PolarHBondContact O-N 3.18Å; R109-A112 PolarHBondContact O-N 3.1Å; R109-A112 VanDerWaalsContact O-N 3.08Å; A112-R114 PolarHBondContact O-N 2.92Å; A112-A115 PolarHBondContact O-N 2.7Å; A112-E116 PolarHBondContact O-N 2.71Å; A112-A284 HydrophobicContact CB-CB 4.26Å
113	E	88.4	Confident	86.3	Confident	66 Å²	66	47.2 Å²	47.2	31%	0.308	22%	0.222	S	C	.	.	H	α-helix	trans	-58.1	-47	172.6	-68.9	174.2	-175.2	0	0	110.8	L26 R109 A115 E116 E117	L26-E113 HydrophobicContact CD1-CB 4.33Å; L26-E113 HydrophobicContact CD2-CB 3.76Å; R109-E113 HydrophobicContact CG-CG 4.48Å; R109-E113 VanDerWaalsContact CG-OE1 3.31Å; R109-E113 WeakPolarHBondContact CG-OE1 3.43Å; R109-E113 IonicContact CZ-OE1 3.24Å; R109-E113 IonicContact NE-OE1 2.68Å; R109-E113 PolarHBondContact NE-OE1 2.6Å; R109-E113 IonicContact NH2-OE1 2.99Å; R109-E113 PolarHBondContact NH2-OE1 2.83Å; R109-E113 WeakPolarHBondContact O-CG 3.48Å; R109-E113 PolarHBondContact O-N 3.13Å; E113-A115 VanDerWaalsContact C-N 3.35Å; E113-A115 PolarHBondContact O-N 3.24Å; E113-E116 PolarHBondContact O-N 2.95Å; E113-E117 WeakPolarHBondContact O-CB 3.39Å; E113-E117 PolarHBondContact O-N 3.36Å
114	R	88.3	Confident	85.9	Confident	32 Å²	32	47.9 Å²	47.9	12%	0.121	23%	0.226	C	C	.	.	H	α-helix	trans	-68	-33.3	179.5	-179	56.8	-179.6	-179.2	4.4	112.5	L26 L30 L110 S111 A112 E117 L118	L26-R114 HydrophobicContact CD2-CB 4.08Å; L26-R114 HydrophobicContact CG-CB 4.19Å; L30-R114 HydrophobicContact CD2-CB 4.01Å; L30-R114 HydrophobicContact CD2-CG 4.05Å; L110-R114 WeakPolarHBondContact O-CB 3.22Å; L110-R114 PolarHBondContact O-N 3.46Å; S111-R114 PolarHBondContact O-N 3.46Å; A112-R114 PolarHBondContact O-N 2.92Å; R114-E117 WeakPolarHBondContact CD-OE2 3.39Å; R114-E117 IonicContact CZ-OE2 2.67Å; R114-E117 IonicContact NE-OE2 2.74Å; R114-E117 IonicContact NH1-OE1 3.86Å; R114-E117 PolarHBondContact NH1-OE1 3.21Å; R114-E117 IonicContact NH1-OE2 2.65Å; R114-E117 PolarHBondContact NH1-OE2 2.95Å; R114-L118 HydrophobicContact CG-CD1 4.26Å; R114-L118 WeakPolarHBondContact O-CB 3.4Å; R114-L118 VanDerWaalsContact O-CG 3.31Å; R114-L118 WeakPolarHBondContact O-CG 3.29Å; R114-L118 PolarHBondContact O-N 3.34Å
115	A	86.6	Confident	85.9	Confident	17 Å²	17	49 Å²	49	14%	0.14	24%	0.24	C	C	.	.	H	α-helix	trans	-64.8	-44.2	173.4	0	0	0	0	0	111.2	S111 A112 E113 L118 R119	S111-A115 VanDerWaalsContact O-CB 3.3Å; S111-A115 WeakPolarHBondContact O-CB 3.32Å; S111-A115 PolarHBondContact O-N 3.46Å; A112-A115 PolarHBondContact O-N 2.7Å; E113-A115 VanDerWaalsContact C-N 3.35Å; E113-A115 PolarHBondContact O-N 3.24Å; A115-L118 PolarHBondContact O-N 3.45Å; A115-R119 VanDerWaalsContact O-CG 3.32Å; A115-R119 WeakPolarHBondContact O-CG 3.4Å; A115-R119 PolarHBondContact O-N 3.25Å
116	E	85.5	Confident	85.9	Confident	73 Å²	73	51.5 Å²	51.5	34%	0.341	25%	0.254	S	S	.	.	H	α-helix	trans	-73.5	-31.4	178.3	-162.7	59.1	-155	0	0	113	A112 E113 R119 S120 R123	A112-E116 PolarHBondContact O-N 2.71Å; E113-E116 PolarHBondContact O-N 2.95Å; E116-R119 PolarHBondContact O-N 2.82Å; E116-R119 WeakPolarHBondContact OE2-CD 3.39Å; E116-R119 IonicContact OE2-CZ 3.07Å; E116-R119 IonicContact OE2-NE 3.07Å; E116-R119 IonicContact OE2-NH1 3.79Å; E116-R119 PolarHBondContact OE2-NH1 3.34Å; E116-S120 VanDerWaalsContact O-CB 3.26Å; E116-S120 WeakPolarHBondContact O-CB 3.41Å; E116-S120 PolarHBondContact O-N 3.38Å; E116-S120 PolarHBondContact O-OG 3.34Å; E116-R123 IonicContact OE1-CZ 2.81Å; E116-R123 VanDerWaalsContact OE1-CZ 3.31Å; E116-R123 IonicContact OE1-NH1 2.72Å; E116-R123 PolarHBondContact OE1-NH1 3.46Å; E116-R123 IonicContact OE1-NH2 2.65Å; E116-R123 PolarHBondContact OE1-NH2 3.28Å
117	E	85.8	Confident	85.6	Confident	42 Å²	42	57.1 Å²	57.1	20%	0.196	28%	0.275	C	S	.	.	H	α-helix	trans	-58.6	-47.3	169	-165.7	-148.2	143.2	0	0	110.9	L26 E113 R114 S120 R121	L26-E117 HydrophobicContact CD2-CB 4.46Å; E113-E117 WeakPolarHBondContact O-CB 3.39Å; E113-E117 PolarHBondContact O-N 3.36Å; R114-E117 WeakPolarHBondContact CD-OE2 3.39Å; R114-E117 IonicContact CZ-OE2 2.67Å; R114-E117 IonicContact NE-OE2 2.74Å; R114-E117 IonicContact NH1-OE1 3.86Å; R114-E117 PolarHBondContact NH1-OE1 3.21Å; R114-E117 IonicContact NH1-OE2 2.65Å; R114-E117 PolarHBondContact NH1-OE2 2.95Å; E117-S120 PolarHBondContact O-N 3.3Å; E117-R121 WeakPolarHBondContact O-CG 3.44Å; E117-R121 PolarHBondContact O-N 3.47Å; E117-R121 IonicContact OE1-CZ 3.31Å; E117-R121 IonicContact OE1-NE 3.66Å; E117-R121 PolarHBondContact OE1-NE 2.81Å; E117-R121 IonicContact OE1-NH2 2.97Å; E117-R121 PolarHBondContact OE1-NH2 3.02Å
118	L	86.6	Confident	85.1	Confident	75 Å²	75	58.3 Å²	58.3	39%	0.393	28%	0.279	S	S	.	.	H	α-helix	trans	-67.4	-43.6	177.5	-73	169.4	0	0	0	112.3	R114 A115 S120 R121 I122	R114-L118 HydrophobicContact CG-CD1 4.26Å; R114-L118 WeakPolarHBondContact O-CB 3.4Å; R114-L118 VanDerWaalsContact O-CG 3.31Å; R114-L118 WeakPolarHBondContact O-CG 3.29Å; R114-L118 PolarHBondContact O-N 3.34Å; A115-L118 PolarHBondContact O-N 3.45Å; L118-S120 VanDerWaalsContact C-N 3.26Å; L118-S120 PolarHBondContact O-N 2.9Å; L118-R121 PolarHBondContact O-N 3.2Å; L118-I122 VanDerWaalsContact O-CG1 3.29Å; L118-I122 WeakPolarHBondContact O-CG1 3.44Å; L118-I122 PolarHBondContact O-N 2.82Å
119	R	85.9	Confident	84.9	Confident	76 Å²	76	63 Å²	63	29%	0.287	30%	0.297	S	S	.	.	H	α-helix	trans	-59.4	-38.7	173.4	-70.1	-179.1	-153.1	114.7	-0.9	111.3	A115 E116 I122 R123 S285	A115-R119 VanDerWaalsContact O-CG 3.32Å; A115-R119 WeakPolarHBondContact O-CG 3.4Å; A115-R119 PolarHBondContact O-N 3.25Å; E116-R119 PolarHBondContact O-N 2.82Å; E116-R119 WeakPolarHBondContact OE2-CD 3.39Å; E116-R119 IonicContact OE2-CZ 3.07Å; E116-R119 IonicContact OE2-NE 3.07Å; E116-R119 IonicContact OE2-NH1 3.79Å; E116-R119 PolarHBondContact OE2-NH1 3.34Å; R119-I122 PolarHBondContact O-N 2.69Å; R119-R123 WeakPolarHBondContact O-CG 3.33Å; R119-R123 PolarHBondContact O-N 2.85Å; R119-S285 PolarHBondContact NH2-O 3.29Å
120	S	80.2	Confident	84.8	Confident	45 Å²	45	62.6 Å²	62.6	32%	0.315	31%	0.307	S	S	.	.	H	α-helix	trans	-68.6	-44	178.1	-59.1	0	0	0	0	112.3	E116 E117 L118 I122 R123 C124	E116-S120 VanDerWaalsContact O-CB 3.26Å; E116-S120 WeakPolarHBondContact O-CB 3.41Å; E116-S120 PolarHBondContact O-N 3.38Å; E116-S120 PolarHBondContact O-OG 3.34Å; E117-S120 PolarHBondContact O-N 3.3Å; L118-S120 VanDerWaalsContact C-N 3.26Å; L118-S120 PolarHBondContact O-N 2.9Å; S120-I122 VanDerWaalsContact C-N 3.3Å; S120-I122 PolarHBondContact O-N 2.73Å; S120-R123 PolarHBondContact O-N 3.38Å; S120-R123 PolarHBondContact OG-NH2 2.92Å; S120-C124 PolarHBondContact O-N 3.39Å
121	R	80.5	Confident	84.4	Confident	73 Å²	73	63.7 Å²	63.7	28%	0.275	32%	0.315	S	S	.	.	H	α-helix	trans	-57.6	-41.8	171.7	-71.7	174.8	-174.7	-112.8	5.1	112	Y19 E117 L118 C124 G125	Y19-R121 PolarHBondContact OH-NH2 3.25Å; E117-R121 WeakPolarHBondContact O-CG 3.44Å; E117-R121 PolarHBondContact O-N 3.47Å; E117-R121 IonicContact OE1-CZ 3.31Å; E117-R121 IonicContact OE1-NE 3.66Å; E117-R121 PolarHBondContact OE1-NE 2.81Å; E117-R121 IonicContact OE1-NH2 2.97Å; E117-R121 PolarHBondContact OE1-NH2 3.02Å; L118-R121 PolarHBondContact O-N 3.2Å; R121-C124 PolarHBondContact O-N 3.13Å; R121-G125 PolarHBondContact O-N 3.49Å
122	I	85.3	Confident	84.2	Confident	102 Å²	102	65.5 Å²	65.5	52%	0.523	32%	0.324	S	S	.	.	H	α-helix	trans	-64.6	-48.3	176.5	-68.1	164	0	0	0	111	L118 R119 S120 C124 G125 Q126	L118-I122 VanDerWaalsContact O-CG1 3.29Å; L118-I122 WeakPolarHBondContact O-CG1 3.44Å; L118-I122 PolarHBondContact O-N 2.82Å; R119-I122 PolarHBondContact O-N 2.69Å; S120-I122 VanDerWaalsContact C-N 3.3Å; S120-I122 PolarHBondContact O-N 2.73Å; I122-C124 VanDerWaalsContact C-N 3.31Å; I122-C124 PolarHBondContact O-N 3.39Å; I122-G125 PolarHBondContact O-N 3.17Å; I122-Q126 HydrophobicContact CG2-CG 4.43Å; I122-Q126 WeakPolarHBondContact O-CB 3.44Å; I122-Q126 WeakPolarHBondContact O-CG 3.2Å; I122-Q126 PolarHBondContact O-N 3.39Å
123	R	83.9	Confident	84.3	Confident	118 Å²	118	69.7 Å²	69.7	45%	0.445	33%	0.334	S	S	.	.	H	α-helix	trans	-58.5	-40.8	176	-73.3	-175.5	-60.3	-129.7	-2.2	112.2	E116 R119 S120 R127	E116-R123 IonicContact OE1-CZ 2.81Å; E116-R123 VanDerWaalsContact OE1-CZ 3.31Å; E116-R123 IonicContact OE1-NH1 2.72Å; E116-R123 PolarHBondContact OE1-NH1 3.46Å; E116-R123 IonicContact OE1-NH2 2.65Å; E116-R123 PolarHBondContact OE1-NH2 3.28Å; R119-R123 WeakPolarHBondContact O-CG 3.33Å; R119-R123 PolarHBondContact O-N 2.85Å; S120-R123 PolarHBondContact O-N 3.38Å; S120-R123 PolarHBondContact OG-NH2 2.92Å; R123-R127 WeakPolarHBondContact O-CG 3.17Å; R123-R127 PolarHBondContact O-N 2.71Å; R123-R127 VanDerWaalsContact O-N 3.09Å
124	C	76.1	Confident	84.1	Confident	22 Å²	22	69.6 Å²	69.6	15%	0.149	34%	0.341	C	S	.	.	H	α-helix	trans	-63.2	-52.7	174.3	-117	0	0	0	0	111.1	S120 R121 I122 Q126 R127 Y128 F233	S120-C124 PolarHBondContact O-N 3.39Å; R121-C124 PolarHBondContact O-N 3.13Å; I122-C124 VanDerWaalsContact C-N 3.31Å; I122-C124 PolarHBondContact O-N 3.39Å; C124-Q126 PolarHBondContact O-N 2.98Å; C124-R127 WeakPolarHBondContact O-CB 3.49Å; C124-R127 PolarHBondContact O-N 3.45Å; C124-Y128 VanDerWaalsContact C-CD2 3.48Å; C124-Y128 HydrophobicContact CB-CD2 4.27Å; C124-Y128 HydrophobicContact CB-CE2 3.8Å; C124-Y128 WeakPolarHBondContact O-CD2 3.35Å; C124-Y128 PolarHBondContact O-N 3.1Å; C124-F233 HydrophobicContact CB-CE2 3.93Å; C124-F233 HydrophobicContact CB-CZ 4Å
125	G	83.5	Confident	83.8	Confident	29 Å²	29	69.7 Å²	69.7	30%	0.299	34%	0.343	S	S	.	.	H	α-helix	trans	-56.4	-36.4	177.9	0	0	0	0	0	113.6	R121 I122 Y129	R121-G125 PolarHBondContact O-N 3.49Å; I122-G125 PolarHBondContact O-N 3.17Å; G125-Y129 WeakPolarHBondContact O-CB 3.49Å; G125-Y129 PolarHBondContact O-N 2.99Å
126	Q	86.7	Confident	83.7	Confident	117 Å²	117	72.4 Å²	72.4	55%	0.547	35%	0.354	S	S	.	.	H	α-helix	trans	-65.5	-44.5	173	-73.8	172.6	-38.2	0	0	112.4	I122 C124 Y129 S130	I122-Q126 HydrophobicContact CG2-CG 4.43Å; I122-Q126 WeakPolarHBondContact O-CB 3.44Å; I122-Q126 WeakPolarHBondContact O-CG 3.2Å; I122-Q126 PolarHBondContact O-N 3.39Å; C124-Q126 PolarHBondContact O-N 2.98Å; Q126-Y129 PolarHBondContact O-N 2.75Å; Q126-S130 PolarHBondContact O-N 2.95Å; Q126-S130 PolarHBondContact O-OG 3.42Å
127	R	80.9	Confident	83.8	Confident	119 Å²	119	72 Å²	72	45%	0.449	36%	0.36	S	S	.	.	H	α-helix	trans	-60.7	-48.8	174.1	-72.3	177	178.9	174.6	-0.3	111.5	R123 C124 Y129 S130 S131 C206 S207	R123-R127 WeakPolarHBondContact O-CG 3.17Å; R123-R127 PolarHBondContact O-N 2.71Å; R123-R127 VanDerWaalsContact O-N 3.09Å; C124-R127 WeakPolarHBondContact O-CB 3.49Å; C124-R127 PolarHBondContact O-N 3.45Å; R127-Y129 VanDerWaalsContact C-N 3.33Å; R127-Y129 PolarHBondContact O-N 2.88Å; R127-S130 PolarHBondContact O-N 3.3Å; R127-S131 PolarHBondContact O-N 3.04Å; R127-S131 PolarHBondContact O-OG 3.03Å; R127-S131 VanDerWaalsContact O-OG 3.11Å; R127-C206 PolarHBondContact NH1-O 2.89Å; R127-S207 PolarHBondContact NH1-OG 3.2Å
128	Y	79.2	Confident	83.6	Confident	25 Å²	25	72.1 Å²	72.1	10%	0.098	36%	0.361	C	S	.	.	H	α-helix	trans	-61.9	-39.4	178.4	-64	-58.8	0	0	0	112.4	C124 S131 L132 C206 F226 E229 F233	C124-Y128 VanDerWaalsContact C-CD2 3.48Å; C124-Y128 HydrophobicContact CB-CD2 4.27Å; C124-Y128 HydrophobicContact CB-CE2 3.8Å; C124-Y128 WeakPolarHBondContact O-CD2 3.35Å; C124-Y128 PolarHBondContact O-N 3.1Å; Y128-S131 PolarHBondContact O-N 2.76Å; Y128-L132 WeakPolarHBondContact O-CB 3.25Å; Y128-L132 PolarHBondContact O-N 2.85Å; Y128-C206 PolarHBondContact OH-SG 3.39Å; Y128-F226 HydrophobicContact CD1-CE2 4.39Å; Y128-E229 HydrophobicContact CE1-CG 4.35Å; Y128-E229 PolarHBondContact OH-OE1 3.07Å; Y128-F233 AromaticContact CD2-CD1 3.57Å; Y128-F233 HydrophobicContact CD2-CD1 3.57Å; Y128-F233 HydrophobicContact CD2-CD2 4.12Å; Y128-F233 AromaticContact CD2-CE1 3.49Å; Y128-F233 HydrophobicContact CD2-CE1 3.49Å; Y128-F233 VanDerWaalsContact CD2-CE1 3.49Å; Y128-F233 HydrophobicContact CD2-CE2 4.06Å; Y128-F233 AromaticContact CD2-CG 3.89Å; Y128-F233 HydrophobicContact CD2-CG 3.89Å; Y128-F233 AromaticContact CD2-CZ 3.75Å; Y128-F233 HydrophobicContact CD2-CZ 3.75Å; Y128-F233 HydrophobicContact CE2-CB 4.37Å; Y128-F233 AromaticContact CE2-CD1 3.76Å; Y128-F233 HydrophobicContact CE2-CD1 3.76Å; Y128-F233 AromaticContact CE2-CD2 3.44Å; Y128-F233 HydrophobicContact CE2-CD2 3.44Å; Y128-F233 VanDerWaalsContact CE2-CD2 3.44Å; Y128-F233 AromaticContact CE2-CE1 3.83Å; Y128-F233 HydrophobicContact CE2-CE1 3.83Å; Y128-F233 AromaticContact CE2-CE2 3.52Å; Y128-F233 HydrophobicContact CE2-CE2 3.52Å; Y128-F233 AromaticContact CE2-CG 3.56Å; Y128-F233 HydrophobicContact CE2-CG 3.56Å; Y128-F233 AromaticContact CE2-CZ 3.71Å; Y128-F233 HydrophobicContact CE2-CZ 3.71Å; Y128-F233 HydrophobicContact CG-CD1 4.41Å
129	Y	83.6	Confident	83.3	Confident	155 Å²	155	72.2 Å²	72.2	61%	0.608	37%	0.365	S	S	*	.	H	α-helix	trans	-62.1	-43.8	174	175.8	-100.9	0	0	0	111.9	G125 Q126 R127 K133	G125-Y129 WeakPolarHBondContact O-CB 3.49Å; G125-Y129 PolarHBondContact O-N 2.99Å; Q126-Y129 PolarHBondContact O-N 2.75Å; R127-Y129 VanDerWaalsContact C-N 3.33Å; R127-Y129 PolarHBondContact O-N 2.88Å; Y129-K133 VanDerWaalsContact O-CB 3.25Å; Y129-K133 WeakPolarHBondContact O-CB 3.24Å; Y129-K133 PolarHBondContact O-N 3.01Å
130	S	85.3	Confident	83.2	Confident	75 Å²	75	76 Å²	76	52%	0.524	39%	0.386	S	S	.	.	H	α-helix	trans	-63.4	-44	174.7	-65	0	0	0	0	112.5	Q126 R127 K133 S134	Q126-S130 PolarHBondContact O-N 2.95Å; Q126-S130 PolarHBondContact O-OG 3.42Å; R127-S130 PolarHBondContact O-N 3.3Å; S130-K133 PolarHBondContact O-N 3.47Å; S130-S134 PolarHBondContact O-N 3.14Å
131	S	82.4	Confident	83.3	Confident	26 Å²	26	77.7 Å²	77.7	18%	0.182	40%	0.398	C	S	.	.	H	α-helix	trans	-64.5	-44.9	177.6	-58.7	0	0	0	0	112.2	R127 Y128 K133 S134 I135	R127-S131 PolarHBondContact O-N 3.04Å; R127-S131 PolarHBondContact O-OG 3.03Å; R127-S131 VanDerWaalsContact O-OG 3.11Å; Y128-S131 PolarHBondContact O-N 2.76Å; S131-K133 VanDerWaalsContact C-N 3.33Å; S131-K133 PolarHBondContact O-N 3.24Å; S131-S134 WeakPolarHBondContact O-CB 3.38Å; S131-S134 PolarHBondContact O-N 3.28Å; S131-I135 WeakPolarHBondContact O-CG1 3.31Å; S131-I135 PolarHBondContact O-N 3.3Å
132	L	86.5	Confident	83.2	Confident	47 Å²	47	75.3 Å²	75.3	25%	0.246	40%	0.396	C	S	.	.	H	α-helix	trans	-63.1	-39.7	175.6	-179	63.2	0	0	0	111.2	Y128 I135 I136	Y128-L132 WeakPolarHBondContact O-CB 3.25Å; Y128-L132 PolarHBondContact O-N 2.85Å; L132-I135 PolarHBondContact O-N 2.88Å; L132-I136 HydrophobicContact CD1-CD1 4.33Å; L132-I136 HydrophobicContact CG-CD1 3.99Å; L132-I136 WeakPolarHBondContact O-CB 3.37Å; L132-I136 VanDerWaalsContact O-CG1 3.26Å; L132-I136 WeakPolarHBondContact O-CG1 3.35Å; L132-I136 PolarHBondContact O-N 3.33Å
133	K	89	Confident	82.4	Confident	130 Å²	130	76.4 Å²	76.4	57%	0.565	40%	0.4	S	S	*	.	H	α-helix	trans	-65.2	-38.4	175	-170.2	-171.8	174.4	-159.2	0	112.1	Y129 S130 S131 I136 S137	Y129-K133 VanDerWaalsContact O-CB 3.25Å; Y129-K133 WeakPolarHBondContact O-CB 3.24Å; Y129-K133 PolarHBondContact O-N 3.01Å; S130-K133 PolarHBondContact O-N 3.47Å; S131-K133 VanDerWaalsContact C-N 3.33Å; S131-K133 PolarHBondContact O-N 3.24Å; K133-I136 PolarHBondContact O-N 3.18Å; K133-S137 PolarHBondContact O-N 3.42Å
134	S	85.2	Confident	81.6	Confident	64 Å²	64	72 Å²	72	45%	0.448	38%	0.384	S	S	.	.	H	α-helix	trans	-59.5	-53.5	172.2	-161.7	0	0	0	0	110.1	S130 S131 I136 S137 D138	S130-S134 PolarHBondContact O-N 3.14Å; S131-S134 WeakPolarHBondContact O-CB 3.38Å; S131-S134 PolarHBondContact O-N 3.28Å; S134-I136 VanDerWaalsContact C-N 3.27Å; S134-I136 PolarHBondContact O-N 3.14Å; S134-S137 CarbonylContact O-C 3.52Å; S134-S137 WeakPolarHBondContact O-CA 3.32Å; S134-S137 WeakPolarHBondContact O-CB 3.39Å; S134-S137 PolarHBondContact O-N 2.77Å; S134-D138 PolarHBondContact O-N 2.92Å
135	I	80.7	Confident	81.5	Confident	33 Å²	33	76 Å²	76	17%	0.169	40%	0.404	C	S	.	.	H	α-helix	trans	-60.4	-35.8	-179.5	-70.5	161.3	0	0	0	112.1	S131 L132 D138 V139 L223 F226	S131-I135 WeakPolarHBondContact O-CG1 3.31Å; S131-I135 PolarHBondContact O-N 3.3Å; L132-I135 PolarHBondContact O-N 2.88Å; I135-D138 PolarHBondContact O-N 2.95Å; I135-V139 VanDerWaalsContact O-CG2 3.3Å; I135-V139 WeakPolarHBondContact O-CG2 3.3Å; I135-V139 PolarHBondContact O-N 2.85Å; I135-L223 HydrophobicContact CD1-CD1 4.39Å; I135-L223 HydrophobicContact CG2-CD1 3.72Å; I135-F226 HydrophobicContact CD1-CD1 3.52Å; I135-F226 HydrophobicContact CD1-CE1 3.26Å; I135-F226 HydrophobicContact CD1-CG 4.31Å; I135-F226 HydrophobicContact CD1-CZ 3.89Å
136	I	85.3	Confident	80.8	Confident	75 Å²	75	79.3 Å²	79.3	39%	0.385	42%	0.423	S	S	.	.	H	α-helix	trans	-64.1	-45.2	171.6	-71.4	165	0	0	0	110.7	L132 K133 S134 D138 V139 E140	L132-I136 HydrophobicContact CD1-CD1 4.33Å; L132-I136 HydrophobicContact CG-CD1 3.99Å; L132-I136 WeakPolarHBondContact O-CB 3.37Å; L132-I136 VanDerWaalsContact O-CG1 3.26Å; L132-I136 WeakPolarHBondContact O-CG1 3.35Å; L132-I136 PolarHBondContact O-N 3.33Å; K133-I136 PolarHBondContact O-N 3.18Å; S134-I136 VanDerWaalsContact C-N 3.27Å; S134-I136 PolarHBondContact O-N 3.14Å; I136-D138 VanDerWaalsContact C-N 3.3Å; I136-D138 PolarHBondContact O-N 2.84Å; I136-V139 PolarHBondContact O-N 3.39Å; I136-E140 HydrophobicContact CG2-CG 4.22Å; I136-E140 WeakPolarHBondContact CG2-OE1 3.35Å; I136-E140 WeakPolarHBondContact O-CB 3.46Å; I136-E140 WeakPolarHBondContact O-CG 3.18Å; I136-E140 PolarHBondContact O-N 3.38Å
137	S	87.6	Confident	79.7	Confident	65 Å²	65	75.8 Å²	75.8	46%	0.455	41%	0.406	S	S	.	.	H	α-helix	trans	-64.1	-33.2	176.1	-165	0	0	0	0	113	K133 S134 S141	K133-S137 PolarHBondContact O-N 3.42Å; S134-S137 CarbonylContact O-C 3.52Å; S134-S137 WeakPolarHBondContact O-CA 3.32Å; S134-S137 WeakPolarHBondContact O-CB 3.39Å; S134-S137 PolarHBondContact O-N 2.77Å; S137-S141 WeakPolarHBondContact O-CB 3.47Å; S137-S141 PolarHBondContact O-N 2.96Å; S137-S141 PolarHBondContact O-OG 3.5Å
138	D	81.9	Confident	79.2	Confident	43 Å²	43	74.5 Å²	74.5	23%	0.23	41%	0.407	C	S	.	.	H	α-helix	trans	-71.7	-32	175.9	-59	-25	0	0	0	111.3	S134 I135 I136 S141 M143 Y144	S134-D138 PolarHBondContact O-N 2.92Å; I135-D138 PolarHBondContact O-N 2.95Å; I136-D138 VanDerWaalsContact C-N 3.3Å; I136-D138 PolarHBondContact O-N 2.84Å; D138-S141 WeakPolarHBondContact CA-OG 3.32Å; D138-S141 PolarHBondContact O-OG 2.67Å; D138-M143 WeakPolarHBondContact O-CB 3.44Å; D138-M143 PolarHBondContact O-N 3.45Å; D138-M143 VanDerWaalsContact O-N 3.1Å; D138-Y144 HydrophobicContact CB-CD2 4.17Å; D138-Y144 HydrophobicContact CB-CE2 3.52Å
139	V	80.6	Confident	78.7	Confident	77 Å²	77	78 Å²	78	47%	0.467	43%	0.431	S	S	.	.	H	α-helix	trans	-74	-46.8	170.3	170.5	0	0	0	0	111	I135 I136 S141 G142 Y144	I135-V139 VanDerWaalsContact O-CG2 3.3Å; I135-V139 WeakPolarHBondContact O-CG2 3.3Å; I135-V139 PolarHBondContact O-N 2.85Å; I136-V139 PolarHBondContact O-N 3.39Å; V139-S141 PolarHBondContact O-N 2.83Å; V139-G142 PolarHBondContact O-N 2.97Å; V139-Y144 HydrophobicContact CB-CD2 4.35Å; V139-Y144 HydrophobicContact CG2-CD2 3.46Å; V139-Y144 VanDerWaalsContact CG2-CD2 3.46Å; V139-Y144 HydrophobicContact CG2-CE2 4.07Å; V139-Y144 HydrophobicContact CG2-CG 4.26Å
140	E	82.8	Confident	77.9	Confident	157 Å²	157	75.4 Å²	75.4	73%	0.734	43%	0.428	S	S	*	.	H	α-helix	trans	-63.8	-22.5	178.9	-73.6	174.8	171	0	0	113	I136	I136-E140 HydrophobicContact CG2-CG 4.22Å; I136-E140 WeakPolarHBondContact CG2-OE1 3.35Å; I136-E140 WeakPolarHBondContact O-CB 3.46Å; I136-E140 WeakPolarHBondContact O-CG 3.18Å; I136-E140 PolarHBondContact O-N 3.38Å
141	S	82.9	Confident	77.1	Confident	79 Å²	79	73.6 Å²	73.6	55%	0.552	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.4	5.9	173	55.4	0	0	0	0	114.3	S137 D138 V139 M143	S137-S141 WeakPolarHBondContact O-CB 3.47Å; S137-S141 PolarHBondContact O-N 2.96Å; S137-S141 PolarHBondContact O-OG 3.5Å; D138-S141 WeakPolarHBondContact CA-OG 3.32Å; D138-S141 PolarHBondContact O-OG 2.67Å; V139-S141 PolarHBondContact O-N 2.83Å; S141-M143 VanDerWaalsContact C-N 3.3Å; S141-M143 PolarHBondContact O-N 2.88Å
142	G	77.3	Confident	76.7	Confident	23 Å²	23	76.2 Å²	76.2	24%	0.237	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	7.9	174.2	0	0	0	0	0	115.4	V139 Y144 D145	V139-G142 PolarHBondContact O-N 2.97Å; G142-Y144 PolarHBondContact O-N 3.27Å; G142-Y144 VanDerWaalsContact O-N 3.11Å; G142-D145 WeakPolarHBondContact CA-OD2 3.39Å; G142-D145 WeakPolarHBondContact O-CB 3.39Å; G142-D145 PolarHBondContact O-N 2.7Å
143	M	69.8	Low	76.1	Confident	126 Å²	126	78.4 Å²	78.4	62%	0.621	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-24.7	-178.8	-62.4	-171.9	65.9	0	0	112.8	D138 S141	D138-M143 WeakPolarHBondContact O-CB 3.44Å; D138-M143 PolarHBondContact O-N 3.45Å; D138-M143 VanDerWaalsContact O-N 3.1Å; S141-M143 VanDerWaalsContact C-N 3.3Å; S141-M143 PolarHBondContact O-N 2.88Å
144	Y	67.4	Low	75.3	Confident	25 Å²	25	75 Å²	75	10%	0.098	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	0.1	176.4	-64.5	-74.3	0	0	0	114.6	D138 V139 G142 S146 Q147 L148 L151	D138-Y144 HydrophobicContact CB-CD2 4.17Å; D138-Y144 HydrophobicContact CB-CE2 3.52Å; V139-Y144 HydrophobicContact CB-CD2 4.35Å; V139-Y144 HydrophobicContact CG2-CD2 3.46Å; V139-Y144 VanDerWaalsContact CG2-CD2 3.46Å; V139-Y144 HydrophobicContact CG2-CE2 4.07Å; V139-Y144 HydrophobicContact CG2-CG 4.26Å; G142-Y144 PolarHBondContact O-N 3.27Å; G142-Y144 VanDerWaalsContact O-N 3.11Å; Y144-S146 VanDerWaalsContact C-N 3.32Å; Y144-S146 PolarHBondContact O-N 2.88Å; Y144-Q147 CarbonylContact O-C 3.58Å; Y144-Q147 VanDerWaalsContact O-CA 3.31Å; Y144-Q147 WeakPolarHBondContact O-CA 3.39Å; Y144-Q147 WeakPolarHBondContact O-CB 3.37Å; Y144-Q147 PolarHBondContact O-N 2.88Å; Y144-L148 PolarHBondContact O-N 3.47Å; Y144-L151 HydrophobicContact CD1-CD1 4.29Å; Y144-L151 HydrophobicContact CG-CD1 4.42Å
145	D	73.9	Confident	74.7	Confident	105 Å²	105	77.5 Å²	77.5	56%	0.561	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-60.6	-42.2	-177.6	-70.8	-6.2	0	0	0	111.8	G142 Q147 L148	G142-D145 WeakPolarHBondContact CA-OD2 3.39Å; G142-D145 WeakPolarHBondContact O-CB 3.39Å; G142-D145 PolarHBondContact O-N 2.7Å; D145-Q147 PolarHBondContact O-N 3.35Å; D145-L148 WeakPolarHBondContact O-CB 3.47Å; D145-L148 PolarHBondContact O-N 3.41Å; D145-L148 VanDerWaalsContact O-N 3.09Å
146	S	68.6	Low	74.3	Confident	100 Å²	100	80.1 Å²	80.1	70%	0.699	45%	0.446	S	S	*	.	G	3₁₀ helix	trans	-60.2	-15	172.1	64.1	0	0	0	0	114.3	Y144	Y144-S146 VanDerWaalsContact C-N 3.32Å; Y144-S146 PolarHBondContact O-N 2.88Å
147	Q	64	Low	73.5	Confident	43 Å²	43	79.2 Å²	79.2	20%	0.201	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-111.8	-7.7	179.4	-55.7	-171.9	53.3	0	0	112.5	Y144 D145 T149 N150 L151	Y144-Q147 CarbonylContact O-C 3.58Å; Y144-Q147 VanDerWaalsContact O-CA 3.31Å; Y144-Q147 WeakPolarHBondContact O-CA 3.39Å; Y144-Q147 WeakPolarHBondContact O-CB 3.37Å; Y144-Q147 PolarHBondContact O-N 2.88Å; D145-Q147 PolarHBondContact O-N 3.35Å; Q147-T149 VanDerWaalsContact C-N 3.34Å; Q147-T149 PolarHBondContact O-N 3.47Å; Q147-N150 CarbonylContact O-C 3.6Å; Q147-N150 WeakPolarHBondContact O-CA 3.46Å; Q147-N150 WeakPolarHBondContact O-CB 3.32Å; Q147-N150 PolarHBondContact O-N 3.46Å; Q147-L151 HydrophobicContact CB-CD1 4.32Å; Q147-L151 HydrophobicContact CB-CG 4.33Å; Q147-L151 WeakPolarHBondContact O-CG 3.17Å; Q147-L151 PolarHBondContact O-N 3.31Å
148	L	69.3	Low	72.2	Confident	91 Å²	91	80 Å²	80	48%	0.476	45%	0.445	S	S	.	.	H	α-helix	trans	-56.4	-43.3	-170.4	-178.1	60.5	0	0	0	112.6	Y144 D145 N150 L151 L152	Y144-L148 PolarHBondContact O-N 3.47Å; D145-L148 WeakPolarHBondContact O-CB 3.47Å; D145-L148 PolarHBondContact O-N 3.41Å; D145-L148 VanDerWaalsContact O-N 3.09Å; L148-N150 VanDerWaalsContact C-N 3.28Å; L148-N150 PolarHBondContact O-N 2.9Å; L148-L151 PolarHBondContact O-N 3.03Å; L148-L152 HydrophobicContact CD1-CD1 4.3Å; L148-L152 HydrophobicContact CD1-CG 4.26Å; L148-L152 HydrophobicContact CG-CD1 4.07Å; L148-L152 HydrophobicContact CG-CG 4.49Å; L148-L152 WeakPolarHBondContact O-CB 3.38Å; L148-L152 VanDerWaalsContact O-CG 3.29Å; L148-L152 WeakPolarHBondContact O-CG 3.41Å; L148-L152 PolarHBondContact O-N 3.37Å
149	T	69	Low	71.1	Confident	98 Å²	98	81.1 Å²	81.1	60%	0.601	46%	0.456	S	S	*	.	H	α-helix	trans	-59.7	-37.6	175	-43.2	0	0	0	0	112.4	Q147 N153	Q147-T149 VanDerWaalsContact C-N 3.34Å; Q147-T149 PolarHBondContact O-N 3.47Å; T149-N153 PolarHBondContact O-N 3.03Å; T149-N153 VanDerWaalsContact O-N 3.15Å; T149-N153 PolarHBondContact O-ND2 3.42Å
150	N	65.8	Low	69.6	Low	102 Å²	102	82.9 Å²	82.9	55%	0.545	46%	0.463	S	S	.	.	H	α-helix	trans	-76.1	-38	178.3	-62.2	-68.3	0	0	0	111.6	Q147 L148 N153 V154	Q147-N150 CarbonylContact O-C 3.6Å; Q147-N150 WeakPolarHBondContact O-CA 3.46Å; Q147-N150 WeakPolarHBondContact O-CB 3.32Å; Q147-N150 PolarHBondContact O-N 3.46Å; L148-N150 VanDerWaalsContact C-N 3.28Å; L148-N150 PolarHBondContact O-N 2.9Å; N150-N153 PolarHBondContact O-N 3.23Å; N150-V154 WeakPolarHBondContact O-CG2 3.2Å; N150-V154 PolarHBondContact O-N 3.5Å
151	L	68.6	Low	68.1	Low	37 Å²	37	83.8 Å²	83.8	19%	0.194	47%	0.465	C	S	.	.	H	α-helix	trans	-65.1	-42.5	175.2	-67.7	176.4	0	0	0	111.4	Y144 Q147 L148 V154 M155 L223	Y144-L151 HydrophobicContact CD1-CD1 4.29Å; Y144-L151 HydrophobicContact CG-CD1 4.42Å; Q147-L151 HydrophobicContact CB-CD1 4.32Å; Q147-L151 HydrophobicContact CB-CG 4.33Å; Q147-L151 WeakPolarHBondContact O-CG 3.17Å; Q147-L151 PolarHBondContact O-N 3.31Å; L148-L151 PolarHBondContact O-N 3.03Å; L151-V154 PolarHBondContact O-N 3.33Å; L151-M155 WeakPolarHBondContact O-CB 3.49Å; L151-M155 WeakPolarHBondContact O-CG 3.36Å; L151-M155 PolarHBondContact O-N 3.48Å; L151-L223 HydrophobicContact CD1-CD2 4.37Å; L151-L223 HydrophobicContact CD2-CD2 3.55Å
152	L	74.1	Confident	66.4	Low	81 Å²	81	87.5 Å²	87.5	42%	0.424	47%	0.471	S	S	.	.	H	α-helix	trans	-59.8	-47	172.8	-73.7	168	0	0	0	111.3	L148 V154 M155 N156	L148-L152 HydrophobicContact CD1-CD1 4.3Å; L148-L152 HydrophobicContact CD1-CG 4.26Å; L148-L152 HydrophobicContact CG-CD1 4.07Å; L148-L152 HydrophobicContact CG-CG 4.49Å; L148-L152 WeakPolarHBondContact O-CB 3.38Å; L148-L152 VanDerWaalsContact O-CG 3.29Å; L148-L152 WeakPolarHBondContact O-CG 3.41Å; L148-L152 PolarHBondContact O-N 3.37Å; L152-V154 VanDerWaalsContact C-N 3.31Å; L152-V154 PolarHBondContact O-N 2.9Å; L152-M155 PolarHBondContact O-N 2.91Å; L152-N156 WeakPolarHBondContact O-CB 3.24Å; L152-N156 PolarHBondContact O-N 3.05Å; L152-N156 PolarHBondContact O-ND2 2.9Å; L152-N156 PolarHBondContact O-OD1 3.19Å
153	N	74	Confident	64.8	Low	93 Å²	93	91.9 Å²	91.9	50%	0.497	49%	0.487	S	S	.	.	H	α-helix	trans	-59.6	-40	176.5	-72.1	-13.2	0	0	0	112.7	T149 N150 S157	T149-N153 PolarHBondContact O-N 3.03Å; T149-N153 VanDerWaalsContact O-N 3.15Å; T149-N153 PolarHBondContact O-ND2 3.42Å; N150-N153 PolarHBondContact O-N 3.23Å; N153-S157 WeakPolarHBondContact O-CB 3.44Å; N153-S157 PolarHBondContact O-N 2.9Å; N153-S157 VanDerWaalsContact O-N 3.14Å; N153-S157 PolarHBondContact O-OG 3.23Å
154	V	73.4	Confident	63.1	Low	59 Å²	59	94 Å²	94	36%	0.358	50%	0.495	S	S	.	.	H	α-helix	trans	-69.7	-41.9	175.6	171.2	0	0	0	0	111.7	N150 L151 L152 S157 I158 V224	N150-V154 WeakPolarHBondContact O-CG2 3.2Å; N150-V154 PolarHBondContact O-N 3.5Å; L151-V154 PolarHBondContact O-N 3.33Å; L152-V154 VanDerWaalsContact C-N 3.31Å; L152-V154 PolarHBondContact O-N 2.9Å; V154-S157 WeakPolarHBondContact O-CB 3.34Å; V154-S157 PolarHBondContact O-N 3.25Å; V154-I158 HydrophobicContact CG1-CD1 3.86Å; V154-I158 WeakPolarHBondContact O-CD1 3.07Å; V154-I158 VanDerWaalsContact O-CG1 3.28Å; V154-I158 WeakPolarHBondContact O-CG1 3.22Å; V154-I158 PolarHBondContact O-N 3.11Å; V154-I158 VanDerWaalsContact O-N 3.07Å; V154-V224 HydrophobicContact CG1-CG2 4.09Å
155	M	71.9	Confident	61.5	Low	116 Å²	116	97.4 Å²	97.4	57%	0.571	52%	0.52	S	S	*	.	H	α-helix	trans	-64.6	-44.3	177.7	-76.3	176	59	0	0	111.9	L151 L152 S157 I158 S159	L151-M155 WeakPolarHBondContact O-CB 3.49Å; L151-M155 WeakPolarHBondContact O-CG 3.36Å; L151-M155 PolarHBondContact O-N 3.48Å; L152-M155 PolarHBondContact O-N 2.91Å; M155-S157 VanDerWaalsContact C-N 3.35Å; M155-S157 PolarHBondContact O-N 2.92Å; M155-I158 WeakPolarHBondContact O-CB 3.47Å; M155-I158 PolarHBondContact O-N 2.63Å; M155-I158 VanDerWaalsContact O-N 3.07Å; M155-S159 PolarHBondContact O-N 2.81Å; M155-S159 PolarHBondContact O-OG 2.67Å
156	N	71.9	Confident	59.7	Low	87 Å²	87	100.8 Å²	100.8	47%	0.465	53%	0.533	S	S	.	.	H	α-helix	trans	-59.4	-46.6	176.5	-67.1	-7.3	0	0	0	110.6	L152 I158 S159 D160	L152-N156 WeakPolarHBondContact O-CB 3.24Å; L152-N156 PolarHBondContact O-N 3.05Å; L152-N156 PolarHBondContact O-ND2 2.9Å; L152-N156 PolarHBondContact O-OD1 3.19Å; N156-I158 VanDerWaalsContact C-N 3.25Å; N156-I158 PolarHBondContact O-N 2.86Å; N156-S159 WeakPolarHBondContact CA-OG 3.4Å; N156-S159 PolarHBondContact O-N 2.86Å; N156-S159 VanDerWaalsContact O-N 3.12Å; N156-S159 PolarHBondContact O-OG 3.07Å; N156-D160 VanDerWaalsContact O-CG 3.3Å; N156-D160 PolarHBondContact O-N 3.49Å; N156-D160 VanDerWaalsContact O-N 3.13Å
157	S	68.4	Low	58.2	Low	57 Å²	57	100.6 Å²	100.6	40%	0.399	53%	0.527	S	S	.	.	H	α-helix	trans	-56.4	-38.8	174	-56.2	0	0	0	0	112.4	N153 V154 M155 D160 F161	N153-S157 WeakPolarHBondContact O-CB 3.44Å; N153-S157 PolarHBondContact O-N 2.9Å; N153-S157 VanDerWaalsContact O-N 3.14Å; N153-S157 PolarHBondContact O-OG 3.23Å; V154-S157 WeakPolarHBondContact O-CB 3.34Å; V154-S157 PolarHBondContact O-N 3.25Å; M155-S157 VanDerWaalsContact C-N 3.35Å; M155-S157 PolarHBondContact O-N 2.92Å; S157-D160 PolarHBondContact O-N 2.93Å; S157-F161 WeakPolarHBondContact O-CD2 3.39Å; S157-F161 PolarHBondContact O-N 3.28Å
158	I	61.9	Low	57	Low	82 Å²	82	105.7 Å²	105.7	42%	0.421	56%	0.555	S	S	.	*	H	α-helix	trans	-71.7	-32.7	179.5	-69.7	164.9	0	0	0	112.1	V154 M155 N156	V154-I158 HydrophobicContact CG1-CD1 3.86Å; V154-I158 WeakPolarHBondContact O-CD1 3.07Å; V154-I158 VanDerWaalsContact O-CG1 3.28Å; V154-I158 WeakPolarHBondContact O-CG1 3.22Å; V154-I158 PolarHBondContact O-N 3.11Å; V154-I158 VanDerWaalsContact O-N 3.07Å; M155-I158 WeakPolarHBondContact O-CB 3.47Å; M155-I158 PolarHBondContact O-N 2.63Å; M155-I158 VanDerWaalsContact O-N 3.07Å; N156-I158 VanDerWaalsContact C-N 3.25Å; N156-I158 PolarHBondContact O-N 2.86Å
159	S	57.6	Low	55.3	Low	65 Å²	65	108.4 Å²	108.4	46%	0.455	57%	0.57	S	S	.	*	H	α-helix	trans	-65.7	-39.7	171	29.2	0	0	0	0	112.5	M155 N156 K162	M155-S159 PolarHBondContact O-N 2.81Å; M155-S159 PolarHBondContact O-OG 2.67Å; N156-S159 WeakPolarHBondContact CA-OG 3.4Å; N156-S159 PolarHBondContact O-N 2.86Å; N156-S159 VanDerWaalsContact O-N 3.12Å; N156-S159 PolarHBondContact O-OG 3.07Å; S159-K162 PolarHBondContact O-N 3.35Å; S159-K162 VanDerWaalsContact O-N 3.15Å
160	D	50	Low	53.7	Low	114 Å²	114	107.2 Å²	107.2	61%	0.61	58%	0.577	S	S	*	*	H	α-helix	trans	-65.1	-43.6	-177.4	-61.8	-27.6	0	0	0	111.8	N156 S157 K162 M163	N156-D160 VanDerWaalsContact O-CG 3.3Å; N156-D160 PolarHBondContact O-N 3.49Å; N156-D160 VanDerWaalsContact O-N 3.13Å; S157-D160 PolarHBondContact O-N 2.93Å; D160-K162 PolarHBondContact O-N 2.75Å; D160-M163 PolarHBondContact O-N 3.09Å
161	F	50.3	Low	52.1	Low	177 Å²	177	110.5 Å²	110.5	78%	0.776	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.8	-10	176.2	-72.4	-61	0	0	0	114.6	S157	S157-F161 WeakPolarHBondContact O-CD2 3.39Å; S157-F161 PolarHBondContact O-N 3.28Å
162	K	48.4	Very low	50.3	Low	156 Å²	156	117.9 Å²	117.9	68%	0.678	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.7	0.2	179.8	-156.8	174	176.5	-176.3	0	113.8	S159 D160	S159-K162 PolarHBondContact O-N 3.35Å; S159-K162 VanDerWaalsContact O-N 3.15Å; D160-K162 PolarHBondContact O-N 2.75Å
163	M	43.3	Very low	48.6	Very low	116 Å²	116	118.2 Å²	118.2	57%	0.571	63%	0.625	S	S	*	*			trans	-104.1	8.9	-176.3	-68.2	-72.4	93.5	0	0	115.2	D160 P165 K777	D160-M163 PolarHBondContact O-N 3.09Å; M163-P165 WeakPolarHBondContact O-CD 3.49Å; M163-K777 PolarHBondContact SD-NZ 2.95Å
164	Q	33	Very low	46.6	Very low	169 Å²	169	122.7 Å²	122.7	79%	0.79	64%	0.643	S	S	*	*			trans	-93.6	103.4	169.7	-72.2	-70.9	-9.5	0	0	110.4
165	P	35.2	Very low	44.6	Very low	97 Å²	97	126.1 Å²	126.1	63%	0.63	67%	0.665	S	S	*	*			trans	-72	123.2	162.9	30.5	-31.7	0	0	0	108.8	M163 V167	M163-P165 WeakPolarHBondContact O-CD 3.49Å; P165-V167 VanDerWaalsContact C-N 3.34Å; P165-V167 HydrophobicContact CG-CG2 4.45Å; P165-V167 PolarHBondContact O-N 3.32Å
166	E	34.6	Very low	42.6	Very low	176 Å²	176	125.5 Å²	125.5	82%	0.822	68%	0.678	S	S	*	*			trans	-75.5	88.2	175.6	-169	168.7	-146.1	0	0	109.4	L168	E166-L168 PolarHBondContact O-N 2.87Å
167	V	37.1	Very low	40.8	Very low	97 Å²	97	126.3 Å²	126.3	59%	0.588	70%	0.696	S	S	*	*			trans	-72.1	93.9	-179.1	180	0	0	0	0	109.9	P165 D169	P165-V167 VanDerWaalsContact C-N 3.34Å; P165-V167 HydrophobicContact CG-CG2 4.45Å; P165-V167 PolarHBondContact O-N 3.32Å; V167-D169 HydrophobicContact CG1-CB 4.16Å; V167-D169 WeakPolarHBondContact CG1-OD2 3.3Å
168	L	40.3	Very low	39	Very low	149 Å²	149	129.3 Å²	129.3	78%	0.78	72%	0.718	S	S	*	*			trans	-98	68.4	165.6	-73.3	176.2	0	0	0	110.4	E166 G170	E166-L168 PolarHBondContact O-N 2.87Å; L168-G170 PolarHBondContact O-N 3.01Å
169	D	32.6	Very low	37.8	Very low	148 Å²	148	130.4 Å²	130.4	79%	0.791	73%	0.73	S	S	*	*			trans	-69.8	82.1	167.7	-75.1	-26.7	0	0	0	109.8	V167 E171	V167-D169 HydrophobicContact CG1-CB 4.16Å; V167-D169 WeakPolarHBondContact CG1-OD2 3.3Å; D169-E171 PolarHBondContact O-N 2.8Å
170	G	35.1	Very low	36.8	Very low	73 Å²	73	134.2 Å²	134.2	75%	0.753	75%	0.745	S	S	*	*			trans	-93.1	69.1	178	0	0	0	0	0	112.5	L168 F172	L168-G170 PolarHBondContact O-N 3.01Å; G170-F172 PolarHBondContact O-N 3.28Å
171	E	32.6	Very low	36.1	Very low	172 Å²	172	136.3 Å²	136.3	80%	0.804	76%	0.757	S	S	*	*			trans	-60.4	121	178.4	-172.9	-177.9	168.2	0	0	111.7	D169 V173	D169-E171 PolarHBondContact O-N 2.8Å; E171-V173 HydrophobicContact CG-CG2 4.2Å; E171-V173 VanDerWaalsContact OE1-CG2 3.31Å; E171-V173 WeakPolarHBondContact OE1-CG2 3.19Å
172	F	30.7	Very low	35.2	Very low	191 Å²	191	135.4 Å²	135.4	84%	0.838	76%	0.76	S	S	*	*			trans	-126.3	95.6	167.9	-166.1	-97.6	0	0	0	111.4	G170	G170-F172 PolarHBondContact O-N 3.28Å
173	V	37.8	Very low	34.5	Very low	88 Å²	88	135.9 Å²	135.9	53%	0.533	77%	0.769	S	S	.	*			trans	-62.9	130	176.9	175.2	0	0	0	0	110.8	E171 T175	E171-V173 HydrophobicContact CG-CG2 4.2Å; E171-V173 VanDerWaalsContact OE1-CG2 3.31Å; E171-V173 WeakPolarHBondContact OE1-CG2 3.19Å; V173-T175 PolarHBondContact O-N 3.01Å
174	Q	31.7	Very low	33.8	Very low	188 Å²	188	134.7 Å²	134.7	88%	0.879	77%	0.772	S	S	*	*			trans	-70.7	121	168.4	-67.1	179.7	-62.2	0	0	110.2
175	T	33.1	Very low	33.8	Very low	131 Å²	131	136.1 Å²	136.1	80%	0.804	78%	0.778	S	S	*	*			trans	-128.6	130.6	163.4	-62.3	0	0	0	0	108.5	V173	V173-T175 PolarHBondContact O-N 3.01Å
176	A	28.6	Very low	33.4	Very low	102 Å²	102	140.2 Å²	140.2	84%	0.843	79%	0.789	S	S	*	*			trans	-96.1	134.2	-173	0	0	0	0	0	112.3
177	A	34.5	Very low	33.3	Very low	104 Å²	104	139.3 Å²	139.3	86%	0.86	79%	0.785	S	S	*	*			trans	-147.7	151.9	164.8	0	0	0	0	0	109.7
178	S	31.3	Very low	32.7	Very low	121 Å²	121	140.8 Å²	140.8	85%	0.846	79%	0.794	S	S	*	*			trans	-77.6	159.9	-170.1	-88.4	0	0	0	0	114.9
179	P	36.6	Very low	32.3	Very low	104 Å²	104	141.4 Å²	141.4	68%	0.675	79%	0.791	S	S	*	*			trans	-84.8	165.5	-177.3	36.5	-38	0	0	0	113.4
180	N	36	Very low	32.2	Very low	145 Å²	145	138.8 Å²	138.8	78%	0.775	79%	0.79	S	S	*	*				178.1	122.3	129.9	-90.4	-18.6	0	0	0	111.6
181	N	36.3	Very low	32	Very low	159 Å²	159	142.6 Å²	142.6	85%	0.85	79%	0.788	S	S	*	*			trans	154.9	134.2	133	-80	-13	0	0	0	111.9
182	D	30.8	Very low	31.9	Very low	158 Å²	158	141.6 Å²	141.6	85%	0.845	79%	0.788	S	S	*	*			trans	-70.5	149.6	169.1	-53.9	-88.9	0	0	0	111.7
183	L	32.5	Very low	32	Very low	165 Å²	165	136.4 Å²	136.4	86%	0.864	77%	0.769	S	S	*	*				-173.4	164.3	97.5	-161.2	53.1	0	0	0	110.9
184	S	28.6	Very low	31.9	Very low	92 Å²	92	135.8 Å²	135.8	64%	0.643	77%	0.773	S	S	*	*			trans	-70.2	139.4	-173.8	57.3	0	0	0	0	115.1
185	H	33.3	Very low	32.1	Very low	198 Å²	198	131 Å²	131	92%	0.917	76%	0.76	S	S	*	*			trans	-145.3	153.5	140.9	-94.3	-70	0	0	0	111.4
186	Q	27.5	Very low	32.4	Very low	184 Å²	184	128.5 Å²	128.5	86%	0.86	75%	0.748	S	S	*	*			trans	-74.3	149.5	174.1	-62.9	165.8	-13.6	0	0	110
187	Q	32.3	Very low	32.7	Very low	157 Å²	157	129.1 Å²	129.1	73%	0.734	73%	0.734	S	S	*	*			trans	-137.8	100.1	160.2	-152.6	169.2	22.9	0	0	111.8	F189	Q187-F189 HydrophobicContact CB-CE2 4.2Å; Q187-F189 HydrophobicContact CG-CD2 4.12Å; Q187-F189 HydrophobicContact CG-CE2 3.5Å; Q187-F189 HydrophobicContact CG-CZ 3.83Å
188	T	24.6	Very low	32.7	Very low	127 Å²	127	129.4 Å²	129.4	78%	0.779	72%	0.72	S	S	*	*			trans	-67.2	133.7	167.1	-37.2	0	0	0	0	109.1
189	F	31.2	Very low	32.9	Very low	163 Å²	163	127.8 Å²	127.8	72%	0.715	70%	0.699	S	S	*	*			trans	-128	141.2	167.1	-80.1	-69.2	0	0	0	110.1	Q187	Q187-F189 HydrophobicContact CB-CE2 4.2Å; Q187-F189 HydrophobicContact CG-CD2 4.12Å; Q187-F189 HydrophobicContact CG-CE2 3.5Å; Q187-F189 HydrophobicContact CG-CZ 3.83Å
190	A	32.1	Very low	33	Very low	93 Å²	93	125.1 Å²	125.1	77%	0.769	68%	0.683	S	S	*	*			trans	-81.9	164	-159.4	0	0	0	0	0	114.7
191	E	29.8	Very low	33	Very low	152 Å²	152	122.6 Å²	122.6	71%	0.71	67%	0.665	S	S	*	*			trans	-67.4	148.4	177.5	-61.9	173	108.8	0	0	112.6	R13	R13-E191 IonicContact NH1-OE1 3.75Å
192	N	31.2	Very low	33.3	Very low	152 Å²	152	119.8 Å²	119.8	81%	0.813	65%	0.647	S	S	*	*			trans	-128.1	70.9	165	-85.7	-70.9	0	0	0	108.3	A194	N192-A194 PolarHBondContact O-N 3.03Å; N192-A194 VanDerWaalsContact O-N 3.13Å
193	D	32.7	Very low	33.7	Very low	82 Å²	82	118.3 Å²	118.3	44%	0.439	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.3	4.5	-159.2	-145.8	26.9	0	0	0	115.2	R13	R13-D193 IonicContact CZ-OD1 3.53Å; R13-D193 VanDerWaalsContact CZ-OD1 3.27Å; R13-D193 IonicContact CZ-OD2 3.56Å; R13-D193 IonicContact NE-OD1 3.76Å; R13-D193 IonicContact NH1-OD1 2.76Å; R13-D193 PolarHBondContact NH1-OD1 2.95Å; R13-D193 IonicContact NH1-OD2 3.77Å; R13-D193 PolarHBondContact NH1-OD2 3.13Å; R13-D193 IonicContact NH2-OD1 2.75Å; R13-D193 IonicContact NH2-OD2 3.48Å; R13-D193 PolarHBondContact NH2-OD2 3.17Å
194	A	35	Very low	34	Very low	74 Å²	74	116.1 Å²	116.1	61%	0.612	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	-26	-174.3	0	0	0	0	0	115	N192	N192-A194 PolarHBondContact O-N 3.03Å; N192-A194 VanDerWaalsContact O-N 3.13Å
195	S	36.1	Very low	34.6	Very low	88 Å²	88	116.5 Å²	116.5	62%	0.615	62%	0.619	S	S	*	*	H	α-helix	trans	-80.3	-25.3	-163.6	-64.8	0	0	0	0	115.4
196	S	38.4	Very low	34.6	Very low	79 Å²	79	108.8 Å²	108.8	55%	0.552	59%	0.587	S	S	*	*	H	α-helix	trans	-79.8	-31.9	-177.4	-74.9	0	0	0	0	113.6	L198	S196-L198 VanDerWaalsContact C-N 3.33Å; S196-L198 PolarHBondContact O-N 3.21Å
197	E	35.2	Very low	35.1	Very low	115 Å²	115	102.8 Å²	102.8	54%	0.537	57%	0.566	S	S	.	*	H	α-helix	trans	-75.2	-24.1	-177.5	-142.9	-152.8	169.5	0	0	112.7	S200 K201	E197-S200 PolarHBondContact O-OG 3.42Å; E197-S200 VanDerWaalsContact O-OG 3.07Å; E197-K201 WeakPolarHBondContact O-CG 3.3Å; E197-K201 PolarHBondContact O-N 2.89Å; E197-K201 WeakPolarHBondContact OE1-CE 3.5Å; E197-K201 IonicContact OE1-NZ 2.78Å; E197-K201 PolarHBondContact OE1-NZ 2.87Å; E197-K201 IonicContact OE2-NZ 2.69Å; E197-K201 PolarHBondContact OE2-NZ 3.24Å
198	L	34.5	Very low	35.5	Very low	109 Å²	109	101.6 Å²	101.6	57%	0.571	56%	0.564	S	S	*	*	H	α-helix	trans	-63.5	-41.7	175.4	-83.4	162.4	0	0	0	112.3	S196 K201 Q202	S196-L198 VanDerWaalsContact C-N 3.33Å; S196-L198 PolarHBondContact O-N 3.21Å; L198-K201 PolarHBondContact O-N 3.35Å; L198-Q202 WeakPolarHBondContact O-CB 3.38Å; L198-Q202 WeakPolarHBondContact O-CG 3.43Å; L198-Q202 PolarHBondContact O-N 3.35Å
199	Q	36.7	Very low	36.3	Very low	88 Å²	88	103 Å²	103	41%	0.411	56%	0.56	S	S	.	*	H	α-helix	trans	-72.4	-33.1	-175.5	-66	-168	0.1	0	0	113.4	Y19 L203	Y19-Q199 VanDerWaalsContact N-OE1 3.12Å; Q199-L203 PolarHBondContact O-N 2.83Å
200	S	37.2	Very low	37	Very low	48 Å²	48	100.7 Å²	100.7	34%	0.336	55%	0.554	S	S	.	*	H	α-helix	trans	-72.3	-32.7	173.9	59.1	0	0	0	0	112.3	E197 N204	E197-S200 PolarHBondContact O-OG 3.42Å; E197-S200 VanDerWaalsContact O-OG 3.07Å; S200-N204 PolarHBondContact O-ND2 2.92Å
201	K	38	Very low	37.1	Very low	91 Å²	91	102 Å²	102	40%	0.396	55%	0.553	S	S	.	*	H	α-helix	trans	-69	-43.8	170.6	-72.4	171.9	179.4	172.1	0	111.6	E197 L198 L203 N204 Q205	E197-K201 WeakPolarHBondContact O-CG 3.3Å; E197-K201 PolarHBondContact O-N 2.89Å; E197-K201 WeakPolarHBondContact OE1-CE 3.5Å; E197-K201 IonicContact OE1-NZ 2.78Å; E197-K201 PolarHBondContact OE1-NZ 2.87Å; E197-K201 IonicContact OE2-NZ 2.69Å; E197-K201 PolarHBondContact OE2-NZ 3.24Å; L198-K201 PolarHBondContact O-N 3.35Å; K201-L203 PolarHBondContact O-N 2.86Å; K201-N204 PolarHBondContact O-N 2.92Å; K201-N204 VanDerWaalsContact O-N 3.1Å; K201-Q205 WeakPolarHBondContact O-CG 3.47Å; K201-Q205 PolarHBondContact O-N 3.48Å
202	Q	41.2	Very low	37.6	Very low	101 Å²	101	100.7 Å²	100.7	47%	0.472	56%	0.555	S	S	.	*	H	α-helix	trans	-56	-46.6	179.1	-72.1	-93.2	-81.5	0	0	112.9	L198 N204 Q205	L198-Q202 WeakPolarHBondContact O-CB 3.38Å; L198-Q202 WeakPolarHBondContact O-CG 3.43Å; L198-Q202 PolarHBondContact O-N 3.35Å; Q202-N204 PolarHBondContact O-N 3.47Å; Q202-N204 VanDerWaalsContact O-N 3.15Å; Q202-Q205 VanDerWaalsContact NE2-OE1 3.12Å; Q202-Q205 PolarHBondContact O-N 3.01Å; Q202-Q205 VanDerWaalsContact O-N 3.15Å
203	L	39.7	Very low	37.8	Very low	127 Å²	127	102.1 Å²	102.1	67%	0.665	56%	0.557	S	S	*	*	H	α-helix	trans	-64.4	-18.9	179.5	-83.7	170	0	0	0	114.4	Q199 K201	Q199-L203 PolarHBondContact O-N 2.83Å; K201-L203 PolarHBondContact O-N 2.86Å
204	N	39.6	Very low	37.8	Very low	119 Å²	119	106.4 Å²	106.4	64%	0.636	58%	0.58	S	S	*	*	H	α-helix	trans	-98.7	-24	173.8	-71	-53.5	0	0	0	113	S200 K201 Q202 C206 S207	S200-N204 PolarHBondContact O-ND2 2.92Å; K201-N204 PolarHBondContact O-N 2.92Å; K201-N204 VanDerWaalsContact O-N 3.1Å; Q202-N204 PolarHBondContact O-N 3.47Å; Q202-N204 VanDerWaalsContact O-N 3.15Å; N204-C206 VanDerWaalsContact C-N 3.31Å; N204-C206 PolarHBondContact O-N 3.43Å; N204-S207 PolarHBondContact O-N 3.25Å
205	Q	40.2	Very low	37.8	Very low	99 Å²	99	106.7 Å²	106.7	46%	0.463	57%	0.571	S	S	.	*	H	α-helix	trans	-64.5	-29.7	-178.3	-84.7	173.7	-21.9	0	0	113.7	K201 Q202 S207 N208	K201-Q205 WeakPolarHBondContact O-CG 3.47Å; K201-Q205 PolarHBondContact O-N 3.48Å; Q202-Q205 VanDerWaalsContact NE2-OE1 3.12Å; Q202-Q205 PolarHBondContact O-N 3.01Å; Q202-Q205 VanDerWaalsContact O-N 3.15Å; Q205-S207 PolarHBondContact O-N 2.96Å; Q205-N208 PolarHBondContact O-N 3.19Å
206	C	33.3	Very low	38.2	Very low	36 Å²	36	107.8 Å²	107.8	24%	0.243	58%	0.576	C	S	.	*	T	Hydrogen-bonded Turn	trans	-67	18.8	175.2	-51.8	0	0	0	0	114.7	R127 Y128 N204 E229	R127-C206 PolarHBondContact NH1-O 2.89Å; Y128-C206 PolarHBondContact OH-SG 3.39Å; N204-C206 VanDerWaalsContact C-N 3.31Å; N204-C206 PolarHBondContact O-N 3.43Å; C206-E229 PolarHBondContact SG-OE1 2.9Å; C206-E229 VanDerWaalsContact SG-OE1 3.39Å
207	S	38.5	Very low	38.4	Very low	59 Å²	59	109 Å²	109	41%	0.413	58%	0.58	S	S	.	*	T	Hydrogen-bonded Turn	trans	-119.5	-15.7	168.6	-57.8	0	0	0	0	114.1	R127 N204 Q205	R127-S207 PolarHBondContact NH1-OG 3.2Å; N204-S207 PolarHBondContact O-N 3.25Å; Q205-S207 PolarHBondContact O-N 2.96Å
208	N	40.6	Very low	39	Very low	132 Å²	132	107.9 Å²	107.9	71%	0.706	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.5	-8	-161.2	-66.3	18.5	0	0	0	115.2	Q205	Q205-N208 PolarHBondContact O-N 3.19Å
209	K	42	Very low	39.9	Very low	156 Å²	156	106.1 Å²	106.1	68%	0.678	57%	0.569	S	S	*	*	S	Bend	trans	-106.6	0.2	-179.3	-148	-167	176.9	-166	0	113.9	E225	K209-E225 IonicContact NZ-OE2 2.72Å; K209-E225 PolarHBondContact NZ-OE2 3.42Å
210	L	44.5	Very low	40.6	Very low	115 Å²	115	109 Å²	109	60%	0.602	58%	0.58	S	S	*	*	S	Bend	trans	-105.7	17	-169.4	-152.5	74.6	0	0	0	113.8
211	T	35.8	Very low	41.3	Very low	120 Å²	120	113.4 Å²	113.4	74%	0.736	60%	0.595	S	S	*	*			trans	-136.9	30.1	-174.5	59.4	0	0	0	0	112.5
212	T	38.5	Very low	42.6	Very low	124 Å²	124	111.7 Å²	111.7	76%	0.761	60%	0.595	S	S	*	*			trans	-91.3	135.4	170.6	-51.2	0	0	0	0	109.1
213	E	35.3	Very low	43.7	Very low	182 Å²	182	107.7 Å²	107.7	85%	0.85	58%	0.577	S	S	*	*			trans	-68.5	164.1	-165.5	-65.2	175.8	108.5	0	0	115.3	N215	E213-N215 PolarHBondContact O-N 3.1Å
214	N	33.9	Very low	44.9	Very low	172 Å²	172	103.4 Å²	103.4	92%	0.92	56%	0.555	S	S	*	*			trans	-60.5	112.8	-173.7	-61	-48.8	0	0	0	112.8
215	N	34.5	Very low	46.3	Very low	81 Å²	81	102.9 Å²	102.9	43%	0.433	55%	0.549	S	S	.	.			trans	-128.4	116.6	159.6	-173.7	-39.8	0	0	0	108.9	E213 V217 N218	E213-N215 PolarHBondContact O-N 3.1Å; N215-V217 PolarHBondContact O-N 2.81Å; N215-V217 PolarHBondContact OD1-N 2.83Å; N215-V217 VanDerWaalsContact OD1-N 3.16Å; N215-N218 PolarHBondContact O-N 2.94Å
216	P	44.7	Very low	47.7	Very low	111 Å²	111	99 Å²	99	72%	0.721	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-17.6	-170.6	25.3	-34.8	0	0	0	114.1
217	V	42.4	Very low	49.3	Very low	104 Å²	104	103.7 Å²	103.7	63%	0.63	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-29.2	177.4	-174.4	0	0	0	0	112	N215	N215-V217 PolarHBondContact O-N 2.81Å; N215-V217 PolarHBondContact OD1-N 2.83Å; N215-V217 VanDerWaalsContact OD1-N 3.16Å
218	N	49	Very low	50.8	Low	92 Å²	92	106.8 Å²	106.8	49%	0.492	55%	0.55	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-17.6	-173.8	-70.9	-8.4	0	0	0	113.9	N215 K220 Q221 S222	N215-N218 PolarHBondContact O-N 2.94Å; N218-K220 PolarHBondContact O-N 3.49Å; N218-K220 VanDerWaalsContact O-N 3.09Å; N218-Q221 PolarHBondContact O-N 3.17Å; N218-Q221 VanDerWaalsContact O-N 3.09Å; N218-S222 PolarHBondContact O-N 3.39Å
219	N	51.9	Low	52.1	Low	72 Å²	72	103.9 Å²	103.9	39%	0.385	53%	0.532	S	S	.	.	H	α-helix	trans	-63.5	-19.2	-175.4	-85.9	-1	0	0	0	114.6	Q221 S222	N219-Q221 VanDerWaalsContact C-N 3.26Å; N219-Q221 PolarHBondContact O-N 3.32Å; N219-S222 WeakPolarHBondContact CA-OG 3.35Å; N219-S222 PolarHBondContact O-OG 2.69Å; N219-S222 VanDerWaalsContact O-OG 3.13Å
220	K	51.3	Low	53.2	Low	149 Å²	149	97.5 Å²	97.5	65%	0.648	51%	0.505	S	S	*	.	H	α-helix	trans	-62.4	-32.9	174.5	-63.6	-178.7	179.7	-178.8	0	112.9	N218	N218-K220 PolarHBondContact O-N 3.49Å; N218-K220 VanDerWaalsContact O-N 3.09Å
221	Q	53.5	Low	54.2	Low	140 Å²	140	98.1 Å²	98.1	65%	0.654	51%	0.505	S	S	*	.	H	α-helix	trans	-95.4	-32.9	-177.9	-72.6	165.1	-13.9	0	0	111.6	N218 N219 L223 V224 E225	N218-Q221 PolarHBondContact O-N 3.17Å; N218-Q221 VanDerWaalsContact O-N 3.09Å; N219-Q221 VanDerWaalsContact C-N 3.26Å; N219-Q221 PolarHBondContact O-N 3.32Å; Q221-L223 PolarHBondContact O-N 3.17Å; Q221-V224 PolarHBondContact O-N 2.8Å; Q221-E225 WeakPolarHBondContact O-CB 3.31Å; Q221-E225 WeakPolarHBondContact O-CG 3.18Å; Q221-E225 PolarHBondContact O-N 2.91Å
222	S	64.5	Low	55.6	Low	55 Å²	55	99.6 Å²	99.6	39%	0.385	50%	0.501	S	S	.	.	H	α-helix	trans	-58.8	-45.8	178.9	66.1	0	0	0	0	112.1	N218 N219 V224 F226	N218-S222 PolarHBondContact O-N 3.39Å; N219-S222 WeakPolarHBondContact CA-OG 3.35Å; N219-S222 PolarHBondContact O-OG 2.69Å; N219-S222 VanDerWaalsContact O-OG 3.13Å; S222-V224 PolarHBondContact O-N 2.86Å; S222-F226 WeakPolarHBondContact O-CB 3.39Å; S222-F226 PolarHBondContact O-N 3.44Å
223	L	64	Low	56.6	Low	17 Å²	17	97.3 Å²	97.3	9%	0.089	48%	0.481	C	S	.	.	H	α-helix	trans	-64.3	-38.3	179.9	-161	89.6	0	0	0	112.7	I135 L151 Q221 F226 W227	I135-L223 HydrophobicContact CD1-CD1 4.39Å; I135-L223 HydrophobicContact CG2-CD1 3.72Å; L151-L223 HydrophobicContact CD1-CD2 4.37Å; L151-L223 HydrophobicContact CD2-CD2 3.55Å; Q221-L223 PolarHBondContact O-N 3.17Å; L223-F226 PolarHBondContact O-N 3.27Å; L223-W227 VanDerWaalsContact O-CD1 3.25Å; L223-W227 PolarHBondContact O-N 3.26Å
224	V	66.1	Low	57.5	Low	36 Å²	36	95.9 Å²	95.9	22%	0.218	47%	0.468	C	S	.	.	H	α-helix	trans	-78.8	-36.7	-178	-177.9	0	0	0	0	111.9	V154 Q221 S222 K228	V154-V224 HydrophobicContact CG1-CG2 4.09Å; Q221-V224 PolarHBondContact O-N 2.8Å; S222-V224 PolarHBondContact O-N 2.86Å; V224-K228 WeakPolarHBondContact O-CG 3.37Å; V224-K228 PolarHBondContact O-N 3Å; V224-K228 VanDerWaalsContact O-N 3.17Å
225	E	68.6	Low	58.4	Low	108 Å²	108	93.4 Å²	93.4	51%	0.505	45%	0.451	S	S	.	.	H	α-helix	trans	-61.4	-45.3	167.4	-71	-114.4	109.1	0	0	110.3	K209 Q221 K228 E229	K209-E225 IonicContact NZ-OE2 2.72Å; K209-E225 PolarHBondContact NZ-OE2 3.42Å; Q221-E225 WeakPolarHBondContact O-CB 3.31Å; Q221-E225 WeakPolarHBondContact O-CG 3.18Å; Q221-E225 PolarHBondContact O-N 2.91Å; E225-K228 CarbonylContact O-C 3.6Å; E225-K228 WeakPolarHBondContact O-CB 3.25Å; E225-K228 PolarHBondContact O-N 2.84Å; E225-K228 VanDerWaalsContact O-N 3.15Å; E225-E229 PolarHBondContact O-N 2.9Å
226	F	68.9	Low	59.3	Low	18 Å²	18	93.3 Å²	93.3	8%	0.079	45%	0.45	C	S	.	.	H	α-helix	trans	-63.4	-41.3	179.1	-178	-110	0	0	0	112.4	Y128 I135 S222 L223 K228 E229 I230	Y128-F226 HydrophobicContact CD1-CE2 4.39Å; I135-F226 HydrophobicContact CD1-CD1 3.52Å; I135-F226 HydrophobicContact CD1-CE1 3.26Å; I135-F226 HydrophobicContact CD1-CG 4.31Å; I135-F226 HydrophobicContact CD1-CZ 3.89Å; S222-F226 WeakPolarHBondContact O-CB 3.39Å; S222-F226 PolarHBondContact O-N 3.44Å; L223-F226 PolarHBondContact O-N 3.27Å; F226-K228 VanDerWaalsContact C-N 3.33Å; F226-K228 PolarHBondContact O-N 2.85Å; F226-E229 CarbonylContact O-C 3.41Å; F226-E229 PolarHBondContact O-N 2.76Å; F226-I230 HydrophobicContact CD1-CD1 3.65Å; F226-I230 HydrophobicContact CD1-CG1 4.38Å; F226-I230 HydrophobicContact CE1-CD1 3.39Å; F226-I230 HydrophobicContact CE1-CG1 4.18Å; F226-I230 HydrophobicContact CG-CD1 4.39Å; F226-I230 HydrophobicContact CZ-CD1 3.94Å; F226-I230 HydrophobicContact CZ-CG1 4.3Å; F226-I230 WeakPolarHBondContact O-CB 3.3Å; F226-I230 WeakPolarHBondContact O-CG1 3.21Å; F226-I230 PolarHBondContact O-N 3.4Å
227	W	66.5	Low	59.6	Low	134 Å²	134	89.3 Å²	89.3	51%	0.508	42%	0.424	S	S	.	.	H	α-helix	trans	-63.1	-36.7	172.4	-88.9	115.4	0	0	0	112.9	L223 I230 Q231	L223-W227 VanDerWaalsContact O-CD1 3.25Å; L223-W227 PolarHBondContact O-N 3.26Å; W227-I230 HydrophobicContact CD2-CD1 4.28Å; W227-I230 HydrophobicContact CE3-CB 4.34Å; W227-I230 HydrophobicContact CE3-CD1 3.97Å; W227-I230 HydrophobicContact CE3-CG2 4.09Å; W227-I230 HydrophobicContact CZ3-CD1 4.23Å; W227-I230 HydrophobicContact CZ3-CG2 4.13Å; W227-Q231 PolarHBondContact O-N 3.25Å
228	K	70.6	Confident	59.8	Low	125 Å²	125	86.9 Å²	86.9	54%	0.543	41%	0.407	S	S	.	.	H	α-helix	trans	-69.5	-34.2	172.8	-70.6	172.4	-178.9	178.1	0	112.1	V224 E225 F226 K232	V224-K228 WeakPolarHBondContact O-CG 3.37Å; V224-K228 PolarHBondContact O-N 3Å; V224-K228 VanDerWaalsContact O-N 3.17Å; E225-K228 CarbonylContact O-C 3.6Å; E225-K228 WeakPolarHBondContact O-CB 3.25Å; E225-K228 PolarHBondContact O-N 2.84Å; E225-K228 VanDerWaalsContact O-N 3.15Å; F226-K228 VanDerWaalsContact C-N 3.33Å; F226-K228 PolarHBondContact O-N 2.85Å; K228-K232 WeakPolarHBondContact O-CG 3.38Å; K228-K232 PolarHBondContact O-N 3.07Å; K228-K232 VanDerWaalsContact O-N 3.14Å
229	E	67.7	Low	59.7	Low	71 Å²	71	82.8 Å²	82.8	33%	0.332	39%	0.386	S	S	.	.	H	α-helix	trans	-70.1	-42.3	173.6	-169.6	169.4	-164.9	0	0	111.6	Y128 C206 E225 F226 Q231 K232 F233	Y128-E229 HydrophobicContact CE1-CG 4.35Å; Y128-E229 PolarHBondContact OH-OE1 3.07Å; C206-E229 PolarHBondContact SG-OE1 2.9Å; C206-E229 VanDerWaalsContact SG-OE1 3.39Å; E225-E229 PolarHBondContact O-N 2.9Å; F226-E229 CarbonylContact O-C 3.41Å; F226-E229 PolarHBondContact O-N 2.76Å; E229-Q231 PolarHBondContact O-N 3.08Å; E229-K232 PolarHBondContact O-N 2.71Å; E229-F233 WeakPolarHBondContact O-CB 3.3Å; E229-F233 PolarHBondContact O-N 3.21Å
230	I	65.2	Low	59.7	Low	21 Å²	21	81 Å²	81	11%	0.108	38%	0.377	C	S	.	.	H	α-helix	trans	-52.9	-55	168.9	-75.1	168.8	0	0	0	109.7	F226 W227 K232 F233 Y234	F226-I230 HydrophobicContact CD1-CD1 3.65Å; F226-I230 HydrophobicContact CD1-CG1 4.38Å; F226-I230 HydrophobicContact CE1-CD1 3.39Å; F226-I230 HydrophobicContact CE1-CG1 4.18Å; F226-I230 HydrophobicContact CG-CD1 4.39Å; F226-I230 HydrophobicContact CZ-CD1 3.94Å; F226-I230 HydrophobicContact CZ-CG1 4.3Å; F226-I230 WeakPolarHBondContact O-CB 3.3Å; F226-I230 WeakPolarHBondContact O-CG1 3.21Å; F226-I230 PolarHBondContact O-N 3.4Å; W227-I230 HydrophobicContact CD2-CD1 4.28Å; W227-I230 HydrophobicContact CE3-CB 4.34Å; W227-I230 HydrophobicContact CE3-CD1 3.97Å; W227-I230 HydrophobicContact CE3-CG2 4.09Å; W227-I230 HydrophobicContact CZ3-CD1 4.23Å; W227-I230 HydrophobicContact CZ3-CG2 4.13Å; I230-K232 PolarHBondContact O-N 2.87Å; I230-F233 PolarHBondContact O-N 3.32Å; I230-F233 VanDerWaalsContact O-N 3.09Å; I230-Y234 HydrophobicContact CG2-CD2 3.78Å; I230-Y234 HydrophobicContact CG2-CE2 4.15Å; I230-Y234 WeakPolarHBondContact O-CB 3.34Å; I230-Y234 WeakPolarHBondContact O-CD2 3.3Å; I230-Y234 PolarHBondContact O-N 3.21Å
231	Q	65	Low	59.7	Low	128 Å²	128	82.8 Å²	82.8	60%	0.598	38%	0.38	S	S	*	.	H	α-helix	trans	-61.1	-34.6	-176.5	-172.1	176.2	-14	0	0	112.2	W227 E229 H235	W227-Q231 PolarHBondContact O-N 3.25Å; E229-Q231 PolarHBondContact O-N 3.08Å; Q231-H235 PolarHBondContact O-N 3.02Å
232	K	66.4	Low	59.3	Low	152 Å²	152	81.7 Å²	81.7	66%	0.661	37%	0.371	S	S	*	.	H	α-helix	trans	-71.8	-40.6	173.1	-73.1	174.1	179.4	-179.6	0	113	K228 E229 I230 H235	K228-K232 WeakPolarHBondContact O-CG 3.38Å; K228-K232 PolarHBondContact O-N 3.07Å; K228-K232 VanDerWaalsContact O-N 3.14Å; E229-K232 PolarHBondContact O-N 2.71Å; I230-K232 PolarHBondContact O-N 2.87Å; K232-H235 WeakPolarHBondContact O-CB 3.26Å; K232-H235 PolarHBondContact O-N 2.79Å
233	F	59.9	Low	58.1	Low	76 Å²	76	84.2 Å²	84.2	33%	0.333	39%	0.387	S	S	.	.	H	α-helix	trans	-71.4	-36.3	-179.9	-173.2	-104.7	0	0	0	112.6	C124 Y128 E229 I230 H235	C124-F233 HydrophobicContact CB-CE2 3.93Å; C124-F233 HydrophobicContact CB-CZ 4Å; Y128-F233 AromaticContact CD2-CD1 3.57Å; Y128-F233 HydrophobicContact CD2-CD1 3.57Å; Y128-F233 HydrophobicContact CD2-CD2 4.12Å; Y128-F233 AromaticContact CD2-CE1 3.49Å; Y128-F233 HydrophobicContact CD2-CE1 3.49Å; Y128-F233 VanDerWaalsContact CD2-CE1 3.49Å; Y128-F233 HydrophobicContact CD2-CE2 4.06Å; Y128-F233 AromaticContact CD2-CG 3.89Å; Y128-F233 HydrophobicContact CD2-CG 3.89Å; Y128-F233 AromaticContact CD2-CZ 3.75Å; Y128-F233 HydrophobicContact CD2-CZ 3.75Å; Y128-F233 HydrophobicContact CE2-CB 4.37Å; Y128-F233 AromaticContact CE2-CD1 3.76Å; Y128-F233 HydrophobicContact CE2-CD1 3.76Å; Y128-F233 AromaticContact CE2-CD2 3.44Å; Y128-F233 HydrophobicContact CE2-CD2 3.44Å; Y128-F233 VanDerWaalsContact CE2-CD2 3.44Å; Y128-F233 AromaticContact CE2-CE1 3.83Å; Y128-F233 HydrophobicContact CE2-CE1 3.83Å; Y128-F233 AromaticContact CE2-CE2 3.52Å; Y128-F233 HydrophobicContact CE2-CE2 3.52Å; Y128-F233 AromaticContact CE2-CG 3.56Å; Y128-F233 HydrophobicContact CE2-CG 3.56Å; Y128-F233 AromaticContact CE2-CZ 3.71Å; Y128-F233 HydrophobicContact CE2-CZ 3.71Å; Y128-F233 HydrophobicContact CG-CD1 4.41Å; E229-F233 WeakPolarHBondContact O-CB 3.3Å; E229-F233 PolarHBondContact O-N 3.21Å; I230-F233 PolarHBondContact O-N 3.32Å; I230-F233 VanDerWaalsContact O-N 3.09Å; F233-H235 VanDerWaalsContact C-N 3.29Å
234	Y	54.3	Low	57	Low	151 Å²	151	85.8 Å²	85.8	59%	0.592	40%	0.403	S	S	*	.	S	Bend	trans	-79.4	-5.5	173	-80.1	-91.8	0	0	0	113.7	I230 I236	I230-Y234 HydrophobicContact CG2-CD2 3.78Å; I230-Y234 HydrophobicContact CG2-CE2 4.15Å; I230-Y234 WeakPolarHBondContact O-CB 3.34Å; I230-Y234 WeakPolarHBondContact O-CD2 3.3Å; I230-Y234 PolarHBondContact O-N 3.21Å; Y234-I236 PolarHBondContact O-N 3.32Å
235	H	52.8	Low	55.5	Low	121 Å²	121	90.3 Å²	90.3	56%	0.56	43%	0.433	S	S	*	.			trans	-72.8	68.4	164	-168.8	-60.3	0	0	0	110.1	Q231 K232 F233 P237	Q231-H235 PolarHBondContact O-N 3.02Å; K232-H235 WeakPolarHBondContact O-CB 3.26Å; K232-H235 PolarHBondContact O-N 2.79Å; F233-H235 VanDerWaalsContact C-N 3.29Å; H235-P237 WeakPolarHBondContact O-CD 3.22Å; H235-P237 VanDerWaalsContact O-N 3.15Å
236	I	51.9	Low	53.9	Low	78 Å²	78	87.5 Å²	87.5	40%	0.4	43%	0.433	S	S	.	.			trans	-57.9	115.1	175.7	-60.8	166.6	0	0	0	108.3	Y234 D238 T240	Y234-I236 PolarHBondContact O-N 3.32Å; I236-D238 PolarHBondContact O-N 2.9Å; I236-T240 HydrophobicContact CG2-CG2 3.97Å
237	P	50.9	Low	52.4	Low	28 Å²	28	92.9 Å²	92.9	18%	0.182	47%	0.469	C	S	.	.			trans	-65.7	121.9	178.2	-18.6	31.8	0	0	0	109	Y19 H235 S239 T240	Y19-P237 HydrophobicContact CD1-CB 4.16Å; Y19-P237 HydrophobicContact CD1-CG 4.47Å; Y19-P237 HydrophobicContact CD2-CG 4.32Å; Y19-P237 HydrophobicContact CE1-CB 3.87Å; Y19-P237 HydrophobicContact CE1-CG 4.21Å; Y19-P237 HydrophobicContact CE2-CG 4.05Å; H235-P237 WeakPolarHBondContact O-CD 3.22Å; H235-P237 VanDerWaalsContact O-N 3.15Å; P237-S239 PolarHBondContact O-N 3.43Å; P237-S239 PolarHBondContact O-OG 3.28Å; P237-T240 VanDerWaalsContact O-CB 3.3Å; P237-T240 WeakPolarHBondContact O-CB 3.28Å; P237-T240 PolarHBondContact O-N 3.46Å; P237-T240 PolarHBondContact O-OG1 2.97Å
238	D	47	Very low	50.8	Low	53 Å²	53	92.6 Å²	92.6	28%	0.283	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-53.4	-29.1	-162.9	-24.8	-22.8	0	0	0	113.5	R58 I236 T240 W241 Y242	R58-D238 HydrophobicContact CG-CB 4.35Å; R58-D238 IonicContact CZ-OD1 3.73Å; R58-D238 IonicContact CZ-OD2 3.27Å; R58-D238 VanDerWaalsContact NE-CG 3.34Å; R58-D238 IonicContact NE-OD1 2.69Å; R58-D238 IonicContact NE-OD2 2.83Å; R58-D238 PolarHBondContact NE-OD2 3.46Å; R58-D238 IonicContact NH2-OD1 2.6Å; R58-D238 PolarHBondContact NH2-OD1 3.37Å; R58-D238 IonicContact NH2-OD2 3.97Å; R58-D238 PolarHBondContact NH2-OD2 2.8Å; I236-D238 PolarHBondContact O-N 2.9Å; D238-T240 PolarHBondContact O-N 3.48Å; D238-W241 PolarHBondContact O-N 3.38Å; D238-W241 VanDerWaalsContact O-N 3.07Å; D238-Y242 HydrophobicContact CB-CD2 4.34Å; D238-Y242 HydrophobicContact CB-CE2 3.67Å; D238-Y242 VanDerWaalsContact O-CD2 3.31Å; D238-Y242 WeakPolarHBondContact O-CD2 3.45Å
239	S	46.8	Very low	49.1	Very low	6 Å²	6	94 Å²	94	4%	0.042	49%	0.49	C	S	.	.	G	3₁₀ helix	trans	-44.3	-20	166.2	68.1	0	0	0	0	115.8	R27 P237	R27-S239 WeakPolarHBondContact CD-O 3.2Å; R27-S239 PolarHBondContact NH1-O 2.95Å; P237-S239 PolarHBondContact O-N 3.43Å; P237-S239 PolarHBondContact O-OG 3.28Å
240	T	52.9	Low	47.3	Very low	33 Å²	33	95.3 Å²	95.3	20%	0.202	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-70.4	-33.5	-179.7	-54.4	0	0	0	0	112.5	I236 P237 D238	I236-T240 HydrophobicContact CG2-CG2 3.97Å; P237-T240 VanDerWaalsContact O-CB 3.3Å; P237-T240 WeakPolarHBondContact O-CB 3.28Å; P237-T240 PolarHBondContact O-N 3.46Å; P237-T240 PolarHBondContact O-OG1 2.97Å; D238-T240 PolarHBondContact O-N 3.48Å
241	W	50.7	Low	45.9	Very low	187 Å²	187	105.7 Å²	105.7	71%	0.708	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.3	-8.6	-166.9	-70.8	114.1	0	0	0	116.3	D238 C243	D238-W241 PolarHBondContact O-N 3.38Å; D238-W241 VanDerWaalsContact O-N 3.07Å; W241-C243 PolarHBondContact O-N 2.9Å
242	Y	44.3	Very low	44.4	Very low	117 Å²	117	106.4 Å²	106.4	46%	0.459	55%	0.545	S	S	.	.			trans	-71.8	75.2	171.7	-67.8	-66.1	0	0	0	112.4	R27 P59 D238	R27-Y242 PolarHBondContact NH1-O 3.36Å; R27-Y242 VanDerWaalsContact NH1-O 3.17Å; R27-Y242 PolarHBondContact NH2-O 3.09Å; P59-Y242 HydrophobicContact CG-CE2 4.28Å; D238-Y242 HydrophobicContact CB-CD2 4.34Å; D238-Y242 HydrophobicContact CB-CE2 3.67Å; D238-Y242 VanDerWaalsContact O-CD2 3.31Å; D238-Y242 WeakPolarHBondContact O-CD2 3.45Å
243	C	40.5	Very low	42.8	Very low	108 Å²	108	107.7 Å²	107.7	73%	0.73	55%	0.551	S	S	*	*			trans	-84	95.5	147.9	-70.9	0	0	0	0	107	W241	W241-C243 PolarHBondContact O-N 2.9Å
244	A	40.2	Very low	41.5	Very low	50 Å²	50	110.8 Å²	110.8	41%	0.413	58%	0.576	S	S	.	*			trans	-51.6	144.7	165.9	0	0	0	0	0	109.3	C55 G246	C55-A244 HydrophobicContact CB-CB 4.08Å; A244-G246 PolarHBondContact O-N 3.37Å
245	P	35.7	Very low	40.4	Very low	132 Å²	132	107 Å²	107	86%	0.857	58%	0.583	S	S	*	*			trans	-55.9	104.4	178.5	-25.6	35	0	0	0	110.4
246	G	34.9	Very low	39.3	Very low	48 Å²	48	104.3 Å²	104.3	50%	0.495	59%	0.588	S	S	.	*			trans	-59.2	149.6	176.3	0	0	0	0	0	109.5	A244 I248	A244-G246 PolarHBondContact O-N 3.37Å; G246-I248 PolarHBondContact O-N 3.23Å
247	P	35.9	Very low	38.5	Very low	131 Å²	131	112.1 Å²	112.1	85%	0.851	62%	0.615	S	S	*	*			trans	-59.5	102.5	180	25.1	-33.8	0	0	0	109.1	N249	P247-N249 PolarHBondContact O-N 2.9Å
248	I	34.2	Very low	37.6	Very low	129 Å²	129	114.7 Å²	114.7	66%	0.662	65%	0.646	S	S	*	*			trans	-61.4	117.8	-177.3	-59.1	179.4	0	0	0	106.5	G246 N250	G246-I248 PolarHBondContact O-N 3.23Å; I248-N250 PolarHBondContact O-N 3.13Å
249	N	33.6	Very low	36.8	Very low	153 Å²	153	117.9 Å²	117.9	82%	0.818	67%	0.672	S	S	*	*			trans	-75.4	45.8	-176.3	48.8	-9.4	0	0	0	112.3	P247 R251	P247-N249 PolarHBondContact O-N 2.9Å; N249-R251 PolarHBondContact O-N 3.49Å
250	N	31	Very low	36.3	Very low	99 Å²	99	123.9 Å²	123.9	53%	0.529	71%	0.708	S	S	.	*			trans	-62.5	97.9	166	-79.3	-19.8	0	0	0	109.1	I248 N252 F253	I248-N250 PolarHBondContact O-N 3.13Å; N250-N252 PolarHBondContact O-N 2.86Å; N250-F253 HydrophobicContact CB-CD2 4.36Å
251	R	36.1	Very low	35.4	Very low	240 Å²	240	128.1 Å²	128.1	91%	0.906	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	8.2	174	-78.5	-175.7	168.7	177.7	-2.9	115	N249	N249-R251 PolarHBondContact O-N 3.49Å
252	N	33.4	Very low	34.4	Very low	142 Å²	142	125.2 Å²	125.2	76%	0.759	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.6	14.5	-167.4	-61.8	14.9	0	0	0	113.5	N250 T254	N250-N252 PolarHBondContact O-N 2.86Å; N252-T254 PolarHBondContact O-N 3.48Å
253	F	32.1	Very low	33.8	Very low	180 Å²	180	131.2 Å²	131.2	79%	0.789	76%	0.764	S	S	*	*			trans	-86.5	86.5	171.7	-100.7	-84.1	0	0	0	111.3	N250	N250-F253 HydrophobicContact CB-CD2 4.36Å
254	T	31.3	Very low	33.3	Very low	140 Å²	140	131.4 Å²	131.4	86%	0.859	77%	0.767	S	S	*	*			trans	-116.4	105.8	167.1	50.6	0	0	0	0	109.3	N252	N252-T254 PolarHBondContact O-N 3.48Å
255	G	32.8	Very low	32.8	Very low	71 Å²	71	140.7 Å²	140.7	73%	0.732	79%	0.791	S	S	*	*			trans	145.9	115	-172.9	0	0	0	0	0	107.6
256	G	29.7	Very low	32.7	Very low	66 Å²	66	139.9 Å²	139.9	68%	0.68	79%	0.786	S	S	*	*			trans	-158	173.1	-165.3	0	0	0	0	0	114.6
257	Y	34.3	Very low	32.5	Very low	242 Å²	242	143.1 Å²	143.1	95%	0.949	80%	0.801	S	S	*	*			trans	-141.3	155.2	175.4	-70.5	-82.9	0	0	0	108.8
258	G	32.7	Very low	32.2	Very low	81 Å²	81	140.6 Å²	140.6	84%	0.835	80%	0.799	S	S	*	*			trans	92.7	88.5	176	0	0	0	0	0	114.5
259	S	28.6	Very low	32.3	Very low	121 Å²	121	140.1 Å²	140.1	85%	0.846	80%	0.802	S	S	*	*			trans	-92.9	120.8	171.5	-179	0	0	0	0	110.8
260	V	37	Very low	32.3	Very low	131 Å²	131	136.1 Å²	136.1	79%	0.794	80%	0.797	S	S	*	*			trans	-138.6	102.3	164.7	-171.4	0	0	0	0	110.2
261	T	35.2	Very low	33	Very low	123 Å²	123	136.7 Å²	136.7	76%	0.755	81%	0.808	S	S	*	*			trans	39.6	105.7	159.1	62.8	0	0	0	0	119.9	R263	T261-R263 PolarHBondContact O-N 2.76Å
262	S	28.6	Very low	33.3	Very low	125 Å²	125	131.9 Å²	131.9	87%	0.874	80%	0.8	S	S	*	*			trans	-15.8	116.3	153.5	-50.5	0	0	0	0	118.5
263	R	31.4	Very low	34.5	Very low	244 Å²	244	127.5 Å²	127.5	92%	0.921	78%	0.776	S	S	*	*			trans	-149.9	129	140.1	-113.8	176.3	-166.9	-136.2	0.8	112.5	T261	T261-R263 PolarHBondContact O-N 2.76Å
264	S	31.2	Very low	36	Very low	112 Å²	112	126.3 Å²	126.3	78%	0.783	77%	0.771	S	S	*	*			trans	28.4	108	158.2	-50.2	0	0	0	0	119.4	P266	S264-P266 WeakPolarHBondContact O-CD 3.26Å
265	R	28.9	Very low	37.8	Very low	245 Å²	245	122.8 Å²	122.8	93%	0.925	75%	0.752	S	S	*	*			trans	-61.7	122.9	156.4	-74.4	-178.5	173.5	-175	-1.4	109.5	S267	R265-S267 PolarHBondContact O-N 2.9Å
266	P	34.4	Very low	39.5	Very low	114 Å²	114	125.6 Å²	125.6	74%	0.74	74%	0.741	S	S	*	*			trans	-74.7	104.1	166.9	29.9	-31.4	0	0	0	109.2	S264	S264-P266 WeakPolarHBondContact O-CD 3.26Å
267	S	30.5	Very low	41.7	Very low	116 Å²	116	123.1 Å²	123.1	81%	0.811	71%	0.712	S	S	*	*			trans	-76.3	140.2	169.1	-168.2	0	0	0	0	110.3	R265 V269	R265-S267 PolarHBondContact O-N 2.9Å; S267-V269 PolarHBondContact O-N 2.92Å
268	G	30	Very low	43.6	Very low	79 Å²	79	114 Å²	114	81%	0.814	68%	0.683	S	S	*	*	S	Bend	trans	89.8	-9	156.4	0	0	0	0	0	119.5
269	V	34.9	Very low	45.8	Very low	119 Å²	119	114.5 Å²	114.5	72%	0.721	67%	0.671	S	S	*	*			trans	-127.9	125.3	-178.3	-76.1	0	0	0	0	113.2	S267	S267-V269 PolarHBondContact O-N 2.92Å
270	G	35.1	Very low	48	Very low	69 Å²	69	109.1 Å²	109.1	71%	0.711	63%	0.632	S	S	*	*	S	Bend	trans	144.3	-19.2	174.3	0	0	0	0	0	116.4	L272	G270-L272 PolarHBondContact O-N 3.29Å
271	S	44	Very low	50	Low	110 Å²	110	106.5 Å²	106.5	77%	0.769	61%	0.614	S	S	*	*	S	Bend	trans	-84	-2	-174	-165.7	0	0	0	0	115.6
272	L	43.6	Very low	52	Low	140 Å²	140	103.1 Å²	103.1	73%	0.733	60%	0.598	S	S	*	*	S	Bend	trans	-95.7	-21.9	-170.8	-65.8	174.3	0	0	0	114.3	G270 S275	G270-L272 PolarHBondContact O-N 3.29Å; L272-S275 PolarHBondContact O-OG 3.36Å; L272-S275 VanDerWaalsContact O-OG 3.11Å
273	N	59.1	Low	54.3	Low	49 Å²	49	101.9 Å²	101.9	26%	0.262	58%	0.578	S	S	.	*	H	α-helix	trans	-81.2	-31.7	-175.9	-69.6	29.2	0	0	0	112.2	L37 S275 R276 L277	L37-N273 PolarHBondContact O-ND2 3.25Å; N273-S275 PolarHBondContact O-N 3Å; N273-R276 PolarHBondContact O-N 3.16Å; N273-R276 VanDerWaalsContact O-N 3.16Å; N273-L277 WeakPolarHBondContact O-CB 3.5Å; N273-L277 WeakPolarHBondContact O-CG 3.45Å; N273-L277 PolarHBondContact O-N 3.49Å
274	F	62.4	Low	56.3	Low	156 Å²	156	90.8 Å²	90.8	68%	0.684	54%	0.539	S	S	*	.	H	α-helix	trans	-64.1	-37.4	-177.7	-168.9	-91.4	0	0	0	113.3	S278	F274-S278 VanDerWaalsContact O-CB 3.27Å; F274-S278 WeakPolarHBondContact O-CB 3.22Å; F274-S278 PolarHBondContact O-N 3.18Å; F274-S278 PolarHBondContact O-OG 3.38Å
275	S	68.7	Low	58.2	Low	66 Å²	66	88.7 Å²	88.7	46%	0.462	52%	0.524	S	S	.	.	H	α-helix	trans	-68.1	-41.5	173.6	44.7	0	0	0	0	111.4	L272 N273 S278 T279	L272-S275 PolarHBondContact O-OG 3.36Å; L272-S275 VanDerWaalsContact O-OG 3.11Å; N273-S275 PolarHBondContact O-N 3Å; S275-S278 PolarHBondContact O-N 2.89Å; S275-T279 PolarHBondContact O-N 3.25Å; S275-T279 PolarHBondContact O-OG1 2.84Å
276	R	70.4	Confident	60	Low	129 Å²	129	80.1 Å²	80.1	49%	0.487	50%	0.502	S	S	.	.	H	α-helix	trans	-63.6	-46	176.4	-167.7	168.3	177.6	160.4	-3.1	112.1	E104 N273 T279 L280	E104-R276 IonicContact OE1-CZ 2.63Å; E104-R276 VanDerWaalsContact OE1-CZ 3.24Å; E104-R276 IonicContact OE1-NE 3.87Å; E104-R276 PolarHBondContact OE1-NE 3.26Å; E104-R276 IonicContact OE1-NH2 2.57Å; E104-R276 PolarHBondContact OE1-NH2 3.14Å; E104-R276 IonicContact OE2-CZ 3.32Å; E104-R276 IonicContact OE2-NE 3.32Å; E104-R276 IonicContact OE2-NH2 2.76Å; E104-R276 PolarHBondContact OE2-NH2 3.49Å; N273-R276 PolarHBondContact O-N 3.16Å; N273-R276 VanDerWaalsContact O-N 3.16Å; R276-T279 PolarHBondContact O-N 2.8Å; R276-L280 WeakPolarHBondContact O-CG 3.34Å; R276-L280 PolarHBondContact O-N 3.06Å
277	L	74.8	Confident	60.9	Low	14 Å²	14	79.8 Å²	79.8	7%	0.073	50%	0.5	C	S	.	.	H	α-helix	trans	-58.6	-46.8	170.9	-74.8	174.7	0	0	0	111.7	T34 L37 D38 N273 T279 L280 L281	T34-L277 HydrophobicContact CG2-CD1 4.38Å; T34-L277 HydrophobicContact CG2-CD2 4.37Å; L37-L277 HydrophobicContact CB-CD2 3.96Å; L37-L277 HydrophobicContact CD1-CD2 3.57Å; L37-L277 HydrophobicContact CG-CD2 4.44Å; D38-L277 WeakPolarHBondContact OD1-CD1 3.4Å; N273-L277 WeakPolarHBondContact O-CB 3.5Å; N273-L277 WeakPolarHBondContact O-CG 3.45Å; N273-L277 PolarHBondContact O-N 3.49Å; L277-T279 VanDerWaalsContact C-N 3.28Å; L277-T279 PolarHBondContact O-N 2.96Å; L277-L280 PolarHBondContact O-N 3.08Å; L277-L281 WeakPolarHBondContact O-CB 3.37Å; L277-L281 VanDerWaalsContact O-CG 3.26Å; L277-L281 WeakPolarHBondContact O-CG 3.48Å; L277-L281 PolarHBondContact O-N 3.06Å
278	S	75.2	Confident	61.7	Low	50 Å²	50	78.7 Å²	78.7	35%	0.35	50%	0.498	S	S	.	.	H	α-helix	trans	-60.1	-38	177	-62.1	0	0	0	0	112	F274 S275 A282	F274-S278 VanDerWaalsContact O-CB 3.27Å; F274-S278 WeakPolarHBondContact O-CB 3.22Å; F274-S278 PolarHBondContact O-N 3.18Å; F274-S278 PolarHBondContact O-OG 3.38Å; S275-S278 PolarHBondContact O-N 2.89Å; S278-A282 VanDerWaalsContact O-CB 3.26Å; S278-A282 WeakPolarHBondContact O-CB 3.31Å; S278-A282 PolarHBondContact O-N 2.92Å
279	T	78.4	Confident	62.1	Low	93 Å²	93	83 Å²	83	57%	0.571	50%	0.502	S	S	*	.	H	α-helix	trans	-67	-47.5	174.4	-57.9	0	0	0	0	111.7	S275 R276 L277 L281 A282 E283	S275-T279 PolarHBondContact O-N 3.25Å; S275-T279 PolarHBondContact O-OG1 2.84Å; R276-T279 PolarHBondContact O-N 2.8Å; L277-T279 VanDerWaalsContact C-N 3.28Å; L277-T279 PolarHBondContact O-N 2.96Å; T279-L281 VanDerWaalsContact C-N 3.31Å; T279-L281 PolarHBondContact O-N 2.92Å; T279-A282 PolarHBondContact O-N 2.87Å; T279-E283 WeakPolarHBondContact O-CB 3.35Å; T279-E283 PolarHBondContact O-N 2.66Å
280	L	74.8	Confident	62.1	Low	8 Å²	8	86.6 Å²	86.6	4%	0.042	51%	0.507	C	S	.	.	H	α-helix	trans	-60.4	-40.1	176.7	-69.6	170.8	0	0	0	112.1	L100 E104 K108 R276 L277 E283 A284	L100-L280 HydrophobicContact CD1-CD2 4.12Å; L100-L280 HydrophobicContact CD2-CD2 4.06Å; E104-L280 HydrophobicContact CB-CD1 4.05Å; E104-L280 HydrophobicContact CG-CD1 3.99Å; K108-L280 HydrophobicContact CD-CD2 4.12Å; R276-L280 WeakPolarHBondContact O-CG 3.34Å; R276-L280 PolarHBondContact O-N 3.06Å; L277-L280 PolarHBondContact O-N 3.08Å; L280-E283 PolarHBondContact O-N 3.31Å; L280-A284 VanDerWaalsContact O-CB 3.26Å; L280-A284 WeakPolarHBondContact O-CB 3.45Å; L280-A284 PolarHBondContact O-N 3.38Å
281	L	78.2	Confident	61.9	Low	76 Å²	76	88.2 Å²	88.2	40%	0.398	51%	0.505	S	S	.	.	H	α-helix	trans	-68.1	-41.8	176.1	-72.6	166.1	0	0	0	112	S111 L277 T279 S285	S111-L281 WeakPolarHBondContact OG-CD2 3.26Å; L277-L281 WeakPolarHBondContact O-CB 3.37Å; L277-L281 VanDerWaalsContact O-CG 3.26Å; L277-L281 WeakPolarHBondContact O-CG 3.48Å; L277-L281 PolarHBondContact O-N 3.06Å; T279-L281 VanDerWaalsContact C-N 3.31Å; T279-L281 PolarHBondContact O-N 2.92Å; L281-S285 VanDerWaalsContact O-CB 3.22Å; L281-S285 WeakPolarHBondContact O-CB 3.22Å; L281-S285 PolarHBondContact O-N 3.29Å; L281-S285 PolarHBondContact O-OG 2.82Å
282	A	76.9	Confident	61.1	Low	52 Å²	52	87.4 Å²	87.4	43%	0.43	51%	0.505	S	S	.	.	H	α-helix	trans	-65.6	-38.5	175	0	0	0	0	0	112	S278 T279 S285 S286	S278-A282 VanDerWaalsContact O-CB 3.26Å; S278-A282 WeakPolarHBondContact O-CB 3.31Å; S278-A282 PolarHBondContact O-N 2.92Å; T279-A282 PolarHBondContact O-N 2.87Å; A282-S285 PolarHBondContact O-OG 3.33Å; A282-S286 WeakPolarHBondContact O-CB 3.2Å; A282-S286 PolarHBondContact O-N 3.35Å; A282-S286 PolarHBondContact O-OG 2.99Å
283	E	77.3	Confident	60.6	Low	98 Å²	98	86.2 Å²	86.2	46%	0.458	50%	0.504	S	S	.	.	H	α-helix	trans	-68.9	-42.9	177	-160.2	-167	165.7	0	0	111.7	K108 T279 L280	K108-E283 WeakPolarHBondContact CE-OE1 3.35Å; K108-E283 WeakPolarHBondContact CE-OE2 3.26Å; K108-E283 IonicContact NZ-OE1 3.81Å; K108-E283 PolarHBondContact NZ-OE1 3.09Å; K108-E283 IonicContact NZ-OE2 2.7Å; K108-E283 PolarHBondContact NZ-OE2 3.42Å; T279-E283 WeakPolarHBondContact O-CB 3.35Å; T279-E283 PolarHBondContact O-N 2.66Å; L280-E283 PolarHBondContact O-N 3.31Å
284	A	73.9	Confident	59.4	Low	12 Å²	12	93.1 Å²	93.1	10%	0.099	54%	0.535	C	S	.	.	H	α-helix	trans	-74.2	-27.6	178.3	0	0	0	0	0	114	A112 L280	A112-A284 HydrophobicContact CB-CB 4.26Å; L280-A284 VanDerWaalsContact O-CB 3.26Å; L280-A284 WeakPolarHBondContact O-CB 3.45Å; L280-A284 PolarHBondContact O-N 3.38Å
285	S	70.5	Confident	58	Low	67 Å²	67	94.4 Å²	94.4	47%	0.469	54%	0.54	S	S	.	.	H	α-helix	trans	-86.7	-17.2	175.8	60.1	0	0	0	0	113.7	R119 L281 A282	R119-S285 PolarHBondContact NH2-O 3.29Å; L281-S285 VanDerWaalsContact O-CB 3.22Å; L281-S285 WeakPolarHBondContact O-CB 3.22Å; L281-S285 PolarHBondContact O-N 3.29Å; L281-S285 PolarHBondContact O-OG 2.82Å; A282-S285 PolarHBondContact O-OG 3.33Å
286	S	66.6	Low	56.4	Low	66 Å²	66	101.6 Å²	101.6	46%	0.462	56%	0.557	S	S	.	*	S	Bend	trans	-58.9	137.2	168.9	-68.9	0	0	0	0	110.3	A282 A288	A282-S286 WeakPolarHBondContact O-CB 3.2Å; A282-S286 PolarHBondContact O-N 3.35Å; A282-S286 PolarHBondContact O-OG 2.99Å; S286-A288 PolarHBondContact O-N 3.38Å; S286-A288 VanDerWaalsContact O-N 3.13Å
287	P	54.9	Low	54.6	Low	107 Å²	107	102.4 Å²	102.4	70%	0.695	57%	0.571	S	S	*	*			trans	-64.3	117.7	170.2	27.6	-32.4	0	0	0	107.9	L289	P287-L289 PolarHBondContact O-N 3.45Å
288	A	46.4	Very low	52.8	Low	93 Å²	93	106 Å²	106	77%	0.769	60%	0.597	S	S	*	*			trans	-58.4	110.8	179.8	0	0	0	0	0	109.3	S286 K290	S286-A288 PolarHBondContact O-N 3.38Å; S286-A288 VanDerWaalsContact O-N 3.13Å; A288-K290 VanDerWaalsContact C-N 3.34Å; A288-K290 PolarHBondContact O-N 2.81Å
289	L	38.5	Very low	51	Low	170 Å²	170	109.1 Å²	109.1	89%	0.89	62%	0.615	S	S	*	*			trans	-59.1	103	165.3	-74.4	171.1	0	0	0	106.2	P287 P291	P287-L289 PolarHBondContact O-N 3.45Å; L289-P291 VanDerWaalsContact O-N 3.12Å
290	K	35.2	Very low	49.1	Very low	193 Å²	193	112 Å²	112	84%	0.839	63%	0.626	S	S	*	*			trans	-48.5	123.9	176.1	-68.3	-176.5	179	-177.9	0	107.1	A288 A292	A288-K290 VanDerWaalsContact C-N 3.34Å; A288-K290 PolarHBondContact O-N 2.81Å; K290-A292 PolarHBondContact O-N 2.85Å
291	P	29.5	Very low	47.3	Very low	104 Å²	104	119 Å²	119	68%	0.675	66%	0.657	S	S	*	*			trans	-54.6	136.1	175.5	22.9	-32.3	0	0	0	108	L289 T293	L289-P291 VanDerWaalsContact O-N 3.12Å; P291-T293 PolarHBondContact O-N 3.47Å; P291-T293 PolarHBondContact O-OG1 2.97Å
292	A	28.8	Very low	45	Very low	93 Å²	93	121.1 Å²	121.1	77%	0.769	68%	0.678	S	S	*	*	S	Bend	trans	-77.4	54.6	-169.6	0	0	0	0	0	112.1	K290	K290-A292 PolarHBondContact O-N 2.85Å
293	T	32.3	Very low	43.2	Very low	114 Å²	114	123.7 Å²	123.7	70%	0.699	69%	0.692	S	S	*	*			trans	-109.5	49.1	-174.5	52.8	0	0	0	0	111.4	P291	P291-T293 PolarHBondContact O-N 3.47Å; P291-T293 PolarHBondContact O-OG1 2.97Å
294	Q	35	Very low	41.2	Very low	195 Å²	195	124.2 Å²	124.2	91%	0.911	71%	0.707	S	S	*	*			trans	-122.8	71.2	153.4	-73.9	-164.5	-7.5	0	0	108.7	R296	Q294-R296 PolarHBondContact O-N 3.37Å
295	F	32.8	Very low	39.3	Very low	183 Å²	183	134.5 Å²	134.5	80%	0.803	75%	0.745	S	S	*	*			trans	-70.9	111.8	168.7	-109.8	-93.2	0	0	0	109.2
296	R	33.2	Very low	37.5	Very low	217 Å²	217	140.9 Å²	140.9	82%	0.819	76%	0.764	S	S	*	*			trans	37.8	111.3	156.3	-64.2	-178	174	-169	-2.9	117.7	Q294	Q294-R296 PolarHBondContact O-N 3.37Å
297	N	33.4	Very low	35.7	Very low	145 Å²	145	143 Å²	143	78%	0.775	78%	0.779	S	S	*	*			trans	-145.9	136.3	134.9	-97.6	-45.4	0	0	0	108.9
298	S	36.7	Very low	34.5	Very low	89 Å²	89	143.4 Å²	143.4	62%	0.622	78%	0.784	S	S	*	*	S	Bend	trans	69.2	80.3	-174.1	-46.1	0	0	0	0	113.8
299	T	37.5	Very low	33.9	Very low	117 Å²	117	144.5 Å²	144.5	72%	0.718	79%	0.786	S	S	*	*				90.1	116.4	65.2	58	0	0	0	0	115.1
300	N	39.2	Very low	33.6	Very low	152 Å²	152	144.2 Å²	144.2	81%	0.813	78%	0.78	S	S	*	*			trans	69.5	142.5	151.1	-55.8	-13.5	0	0	0	118
301	K	36	Very low	33.7	Very low	157 Å²	157	143.7 Å²	143.7	68%	0.683	78%	0.781	S	S	*	*			cis	-140	157	-0.1	-118.9	169.7	-179.6	-175.2	0	108.2	E529	K301-E529 IonicContact NZ-OE1 2.83Å; K301-E529 PolarHBondContact NZ-OE1 3.07Å; K301-E529 IonicContact NZ-OE2 2.94Å; K301-E529 PolarHBondContact NZ-OE2 3.16Å
302	S	31.2	Very low	34.2	Very low	120 Å²	120	145.5 Å²	145.5	84%	0.839	78%	0.783	S	S	*	*			trans	-144.3	118.4	178.7	62.8	0	0	0	0	113.5
303	S	38.3	Very low	35	Very low	105 Å²	105	143.7 Å²	143.7	73%	0.734	77%	0.774	S	S	*	*			trans	-158.2	112.4	167.8	48.7	0	0	0	0	108
304	S	35.5	Very low	35.7	Very low	109 Å²	109	147.4 Å²	147.4	76%	0.762	78%	0.783	S	S	*	*				74.9	77.1	62.2	-164.5	0	0	0	0	113.5
305	Y	33.5	Very low	36.9	Very low	228 Å²	228	141 Å²	141	89%	0.894	76%	0.757	S	S	*	*			trans	-102.6	135.2	149.2	-74	-82	0	0	0	109
306	K	32.2	Very low	38.8	Very low	201 Å²	201	136.7 Å²	136.7	87%	0.874	75%	0.746	S	S	*	*			trans	-85.4	130.6	174.9	-67.2	172.2	179.4	170.2	0	109.1
307	S	30	Very low	40.7	Very low	112 Å²	112	129.8 Å²	129.8	78%	0.783	74%	0.735	S	S	*	*				157.2	142.6	102.7	-164	0	0	0	0	112.4
308	S	28.5	Very low	42.8	Very low	114 Å²	114	128.2 Å²	128.2	80%	0.797	73%	0.731	S	S	*	*			trans	49.9	82.6	147	-174.3	0	0	0	0	119.4
309	S	35.1	Very low	44.8	Very low	116 Å²	116	126.6 Å²	126.6	81%	0.811	72%	0.72	S	S	*	*				-152.1	162.4	117.8	-159	0	0	0	0	111.1
310	H	32.8	Very low	46.7	Very low	164 Å²	164	128 Å²	128	76%	0.759	71%	0.712	S	S	*	*			trans	-108.4	73.2	-171.7	-170.3	-40.3	0	0	0	110.7
311	E	35.7	Very low	48.6	Very low	183 Å²	183	123.8 Å²	123.8	86%	0.855	70%	0.697	S	S	*	*			trans	-65.9	138	179.9	-71.6	-162.3	128	0	0	113	G313	E311-G313 PolarHBondContact O-N 3.41Å
312	I	41	Very low	50.7	Low	141 Å²	141	119.2 Å²	119.2	72%	0.723	69%	0.689	S	S	*	*			trans	-101.8	79.7	-169.1	-56.5	175.6	0	0	0	108.6	H314	I312-H314 PolarHBondContact O-N 3.22Å
313	G	45.7	Very low	53	Low	56 Å²	56	118.6 Å²	118.6	58%	0.577	67%	0.673	S	S	*	*			trans	-59.8	126.1	173	0	0	0	0	0	111.3	E311 T315	E311-G313 PolarHBondContact O-N 3.41Å; G313-T315 PolarHBondContact O-N 2.9Å
314	H	45.9	Very low	55.1	Low	192 Å²	192	115.6 Å²	115.6	89%	0.889	66%	0.655	S	S	*	*			trans	-69.4	67.1	-176.2	-68.3	-80.4	0	0	0	113.3	I312 T316	I312-H314 PolarHBondContact O-N 3.22Å; H314-T316 PolarHBondContact O-N 3.41Å
315	T	60.1	Low	57.4	Low	59 Å²	59	113.1 Å²	113.1	36%	0.362	64%	0.641	S	S	.	*			trans	-69	125.1	173.6	47.3	0	0	0	0	110.5	G313 R320	G313-T315 PolarHBondContact O-N 2.9Å; T315-R320 PolarHBondContact O-NE 2.97Å; T315-R320 VanDerWaalsContact O-NE 3.1Å; T315-R320 PolarHBondContact O-NH2 2.96Å; T315-R320 WeakPolarHBondContact OG1-CD 3.44Å; T315-R320 WeakPolarHBondContact OG1-CG 3.33Å; T315-R320 PolarHBondContact OG1-NE 2.95Å
316	T	73.8	Confident	59.7	Low	93 Å²	93	109.2 Å²	109.2	57%	0.571	63%	0.628	S	S	*	*			trans	-56.5	149.6	173.8	-28.5	0	0	0	0	110.6	H314 V318 S319 R320	H314-T316 PolarHBondContact O-N 3.41Å; T316-V318 PolarHBondContact O-N 2.71Å; T316-S319 WeakPolarHBondContact O-CA 3.31Å; T316-S319 WeakPolarHBondContact O-CB 3.5Å; T316-S319 PolarHBondContact O-N 3.03Å; T316-R320 PolarHBondContact O-N 2.89Å
317	A	72	Confident	62.2	Low	72 Å²	72	105.3 Å²	105.3	60%	0.595	61%	0.613	S	S	*	*	H	α-helix	trans	-56.1	-36.2	178.7	0	0	0	0	0	112.6	R320 A321	A317-R320 PolarHBondContact O-N 2.73Å; A317-A321 WeakPolarHBondContact O-CB 3.47Å; A317-A321 PolarHBondContact O-N 3.29Å
318	V	78.2	Confident	64.5	Low	112 Å²	112	109 Å²	109	68%	0.679	61%	0.61	S	S	*	*	H	α-helix	trans	-60.9	-45.9	172.8	179.8	0	0	0	0	111.6	T316 A321 A322	T316-V318 PolarHBondContact O-N 2.71Å; V318-A321 PolarHBondContact O-N 2.94Å; V318-A322 WeakPolarHBondContact O-CB 3.47Å; V318-A322 PolarHBondContact O-N 2.9Å
319	S	78.6	Confident	66.7	Low	56 Å²	56	111.4 Å²	111.4	39%	0.392	60%	0.603	S	S	.	*	H	α-helix	trans	-63	-45.3	178.7	-47.2	0	0	0	0	111.5	T316 A321 A322 E323	T316-S319 WeakPolarHBondContact O-CA 3.31Å; T316-S319 WeakPolarHBondContact O-CB 3.5Å; T316-S319 PolarHBondContact O-N 3.03Å; S319-A321 PolarHBondContact O-N 3.4Å; S319-A322 PolarHBondContact O-N 3.23Å; S319-E323 VanDerWaalsContact O-CB 3.32Å; S319-E323 WeakPolarHBondContact O-CB 3.43Å; S319-E323 PolarHBondContact O-N 3.14Å
320	R	77.9	Confident	68.7	Low	147 Å²	147	110.8 Å²	110.8	56%	0.555	59%	0.59	S	S	*	*	H	α-helix	trans	-62	-39.4	173.6	-91.2	178.5	-82.3	153.8	-5.7	112.6	T315 T316 A317 A324	T315-R320 PolarHBondContact O-NE 2.97Å; T315-R320 VanDerWaalsContact O-NE 3.1Å; T315-R320 PolarHBondContact O-NH2 2.96Å; T315-R320 WeakPolarHBondContact OG1-CD 3.44Å; T315-R320 WeakPolarHBondContact OG1-CG 3.33Å; T315-R320 PolarHBondContact OG1-NE 2.95Å; T316-R320 PolarHBondContact O-N 2.89Å; A317-R320 PolarHBondContact O-N 2.73Å; R320-A324 WeakPolarHBondContact O-CB 3.47Å; R320-A324 PolarHBondContact O-N 2.88Å
321	A	79.4	Confident	70.6	Confident	62 Å²	62	106.4 Å²	106.4	51%	0.512	58%	0.577	S	S	.	*	H	α-helix	trans	-67	-43.1	176	0	0	0	0	0	112.3	A317 V318 S319 A325	A317-A321 WeakPolarHBondContact O-CB 3.47Å; A317-A321 PolarHBondContact O-N 3.29Å; V318-A321 PolarHBondContact O-N 2.94Å; S319-A321 PolarHBondContact O-N 3.4Å; A321-A325 WeakPolarHBondContact O-CB 3.44Å; A321-A325 PolarHBondContact O-N 3.46Å
322	A	79.9	Confident	72	Confident	61 Å²	61	105.6 Å²	105.6	50%	0.504	57%	0.571	S	S	.	*	H	α-helix	trans	-65.9	-41.6	177	0	0	0	0	0	112	V318 S319 A325 K326	V318-A322 WeakPolarHBondContact O-CB 3.47Å; V318-A322 PolarHBondContact O-N 2.9Å; S319-A322 PolarHBondContact O-N 3.23Å; A322-A325 PolarHBondContact O-N 3.32Å; A322-K326 WeakPolarHBondContact O-CB 3.41Å; A322-K326 PolarHBondContact O-N 3.34Å
323	E	77.8	Confident	72.6	Confident	108 Å²	108	103 Å²	103	51%	0.505	56%	0.562	S	S	.	*	H	α-helix	trans	-68.5	-41.8	176.4	-173.5	163.1	-130.2	0	0	111.9	S319 A325 K326 Q327	S319-E323 VanDerWaalsContact O-CB 3.32Å; S319-E323 WeakPolarHBondContact O-CB 3.43Å; S319-E323 PolarHBondContact O-N 3.14Å; E323-A325 VanDerWaalsContact C-N 3.31Å; E323-A325 PolarHBondContact O-N 3.2Å; E323-K326 WeakPolarHBondContact O-CB 3.34Å; E323-K326 PolarHBondContact O-N 3.3Å; E323-Q327 WeakPolarHBondContact O-CG 3.42Å; E323-Q327 PolarHBondContact O-N 3Å
324	A	84.1	Confident	73	Confident	42 Å²	42	105 Å²	105	35%	0.347	57%	0.567	S	S	.	*	H	α-helix	trans	-62.6	-36.7	172.1	0	0	0	0	0	112.3	R320 R328	R320-A324 WeakPolarHBondContact O-CB 3.47Å; R320-A324 PolarHBondContact O-N 2.88Å; A324-R328 WeakPolarHBondContact O-CB 3.28Å; A324-R328 WeakPolarHBondContact O-CG 3.38Å; A324-R328 PolarHBondContact O-N 2.93Å
325	A	83.9	Confident	73.2	Confident	57 Å²	57	103.8 Å²	103.8	47%	0.471	56%	0.559	S	S	.	*	H	α-helix	trans	-65.4	-43.5	172.7	0	0	0	0	0	111.8	A321 A322 E323 R328 Y329	A321-A325 WeakPolarHBondContact O-CB 3.44Å; A321-A325 PolarHBondContact O-N 3.46Å; A322-A325 PolarHBondContact O-N 3.32Å; E323-A325 VanDerWaalsContact C-N 3.31Å; E323-A325 PolarHBondContact O-N 3.2Å; A325-R328 PolarHBondContact O-N 3.31Å; A325-Y329 PolarHBondContact O-N 2.89Å
326	K	80.8	Confident	72.7	Confident	146 Å²	146	109.7 Å²	109.7	64%	0.635	58%	0.582	S	S	*	*	H	α-helix	trans	-61.2	-46.5	175.4	-170.3	177.9	-178.9	-177.7	0	111.7	A322 E323 Y329 L330	A322-K326 WeakPolarHBondContact O-CB 3.41Å; A322-K326 PolarHBondContact O-N 3.34Å; E323-K326 WeakPolarHBondContact O-CB 3.34Å; E323-K326 PolarHBondContact O-N 3.3Å; K326-Y329 PolarHBondContact O-N 3.47Å; K326-L330 HydrophobicContact CG-CD1 4.31Å; K326-L330 WeakPolarHBondContact O-CG 3.35Å; K326-L330 PolarHBondContact O-N 3.43Å
327	Q	85.1	Confident	71	Confident	118 Å²	118	114.4 Å²	114.4	55%	0.551	60%	0.595	S	S	*	*	H	α-helix	trans	-63.3	-40.5	174.7	-71.3	-170.7	11.7	0	0	112.2	E323 Y329 L330 S331	E323-Q327 WeakPolarHBondContact O-CG 3.42Å; E323-Q327 PolarHBondContact O-N 3Å; Q327-Y329 VanDerWaalsContact C-N 3.31Å; Q327-Y329 PolarHBondContact O-N 3.3Å; Q327-L330 PolarHBondContact O-N 2.93Å; Q327-S331 VanDerWaalsContact O-CB 3.22Å; Q327-S331 WeakPolarHBondContact O-CB 3.42Å; Q327-S331 PolarHBondContact O-N 2.86Å; Q327-S331 PolarHBondContact O-OG 2.71Å
328	R	77.9	Confident	69.3	Low	189 Å²	189	119.3 Å²	119.3	71%	0.713	61%	0.61	S	S	*	*	H	α-helix	trans	-62.6	-34.7	174.2	-77.9	171.5	178.2	-170.9	0.6	112.8	A324 A325 K332	A324-R328 WeakPolarHBondContact O-CB 3.28Å; A324-R328 WeakPolarHBondContact O-CG 3.38Å; A324-R328 PolarHBondContact O-N 2.93Å; A325-R328 PolarHBondContact O-N 3.31Å; R328-K332 WeakPolarHBondContact O-CG 3.44Å; R328-K332 PolarHBondContact O-N 2.9Å
329	Y	75.2	Confident	67.3	Low	166 Å²	166	120 Å²	120	65%	0.651	62%	0.62	S	S	*	*	H	α-helix	trans	-69.3	-52.3	175.9	-169.5	-91.7	0	0	0	111.2	A325 K326 Q327 S331 K332 T333	A325-Y329 PolarHBondContact O-N 2.89Å; K326-Y329 PolarHBondContact O-N 3.47Å; Q327-Y329 VanDerWaalsContact C-N 3.31Å; Q327-Y329 PolarHBondContact O-N 3.3Å; Y329-S331 VanDerWaalsContact C-N 3.27Å; Y329-S331 PolarHBondContact O-N 3.06Å; Y329-K332 PolarHBondContact O-N 3.28Å; Y329-T333 HydrophobicContact CD1-CG2 4.34Å; Y329-T333 HydrophobicContact CE1-CG2 4Å; Y329-T333 PolarHBondContact O-N 3.34Å
330	L	77.5	Confident	65.2	Low	102 Å²	102	123.1 Å²	123.1	53%	0.534	64%	0.642	S	S	.	*	H	α-helix	trans	-60.3	-35.7	177.7	-64.8	170.4	0	0	0	112.5	K326 Q327 K332 T333 S334	K326-L330 HydrophobicContact CG-CD1 4.31Å; K326-L330 WeakPolarHBondContact O-CG 3.35Å; K326-L330 PolarHBondContact O-N 3.43Å; Q327-L330 PolarHBondContact O-N 2.93Å; L330-K332 PolarHBondContact O-N 3.11Å; L330-T333 PolarHBondContact O-OG1 2.75Å; L330-T333 VanDerWaalsContact O-OG1 3.14Å; L330-S334 PolarHBondContact O-N 3.44Å
331	S	71.5	Confident	63.3	Low	72 Å²	72	121 Å²	121	50%	0.503	66%	0.656	S	S	.	*	H	α-helix	trans	-68.4	-16.9	175.9	-61.1	0	0	0	0	114.2	Q327 Y329	Q327-S331 VanDerWaalsContact O-CB 3.22Å; Q327-S331 WeakPolarHBondContact O-CB 3.42Å; Q327-S331 PolarHBondContact O-N 2.86Å; Q327-S331 PolarHBondContact O-OG 2.71Å; Y329-S331 VanDerWaalsContact C-N 3.27Å; Y329-S331 PolarHBondContact O-N 3.06Å
332	K	65	Low	61.2	Low	166 Å²	166	124.3 Å²	124.3	72%	0.722	67%	0.67	S	S	*	*	H	α-helix	trans	-92.3	-41.8	176	-76.3	-178.8	174.6	-170.9	0	112	R328 Y329 L330 S334 K335	R328-K332 WeakPolarHBondContact O-CG 3.44Å; R328-K332 PolarHBondContact O-N 2.9Å; Y329-K332 PolarHBondContact O-N 3.28Å; L330-K332 PolarHBondContact O-N 3.11Å; K332-S334 VanDerWaalsContact C-N 3.25Å; K332-S334 PolarHBondContact O-N 3.07Å; K332-K335 PolarHBondContact O-N 3.45Å
333	T	54.9	Low	59.2	Low	88 Å²	88	126.9 Å²	126.9	54%	0.54	68%	0.684	S	S	.	*	H	α-helix	trans	-65.4	-29	178.9	55.3	0	0	0	0	112.7	Y329 L330 K335	Y329-T333 HydrophobicContact CD1-CG2 4.34Å; Y329-T333 HydrophobicContact CE1-CG2 4Å; Y329-T333 PolarHBondContact O-N 3.34Å; L330-T333 PolarHBondContact O-OG1 2.75Å; L330-T333 VanDerWaalsContact O-OG1 3.14Å; T333-K335 VanDerWaalsContact C-N 3.25Å; T333-K335 PolarHBondContact O-N 2.8Å
334	S	52.2	Low	57.5	Low	96 Å²	96	130.1 Å²	130.1	67%	0.671	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-3	-180	-168.4	0	0	0	0	115.7	L330 K332	L330-S334 PolarHBondContact O-N 3.44Å; K332-S334 VanDerWaalsContact C-N 3.25Å; K332-S334 PolarHBondContact O-N 3.07Å
335	K	51.9	Low	55.4	Low	168 Å²	168	133.4 Å²	133.4	73%	0.73	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.4	9.6	-170	-68.3	-166.9	176.4	-170.6	0	116.3	K332 T333	K332-K335 PolarHBondContact O-N 3.45Å; T333-K335 VanDerWaalsContact C-N 3.25Å; T333-K335 PolarHBondContact O-N 2.8Å
336	H	48.2	Very low	53.1	Low	182 Å²	182	136 Å²	136	84%	0.843	73%	0.731	S	S	*	*	S	Bend	trans	-117.8	34.1	179.1	-86.7	-85.7	0	0	0	114.3
337	K	37.9	Very low	51.1	Low	192 Å²	192	140.5 Å²	140.5	84%	0.835	74%	0.744	S	S	*	*	S	Bend	trans	-144.9	151.9	166	-107	175.3	178.3	177.4	0	110
338	L	37.1	Very low	49	Very low	176 Å²	176	142.8 Å²	142.8	92%	0.921	76%	0.759	S	S	*	*			trans	71.5	86.9	176.5	-58.5	159.2	0	0	0	116.7
339	S	35.7	Very low	47	Very low	127 Å²	127	140.7 Å²	140.7	89%	0.888	76%	0.762	S	S	*	*			trans	-163	96	141	-170.9	0	0	0	0	110.7
340	S	35.1	Very low	45.3	Very low	121 Å²	121	142.1 Å²	142.1	85%	0.846	77%	0.771	S	S	*	*			trans	-160.4	75.4	178.5	59.1	0	0	0	0	111.4
341	A	38.4	Very low	43.5	Very low	102 Å²	102	142.6 Å²	142.6	84%	0.843	78%	0.783	S	S	*	*			trans	-147.9	114.1	175.3	0	0	0	0	0	112.5
342	T	35.6	Very low	42.1	Very low	132 Å²	132	144.3 Å²	144.3	81%	0.81	80%	0.795	S	S	*	*			trans	-55.3	138	179.7	-54.6	0	0	0	0	116.5
343	S	38	Very low	40.9	Very low	114 Å²	114	144.7 Å²	144.7	80%	0.797	80%	0.797	S	S	*	*			trans	-158.5	83.2	155.3	62.8	0	0	0	0	115.6
344	Q	41.8	Very low	40.2	Very low	176 Å²	176	148.6 Å²	148.6	82%	0.822	81%	0.806	S	S	*	*			trans	37.4	159.2	148	-69.2	-68.6	-55.5	0	0	124
345	P	38.7	Very low	39.6	Very low	111 Å²	111	149.4 Å²	149.4	72%	0.721	80%	0.803	S	S	*	*			trans	-124.2	175.5	-155.8	44.9	-34.3	0	0	0	117.3
346	S	37.5	Very low	38.9	Very low	112 Å²	112	145.4 Å²	145.4	78%	0.783	80%	0.796	S	S	*	*			trans	-151.3	122.5	157.9	60.9	0	0	0	0	114.9
347	R	37.4	Very low	38.4	Very low	240 Å²	240	146.6 Å²	146.6	91%	0.906	80%	0.799	S	S	*	*			trans	20.1	142.3	143.9	-50.7	176.8	-173.7	169.8	2.5	118.5
348	I	41	Very low	38.2	Very low	166 Å²	166	141.9 Å²	141.9	85%	0.851	79%	0.79	S	S	*	*				-155.1	156.5	64.2	-81.2	163.5	0	0	0	112.3
349	N	37.4	Very low	38.1	Very low	146 Å²	146	142.7 Å²	142.7	78%	0.781	79%	0.787	S	S	*	*			trans	-85.5	163.5	-172.8	-49.2	-45.8	0	0	0	115.6
350	K	38.8	Very low	38	Very low	196 Å²	196	145.1 Å²	145.1	85%	0.852	78%	0.783	S	S	*	*				-173.9	131.4	116.2	-103.7	165.2	-176.5	178.1	0	115.1
351	S	39	Very low	37.9	Very low	111 Å²	111	148.6 Å²	148.6	78%	0.776	78%	0.778	S	S	*	*			trans	43	144.6	147.6	56.7	0	0	0	0	121.8
352	S	41.9	Very low	38	Very low	109 Å²	109	149.6 Å²	149.6	76%	0.762	78%	0.776	S	S	*	*			cis	-172.9	174	-9.4	55	0	0	0	0	106.8
353	K	39.8	Very low	38	Very low	173 Å²	173	151.6 Å²	151.6	75%	0.752	77%	0.773	S	S	*	*			cis	-178	124.6	36.1	-174.5	175	-178.3	179.7	0	111.3
354	K	41.1	Very low	38.1	Very low	171 Å²	171	155 Å²	155	74%	0.743	77%	0.774	S	S	*	*			trans	61.9	170.5	154.7	-67	-179.1	155.4	-91.5	0	117.5
355	D	39	Very low	37.9	Very low	112 Å²	112	154.1 Å²	154.1	60%	0.599	77%	0.773	S	S	*	*			cis	-166	160.7	-28.1	-100.4	-38.2	0	0	0	106.1
356	S	37.3	Very low	37.8	Very low	84 Å²	84	152 Å²	152	59%	0.587	76%	0.761	S	S	*	*			cis	-178.8	140.4	-28.2	-100.2	0	0	0	0	109.7
357	K	38.2	Very low	37.8	Very low	207 Å²	207	157 Å²	157	90%	0.9	76%	0.763	S	S	*	*			trans	71.1	162.5	164.5	-60.2	161.4	-173.5	173.5	0	116.2
358	S	33.1	Very low	37.8	Very low	94 Å²	94	151.1 Å²	151.1	66%	0.657	75%	0.749	S	S	*	*			cis	-169.5	143.5	-17.2	158	0	0	0	0	111.9
359	K	34.5	Very low	37.6	Very low	193 Å²	193	149.6 Å²	149.6	84%	0.839	74%	0.743	S	S	*	*			trans	30.4	129.5	151.4	-55.4	172.5	-177.9	-179.2	0	120.9
360	H	34.3	Very low	37.6	Very low	177 Å²	177	149.3 Å²	149.3	82%	0.819	74%	0.735	S	S	*	*				166.1	158.9	97.6	-163	-94.6	0	0	0	112.9
361	W	32.3	Very low	37.3	Very low	194 Å²	194	149.3 Å²	149.3	74%	0.735	73%	0.731	S	S	*	*			trans	-77.2	165.2	173.8	-86.8	65.1	0	0	0	113.4	K363	W361-K363 HydrophobicContact CE3-CG 4.02Å; W361-K363 HydrophobicContact CZ3-CG 3.86Å
362	P	41.5	Very low	37.3	Very low	124 Å²	124	150.6 Å²	150.6	81%	0.805	73%	0.729	S	S	*	*				-138.9	148.1	114.1	37.2	-26.7	0	0	0	115.4
363	K	35.6	Very low	36.7	Very low	173 Å²	173	155.2 Å²	155.2	75%	0.752	73%	0.731	S	S	*	*			trans	-89.2	149	155.1	-74.9	-179.3	174.8	178	0	109.1	W361	W361-K363 HydrophobicContact CE3-CG 4.02Å; W361-K363 HydrophobicContact CZ3-CG 3.86Å
364	K	39.7	Very low	36.5	Very low	186 Å²	186	153.7 Å²	153.7	81%	0.809	74%	0.736	S	S	*	*				174.8	153.1	127.4	-104.4	172.9	-179	-178.1	0	114
365	I	36.9	Very low	36.1	Very low	157 Å²	157	150.6 Å²	150.6	81%	0.805	73%	0.731	S	S	*	*			trans	72.1	140.8	146.2	-73.1	166.3	0	0	0	116.5
366	S	37.1	Very low	35.8	Very low	66 Å²	66	151.2 Å²	151.2	46%	0.462	74%	0.739	S	S	.	*			cis	179.9	131.5	-13.8	161.7	0	0	0	0	111.5
367	R	38	Very low	35.6	Very low	217 Å²	217	151.9 Å²	151.9	82%	0.819	74%	0.744	S	S	*	*			trans	65.3	163.5	152.4	-67.7	175.8	-171.6	129.6	-6.5	116
368	N	37.8	Very low	35.4	Very low	117 Å²	117	147.4 Å²	147.4	63%	0.626	74%	0.739	S	S	*	*			cis	-158.3	152.9	-8.2	-121.5	11.1	0	0	0	110.7
369	N	36.7	Very low	35.6	Very low	134 Å²	134	147.7 Å²	147.7	72%	0.717	74%	0.741	S	S	*	*			trans	56.8	161.1	139.1	-69.3	4.7	0	0	0	122.3
370	K	37.7	Very low	35.6	Very low	141 Å²	141	144.6 Å²	144.6	61%	0.613	74%	0.738	S	S	*	*			cis	-172.6	113.6	-28.4	177.2	-164.8	175.4	-161.4	0	109.1
371	Y	32.4	Very low	35.8	Very low	195 Å²	195	141.1 Å²	141.1	77%	0.765	73%	0.734	S	S	*	*			trans	61.3	-178.6	153.7	-58.9	-155.1	0	0	0	113.4
372	D	38	Very low	36.1	Very low	139 Å²	139	139.4 Å²	139.4	74%	0.743	73%	0.732	S	S	*	*			cis	-137.4	167.7	6.8	-109.8	-54.7	0	0	0	112.3
373	Y	29.5	Very low	35.9	Very low	206 Å²	206	139.7 Å²	139.7	81%	0.808	72%	0.722	S	S	*	*			trans	-81.6	155.5	177.1	-137.4	-105.8	0	0	0	111.1
374	V	36	Very low	36	Very low	140 Å²	140	137.5 Å²	137.5	85%	0.848	72%	0.719	S	S	*	*			trans	-178.4	138.9	134.5	141.7	0	0	0	0	111.1
375	T	32.1	Very low	36	Very low	106 Å²	106	136.8 Å²	136.8	65%	0.65	72%	0.718	S	S	*	*			trans	-101.1	141.6	176.8	-53.5	0	0	0	0	110
376	T	33.3	Very low	36.1	Very low	125 Å²	125	134.3 Å²	134.3	77%	0.767	71%	0.71	S	S	*	*			trans	177.2	130.8	131.1	33.5	0	0	0	0	114.9
377	S	33.6	Very low	36.1	Very low	98 Å²	98	137.2 Å²	137.2	69%	0.685	72%	0.72	S	S	*	*				64.5	107.5	129.8	-51.3	0	0	0	0	123.9
378	S	33.6	Very low	36.2	Very low	114 Å²	114	134 Å²	134	80%	0.797	72%	0.715	S	S	*	*				86.9	169.6	113.8	78.1	0	0	0	0	122.8
379	S	36.7	Very low	36.2	Very low	99 Å²	99	133.9 Å²	133.9	69%	0.692	71%	0.714	S	S	*	*			trans	66.8	95.3	170.6	67.1	0	0	0	0	120.9
380	T	34.3	Very low	36.4	Very low	128 Å²	128	133.8 Å²	133.8	79%	0.785	71%	0.712	S	S	*	*				20.9	128.7	120.5	57	0	0	0	0	119.8
381	S	38.3	Very low	36.4	Very low	105 Å²	105	131.4 Å²	131.4	73%	0.734	71%	0.71	S	S	*	*				169.4	150.5	88	60.5	0	0	0	0	115
382	K	39.2	Very low	36.5	Very low	157 Å²	157	132.9 Å²	132.9	68%	0.683	71%	0.714	S	S	*	*			trans	59.6	130.4	137.9	-79.3	167.6	153	-79.3	0	123.4
383	E	37.6	Very low	36.5	Very low	130 Å²	130	135.9 Å²	135.9	61%	0.607	72%	0.72	S	S	*	*				81.1	106.7	127.3	-69.9	158.2	176.2	0	0	122.2
384	D	37.4	Very low	37	Very low	128 Å²	128	131.2 Å²	131.2	68%	0.684	72%	0.718	S	S	*	*				85.3	152.5	123.9	-61	-19.6	0	0	0	123.8
385	H	40.7	Very low	37	Very low	171 Å²	171	132.8 Å²	132.8	79%	0.792	72%	0.716	S	S	*	*			trans	74	144.9	158.9	-66.8	-47.7	0	0	0	120.4
386	V	38.5	Very low	37.3	Very low	104 Å²	104	132.7 Å²	132.7	63%	0.63	72%	0.717	S	S	*	*			cis	-168.2	154.2	-24.4	78.5	0	0	0	0	110.3
387	N	36.1	Very low	37.2	Very low	127 Å²	127	130.7 Å²	130.7	68%	0.679	71%	0.708	S	S	*	*			trans	64.9	163.6	159.5	-71.7	-6.4	0	0	0	117.6
388	Q	40.3	Very low	37.3	Very low	150 Å²	150	133 Å²	133	70%	0.701	71%	0.713	S	S	*	*			cis	-168.4	171.7	-8.9	-114.4	-179.1	-68.3	0	0	108
389	D	38.5	Very low	37.3	Very low	114 Å²	114	133.2 Å²	133.2	61%	0.61	71%	0.713	S	S	*	*			cis	-170	-170.2	-14.1	-152.4	-34.1	0	0	0	108.1
390	I	40.1	Very low	36.9	Very low	133 Å²	133	139.3 Å²	139.3	68%	0.682	72%	0.721	S	S	*	*			trans	67.6	130	143.7	-72.1	160.6	0	0	0	118.4
391	T	37.3	Very low	36.9	Very low	91 Å²	91	141.4 Å²	141.4	56%	0.558	73%	0.726	S	S	*	*			cis	-163.9	153.1	-10.8	28.2	0	0	0	0	114
392	R	34.8	Very low	36.4	Very low	225 Å²	225	140.7 Å²	140.7	85%	0.849	72%	0.721	S	S	*	*			trans	47.6	121.4	135.6	-57.3	163.5	-169	175.2	4.4	122
393	K	39.4	Very low	36.4	Very low	202 Å²	202	142.6 Å²	142.6	88%	0.878	73%	0.732	S	S	*	*				168.9	147.6	112.5	-93.2	171.8	179.7	-179.9	0	110.1
394	S	39.8	Very low	36	Very low	109 Å²	109	143.6 Å²	143.6	76%	0.762	74%	0.737	S	S	*	*			cis	-163.3	145.5	-20.4	39.3	0	0	0	0	111.1
395	Q	35.3	Very low	35.9	Very low	173 Å²	173	147.4 Å²	147.4	81%	0.808	75%	0.747	S	S	*	*			trans	-63.9	175.6	166.1	-89.2	-90.9	-43.4	0	0	111.9
396	P	38.3	Very low	35.3	Very low	104 Å²	104	142.3 Å²	142.3	68%	0.675	73%	0.731	S	S	*	*			cis	-148.3	-178.6	32.2	45.8	-25.3	0	0	0	119.4
397	S	31.9	Very low	34.8	Very low	83 Å²	83	147 Å²	147	58%	0.58	74%	0.739	S	S	*	*			trans	33.5	159.8	137.2	80.2	0	0	0	0	121.8
398	D	34.4	Very low	34.5	Very low	146 Å²	146	147.2 Å²	147.2	78%	0.781	74%	0.74	S	S	*	*			cis	-137.6	-173.5	14.8	-87.8	-73.4	0	0	0	109.2
399	C	34	Very low	33.9	Very low	118 Å²	118	144.4 Å²	144.4	80%	0.797	74%	0.737	S	S	*	*			cis	-155.2	170.5	17.9	-158.5	0	0	0	0	112.4
400	R	27.9	Very low	33.3	Very low	228 Å²	228	145 Å²	145	86%	0.86	74%	0.738	S	S	*	*			trans	-76.8	151.9	173.5	-58.6	168.6	173.4	175.5	-4.1	111.9
401	L	34.9	Very low	32.7	Very low	171 Å²	171	147.9 Å²	147.9	90%	0.895	74%	0.742	S	S	*	*				-153.8	153.7	123.8	-137.2	73.8	0	0	0	111.9
402	S	29	Very low	32.5	Very low	90 Å²	90	152.9 Å²	152.9	63%	0.629	76%	0.756	S	S	*	*			trans	-106.7	144.5	-174.5	53.4	0	0	0	0	112.3
403	H	38.3	Very low	32.3	Very low	198 Å²	198	151.6 Å²	151.6	92%	0.917	76%	0.757	S	S	*	*			trans	-139.7	151.3	142.4	-94.4	-66.3	0	0	0	111.1
404	Q	28.4	Very low	31.9	Very low	151 Å²	151	145.6 Å²	145.6	71%	0.706	74%	0.74	S	S	*	*			trans	-144	122.4	-154.2	177.8	-174.9	13.2	0	0	109.9
405	K	36.8	Very low	31.5	Very low	208 Å²	208	148.2 Å²	148.2	90%	0.904	74%	0.741	S	S	*	*			trans	-172.3	93.6	169.8	-101.1	172.1	-174.9	-177.7	0	106.1
406	S	27.9	Very low	31.3	Very low	64 Å²	64	144.6 Å²	144.6	45%	0.448	73%	0.734	S	S	.	*			cis	78.9	116.8	20.8	92.7	0	0	0	0	116.2
407	Y	26.8	Very low	31.1	Very low	201 Å²	201	146 Å²	146	79%	0.788	73%	0.731	S	S	*	*			trans	66.6	153.6	165.8	-50	-61	0	0	0	114.9
408	N	29.7	Very low	31.3	Very low	133 Å²	133	149.6 Å²	149.6	71%	0.711	74%	0.737	S	S	*	*			cis	-153.7	156.1	-4.2	-114.6	-1	0	0	0	105.6
409	S	29.6	Very low	31.4	Very low	90 Å²	90	149.3 Å²	149.3	63%	0.629	73%	0.731	S	S	*	*			cis	69.2	119.3	40.4	-150.3	0	0	0	0	116
410	I	25.9	Very low	31.6	Very low	126 Å²	126	151.2 Å²	151.2	65%	0.646	73%	0.728	S	S	*	*			trans	71.3	145.4	165.2	-16	179.6	0	0	0	119.9
411	Y	27.5	Very low	32.2	Very low	194 Å²	194	145.5 Å²	145.5	76%	0.761	72%	0.721	S	S	*	*			trans	74.6	113.1	169.4	-56.4	-72.9	0	0	0	117.3
412	K	32.3	Very low	32.5	Very low	196 Å²	196	141.9 Å²	141.9	85%	0.852	71%	0.71	S	S	*	*				72.6	100.6	59.4	-77.2	-163.3	170.2	-171.2	0	114.8
413	K	30.5	Very low	33.2	Very low	199 Å²	199	144.1 Å²	144.1	87%	0.865	72%	0.715	S	S	*	*			trans	-168.5	136.6	148.5	-139.7	157.6	-178.2	-177.1	0	107.7
414	S	31.4	Very low	33.2	Very low	76 Å²	76	139 Å²	139	53%	0.531	70%	0.701	S	S	.	*			cis	-157.4	170.5	-3.3	-120.7	0	0	0	0	111.8
415	E	30.2	Very low	33.7	Very low	164 Å²	164	139.7 Å²	139.7	77%	0.766	70%	0.704	S	S	*	*			trans	18.1	139.1	141	-61.7	144.3	142.5	0	0	119.6
416	S	31.9	Very low	33.8	Very low	96 Å²	96	134.3 Å²	134.3	67%	0.671	69%	0.689	S	S	*	*			cis	-166.5	-161	-9.5	-70.1	0	0	0	0	106.2
417	E	34.2	Very low	34.4	Very low	133 Å²	133	138.9 Å²	138.9	62%	0.621	70%	0.703	S	S	*	*			cis	-164.2	136.6	-0.2	-148.6	156.8	113.5	0	0	112.2
418	K	36.3	Very low	34.8	Very low	160 Å²	160	135.9 Å²	135.9	70%	0.696	70%	0.696	S	S	*	*			trans	62	159.6	156.9	-70	163.7	-172.1	159.2	0	117.8
419	Q	36.7	Very low	35.2	Very low	140 Å²	140	136.6 Å²	136.6	65%	0.654	70%	0.695	S	S	*	*			cis	-164.6	157.5	-9.1	-108.1	175	-76	0	0	107.5
420	E	37	Very low	35.7	Very low	157 Å²	157	138.3 Å²	138.3	73%	0.734	70%	0.697	S	S	*	*			cis	-145.3	-103.2	-11.7	-163.8	133.7	-111.3	0	0	113.4
421	P	41.9	Very low	36.6	Very low	109 Å²	109	140.2 Å²	140.2	71%	0.708	70%	0.704	S	S	*	*			trans	-133.4	-153.8	-164.6	46.9	-25.3	0	0	0	115.8
422	S	39.9	Very low	36.9	Very low	95 Å²	95	133.7 Å²	133.7	66%	0.664	70%	0.695	S	S	*	*			trans	78.5	130.3	162.8	-77.7	0	0	0	0	118.6
423	D	43.5	Very low	37.3	Very low	137 Å²	137	129.9 Å²	129.9	73%	0.733	69%	0.693	S	S	*	*			cis	-145.7	154.6	1	-81.7	-39.6	0	0	0	113
424	S	38.2	Very low	37.5	Very low	90 Å²	90	125.8 Å²	125.8	63%	0.629	69%	0.685	S	S	*	*				21.7	153.3	126.9	-43.9	0	0	0	0	121.4
425	E	40.1	Very low	37.6	Very low	166 Å²	166	126.9 Å²	126.9	78%	0.776	69%	0.692	S	S	*	*			cis	-170.7	172.5	1.6	-122.5	162.8	177.5	0	0	112.3
426	T	39.6	Very low	38.1	Very low	95 Å²	95	125.4 Å²	125.4	58%	0.583	69%	0.689	S	S	*	*			trans	62.3	103.9	140	-65.3	0	0	0	0	118.9
427	E	38.7	Very low	38.4	Very low	159 Å²	159	129 Å²	129	74%	0.743	70%	0.695	S	S	*	*				82.6	166.2	96.3	-78.3	168.8	-152.7	0	0	112.9
428	Q	35.1	Very low	38.6	Very low	139 Å²	139	127.7 Å²	127.7	65%	0.65	70%	0.701	S	S	*	*			cis	-172.9	-177	-26.8	-175	169.6	-95.1	0	0	104.8
429	E	39.8	Very low	38.9	Very low	148 Å²	148	124.8 Å²	124.8	69%	0.692	70%	0.701	S	S	*	*			trans	68.7	155.7	163.4	-75.3	145.7	-139.7	0	0	115.9
430	D	40	Very low	39.1	Very low	125 Å²	125	124.7 Å²	124.7	67%	0.668	71%	0.71	S	S	*	*			cis	-153.1	163	0.3	-135.9	-9.2	0	0	0	114
431	E	43.2	Very low	39.2	Very low	167 Å²	167	123 Å²	123	78%	0.78	71%	0.706	S	S	*	*			trans	49.7	155	158.3	-60.9	-63.5	177.6	0	0	121.4
432	G	34.9	Very low	39.2	Very low	57 Å²	57	125.4 Å²	125.4	59%	0.588	71%	0.705	S	S	*	*			cis	153.5	147.2	-6.5	0	0	0	0	0	114.9
433	S	40.2	Very low	39.2	Very low	115 Å²	115	128.6 Å²	128.6	80%	0.804	71%	0.71	S	S	*	*			trans	69.4	163.7	158.9	-170	0	0	0	0	120.4
434	T	34.2	Very low	39	Very low	113 Å²	113	128 Å²	128	69%	0.693	71%	0.705	S	S	*	*				-163.9	171.9	-62.7	-32.6	0	0	0	0	106.9
435	C	34.4	Very low	39	Very low	99 Å²	99	130.4 Å²	130.4	67%	0.669	71%	0.711	S	S	*	*			trans	69	150.6	152.9	-70.1	0	0	0	0	118.4
436	D	40.5	Very low	38.7	Very low	133 Å²	133	128.9 Å²	128.9	71%	0.711	71%	0.713	S	S	*	*			cis	-147.5	138.2	-15.5	-83	-32	0	0	0	106.4
437	E	38.4	Very low	38.6	Very low	171 Å²	171	130.1 Å²	130.1	80%	0.799	72%	0.723	S	S	*	*				80.4	126.7	74.1	-148.9	-170.1	-154.5	0	0	116.1
438	S	38.5	Very low	38.3	Very low	106 Å²	106	127.7 Å²	127.7	74%	0.741	72%	0.723	S	S	*	*			trans	72	158	164.8	87.2	0	0	0	0	118.1
439	S	42.8	Very low	38.3	Very low	99 Å²	99	126.6 Å²	126.6	69%	0.692	73%	0.731	S	S	*	*			cis	-168.9	166.1	-26.1	-101.4	0	0	0	0	111.9
440	T	40.3	Very low	38.1	Very low	138 Å²	138	126 Å²	126	85%	0.847	74%	0.738	S	S	*	*			trans	85.9	143.5	163.2	70.1	0	0	0	0	120.3
441	D	39.7	Very low	38.1	Very low	121 Å²	121	126 Å²	126	65%	0.647	74%	0.744	S	S	*	*			cis	-167.7	153.1	-27.7	-168	10.4	0	0	0	109.9
442	K	42.6	Very low	37.6	Very low	161 Å²	161	123.7 Å²	123.7	70%	0.7	75%	0.747	S	S	*	*			trans	65.4	148.3	167.6	-37.7	-173.1	-170.9	178.9	0	116.6
443	Q	39.9	Very low	37.4	Very low	162 Å²	162	127.1 Å²	127.1	76%	0.757	76%	0.756	S	S	*	*			cis	-169.5	160.6	-13.8	-112.4	176.5	-62.8	0	0	106.4
444	I	38	Very low	37.2	Very low	123 Å²	123	128.3 Å²	128.3	63%	0.631	76%	0.758	S	S	*	*			cis	-153.7	158.2	5.6	-151.8	170.2	0	0	0	110.9
445	D	37.5	Very low	37.1	Very low	141 Å²	141	126.7 Å²	126.7	75%	0.754	76%	0.757	S	S	*	*			trans	26.9	114	156.8	-55	-10.4	0	0	0	123.7
446	T	33.9	Very low	37.2	Very low	135 Å²	135	130.8 Å²	130.8	83%	0.828	77%	0.768	S	S	*	*			trans	-69.9	166.7	143.2	11	0	0	0	0	111.2
447	P	38.4	Very low	36.9	Very low	121 Å²	121	129.8 Å²	129.8	79%	0.786	77%	0.77	S	S	*	*				-156.7	178.9	54	43.5	-20.7	0	0	0	120.2
448	S	31.6	Very low	36.8	Very low	107 Å²	107	129.8 Å²	129.8	75%	0.748	77%	0.773	S	S	*	*			trans	-20	137.6	158.4	165.1	0	0	0	0	119.3
449	S	35.1	Very low	36.9	Very low	117 Å²	117	129.9 Å²	129.9	82%	0.818	77%	0.773	S	S	*	*			trans	-165.7	170.4	132	-86.9	0	0	0	0	114.3
450	T	36.8	Very low	36.6	Very low	136 Å²	136	132 Å²	132	83%	0.834	78%	0.776	S	S	*	*			trans	-77	164.3	-173.3	32.1	0	0	0	0	115.2
451	P	38.9	Very low	36.7	Very low	124 Å²	124	132.1 Å²	132.1	81%	0.805	78%	0.777	S	S	*	*			trans	-86.9	143.8	-167.9	33.6	-36.2	0	0	0	114.9
452	S	33	Very low	36.8	Very low	119 Å²	119	134.1 Å²	134.1	83%	0.832	78%	0.783	S	S	*	*			trans	-156.7	149.3	156.6	-166.1	0	0	0	0	113.3
453	T	31.1	Very low	36.6	Very low	128 Å²	128	133 Å²	133	79%	0.785	78%	0.784	S	S	*	*			trans	-49.7	132.8	176.3	-55.7	0	0	0	0	116.1
454	V	35.3	Very low	36.4	Very low	140 Å²	140	134.7 Å²	134.7	85%	0.848	79%	0.789	S	S	*	*			trans	-139.4	141.5	141.8	179	0	0	0	0	108.2
455	A	32.5	Very low	36.3	Very low	80 Å²	80	136.9 Å²	136.9	66%	0.661	80%	0.802	S	S	*	*			trans	-111.6	155	175.3	0	0	0	0	0	111.2
456	M	36.1	Very low	36.6	Very low	184 Å²	184	137.6 Å²	137.6	91%	0.906	80%	0.804	S	S	*	*			trans	-133.9	154.4	165.6	-80.5	-68.2	-81.4	0	0	109.4
457	C	35.3	Very low	36.7	Very low	112 Å²	112	141.6 Å²	141.6	76%	0.757	80%	0.804	S	S	*	*			trans	-110.6	-163.2	-150.6	-55.5	0	0	0	0	114.7
458	M	36.7	Very low	36.9	Very low	172 Å²	172	143.4 Å²	143.4	85%	0.847	81%	0.807	S	S	*	*			trans	88.4	134.7	172.2	-45.8	-164.7	76.4	0	0	114.5
459	S	39.6	Very low	37.6	Very low	107 Å²	107	145.7 Å²	145.7	75%	0.748	81%	0.811	S	S	*	*			cis	-138.3	164.5	10	-46.3	0	0	0	0	112.9
460	D	37.2	Very low	37.9	Very low	143 Å²	143	149.8 Å²	149.8	77%	0.765	82%	0.817	S	S	*	*			trans	-92.4	150.7	-167.3	-40.4	-95.4	0	0	0	114.9
461	V	41.3	Very low	38.4	Very low	142 Å²	142	152.5 Å²	152.5	86%	0.861	82%	0.817	S	S	*	*			trans	-148	103.8	152.7	-175.1	0	0	0	0	111.2
462	E	42.9	Very low	38.2	Very low	163 Å²	163	151.8 Å²	151.8	76%	0.762	82%	0.815	S	S	*	*			trans	30.6	115.1	146.6	-58.8	-60.3	123.3	0	0	122.6
463	D	36.9	Very low	38.7	Very low	137 Å²	137	154.9 Å²	154.9	73%	0.733	82%	0.816	S	S	*	*			trans	27.1	125.9	130.6	-85.8	19.9	0	0	0	122.6
464	F	37.1	Very low	39	Very low	197 Å²	197	157 Å²	157	86%	0.864	82%	0.815	S	S	*	*				-173	112.9	106.7	-107.2	-72.6	0	0	0	110.9
465	L	35.6	Very low	39	Very low	170 Å²	170	157 Å²	157	89%	0.89	82%	0.815	S	S	*	*			trans	-131.6	121	171.7	-83.1	177.3	0	0	0	112.4
466	I	42.3	Very low	38.9	Very low	155 Å²	155	159.1 Å²	159.1	80%	0.795	81%	0.814	S	S	*	*			trans	-89.4	136.6	167.5	-63.3	175.7	0	0	0	108.4
467	R	36	Very low	39.1	Very low	220 Å²	220	154.5 Å²	154.5	83%	0.83	81%	0.805	S	S	*	*			trans	-100.2	143.7	171.8	-79.8	169.6	-83.4	161.5	-7.1	109.7
468	D	44.7	Very low	39.2	Very low	159 Å²	159	154.9 Å²	154.9	85%	0.85	80%	0.8	S	S	*	*			trans	-131.9	142.9	157.2	-85.6	-56.1	0	0	0	107.7
469	D	45.6	Very low	39.3	Very low	155 Å²	155	153.3 Å²	153.3	83%	0.829	80%	0.795	S	S	*	*			trans	-92.3	138.1	-163.8	-59.7	-63.4	0	0	0	114.1
470	E	40.8	Very low	39.4	Very low	202 Å²	202	155.9 Å²	155.9	94%	0.944	80%	0.8	S	S	*	*			trans	-81.5	130.4	160.3	-76.6	-157.1	140	0	0	111
471	K	47.5	Very low	39.2	Very low	193 Å²	193	156 Å²	156	84%	0.839	80%	0.801	S	S	*	*			trans	-107.3	118.5	175.7	-172.1	-176.1	175.9	-166.9	0	111.1
472	S	34.8	Very low	39	Very low	110 Å²	110	152.9 Å²	152.9	77%	0.769	79%	0.79	S	S	*	*			trans	-77.8	149.5	176.1	57.1	0	0	0	0	113.3
473	E	42.7	Very low	38.7	Very low	184 Å²	184	151.5 Å²	151.5	86%	0.86	79%	0.793	S	S	*	*			trans	-147.3	144.2	155.1	-163.5	141.9	-145.5	0	0	109.6
474	K	37.3	Very low	38.4	Very low	173 Å²	173	152.4 Å²	152.4	75%	0.752	80%	0.797	S	S	*	*			trans	-147.2	129.6	-166.5	173.7	-171.2	175	-175.9	0	110.5
475	T	37.2	Very low	38.2	Very low	138 Å²	138	148.3 Å²	148.3	85%	0.847	79%	0.793	S	S	*	*			trans	-147.6	147.6	169.1	-44.1	0	0	0	0	109.8
476	I	30	Very low	38.2	Very low	125 Å²	125	145.8 Å²	145.8	64%	0.641	79%	0.785	S	S	*	*			trans	-138.5	135.4	-170.9	-62.8	173.4	0	0	0	110.4
477	A	39.7	Very low	37.9	Very low	87 Å²	87	145.3 Å²	145.3	72%	0.719	78%	0.783	S	S	*	*			trans	-162.2	138.8	148	0	0	0	0	0	106.8
478	N	36.8	Very low	38	Very low	121 Å²	121	140.5 Å²	140.5	65%	0.647	77%	0.774	S	S	*	*			cis	68.6	124.5	45.9	-70.4	77.7	0	0	0	112.7
479	D	39.3	Very low	37.6	Very low	139 Å²	139	138.4 Å²	138.4	74%	0.743	76%	0.763	S	S	*	*			cis	-146.6	-166	-10.4	-76.5	-49.4	0	0	0	106.9
480	D	41.8	Very low	37.2	Very low	161 Å²	161	138.2 Å²	138.2	86%	0.861	76%	0.762	S	S	*	*			cis	-154.5	-138.6	12	-165.8	-5.8	0	0	0	110.8
481	N	33.4	Very low	36.8	Very low	145 Å²	145	139.5 Å²	139.5	78%	0.775	76%	0.758	S	S	*	*			trans	-140.5	174	-160.7	-177.2	27.6	0	0	0	114.8
482	A	36	Very low	36.6	Very low	77 Å²	77	135.1 Å²	135.1	64%	0.636	75%	0.749	S	S	*	*			trans	77.4	156.7	169.1	0	0	0	0	0	117.2
483	T	37.4	Very low	36.5	Very low	134 Å²	134	134.1 Å²	134.1	82%	0.822	75%	0.747	S	S	*	*			cis	-146.5	175.8	9.8	-30	0	0	0	0	112.3
484	N	29.9	Very low	35.9	Very low	155 Å²	155	131.8 Å²	131.8	83%	0.829	75%	0.746	S	S	*	*			trans	-91.3	-171.3	-174.2	-60.6	-55.5	0	0	0	115.5
485	S	34.2	Very low	35.7	Very low	111 Å²	111	129.5 Å²	129.5	78%	0.776	75%	0.747	S	S	*	*			trans	86.6	143.8	162.4	133.3	0	0	0	0	116.4
486	T	34.8	Very low	35.6	Very low	117 Å²	117	129.8 Å²	129.8	72%	0.718	74%	0.742	S	S	*	*			cis	-156.7	173.6	1.5	-85.4	0	0	0	0	111.1
487	L	35.5	Very low	35.9	Very low	146 Å²	146	129 Å²	129	76%	0.764	74%	0.744	S	S	*	*			trans	-39.5	173.3	167.2	-60	156.6	0	0	0	115.9
488	D	37.8	Very low	35.7	Very low	118 Å²	118	131.3 Å²	131.3	63%	0.631	75%	0.745	S	S	*	*			cis	-172.5	173.4	37.5	-141.2	-6.8	0	0	0	116.8
489	N	37.5	Very low	35.9	Very low	115 Å²	115	133.5 Å²	133.5	62%	0.615	75%	0.751	S	S	*	*			trans	72.5	121.4	149.5	-63	-34.7	0	0	0	126.9
490	D	37.3	Very low	35.9	Very low	152 Å²	152	134.5 Å²	134.5	81%	0.813	76%	0.757	S	S	*	*				86.5	173.1	124.4	-66.9	-32.3	0	0	0	127.1
491	R	32.9	Very low	35.5	Very low	229 Å²	229	130.2 Å²	130.2	86%	0.864	75%	0.75	S	S	*	*			trans	-167.4	178.9	-140	-154	162.2	147.6	-98	-1.5	108.3
492	P	41.5	Very low	35.9	Very low	101 Å²	101	131.6 Å²	131.6	66%	0.656	76%	0.756	S	S	*	*			cis	-140.4	164.5	6.2	45.1	-26.7	0	0	0	119.8
493	A	33.1	Very low	35.7	Very low	88 Å²	88	134.7 Å²	134.7	73%	0.727	76%	0.761	S	S	*	*			trans	55.5	160.7	136.3	0	0	0	0	0	125.9
494	T	29.9	Very low	35.6	Very low	135 Å²	135	131.9 Å²	131.9	83%	0.828	76%	0.76	S	S	*	*			trans	74.2	145.9	167.1	5.5	0	0	0	0	115.8
495	T	33.4	Very low	35.7	Very low	125 Å²	125	133.7 Å²	133.7	77%	0.767	76%	0.756	S	S	*	*			cis	-149	167	14.5	-57	0	0	0	0	111.3
496	I	35.7	Very low	35.9	Very low	145 Å²	145	136.1 Å²	136.1	74%	0.744	76%	0.76	S	S	*	*			trans	-118.8	139.5	172.8	-43.2	168	0	0	0	109.6
497	P	36.9	Very low	35.8	Very low	107 Å²	107	135.3 Å²	135.3	70%	0.695	76%	0.76	S	S	*	*				-136.6	143	113.5	16.5	5.3	0	0	0	111.3
498	D	34.1	Very low	35.9	Very low	136 Å²	136	137.9 Å²	137.9	73%	0.727	77%	0.768	S	S	*	*				110.1	-178.6	58.2	-67.8	-30	0	0	0	110.1
499	E	42.7	Very low	35.5	Very low	168 Å²	168	137.4 Å²	137.4	79%	0.785	77%	0.773	S	S	*	*			trans	76.8	95.4	178.3	-48.9	-57.1	93.7	0	0	120.4
500	D	37.5	Very low	35.5	Very low	160 Å²	160	141 Å²	141	86%	0.856	79%	0.786	S	S	*	*				46.6	130.7	125.9	-71.9	14.1	0	0	0	125
501	G	33.5	Very low	35.2	Very low	70 Å²	70	141.7 Å²	141.7	72%	0.722	78%	0.783	S	S	*	*				141	123.4	124	0	0	0	0	0	120.3
502	I	41.5	Very low	35.3	Very low	174 Å²	174	138.4 Å²	138.4	89%	0.892	78%	0.781	S	S	*	*			trans	82.4	125.9	151.8	-53.8	172.8	0	0	0	118.4
503	D	31.8	Very low	34.6	Very low	142 Å²	142	138.6 Å²	138.6	76%	0.759	78%	0.781	S	S	*	*			trans	-79.8	163	-175.8	-59.1	-90.4	0	0	0	116.4
504	G	37.2	Very low	34.8	Very low	76 Å²	76	143.3 Å²	143.3	78%	0.784	79%	0.793	S	S	*	*			trans	-171.4	59.3	175.1	0	0	0	0	0	114.9
505	Y	32	Very low	35	Very low	193 Å²	193	142.4 Å²	142.4	76%	0.757	79%	0.792	S	S	*	*			trans	-65.9	141.9	177.1	-80.3	-92	0	0	0	113.2
506	N	36.5	Very low	34.9	Very low	161 Å²	161	141 Å²	141	86%	0.861	79%	0.787	S	S	*	*			trans	-146.8	116.6	153.8	-94.5	-49.4	0	0	0	109.6
507	S	33	Very low	34.7	Very low	101 Å²	101	141.6 Å²	141.6	71%	0.706	79%	0.792	S	S	*	*			trans	-121.3	105.7	174.5	-66.9	0	0	0	0	108.9	S509	S507-S509 PolarHBondContact O-N 3.38Å
508	E	38	Very low	34.7	Very low	199 Å²	199	141.4 Å²	141.4	93%	0.93	80%	0.799	S	S	*	*			trans	-76.2	120.7	178	-67.9	-175.7	138.4	0	0	110.9
509	S	29.2	Very low	34.7	Very low	108 Å²	108	141.4 Å²	141.4	76%	0.755	80%	0.804	S	S	*	*			trans	-140	94.1	173	49.7	0	0	0	0	110.1	S507 K511	S507-S509 PolarHBondContact O-N 3.38Å; S509-K511 PolarHBondContact O-N 3.45Å
510	E	38.5	Very low	34.3	Very low	190 Å²	190	138.5 Å²	138.5	89%	0.888	80%	0.802	S	S	*	*			trans	-79.8	101.8	-177.9	-69.7	-159.2	129.3	0	0	112.2
511	K	29.6	Very low	34	Very low	168 Å²	168	135.3 Å²	135.3	73%	0.73	79%	0.792	S	S	*	*			trans	-108.5	105.1	167.4	175.2	-176.7	177.7	-70.1	0	109.1	S509	S509-K511 PolarHBondContact O-N 3.45Å
512	L	35.1	Very low	34	Very low	160 Å²	160	139.5 Å²	139.5	84%	0.838	80%	0.797	S	S	*	*			trans	-121	118.1	173.5	-72.8	178.4	0	0	0	112.5
513	T	26.6	Very low	33.4	Very low	105 Å²	105	136.3 Å²	136.3	64%	0.644	79%	0.791	S	S	*	*			trans	-120.1	122.9	174.6	45.6	0	0	0	0	108.5
514	L	37.9	Very low	33.4	Very low	187 Å²	187	135.8 Å²	135.8	98%	0.979	79%	0.792	S	S	*	*			trans	-141.5	168.2	167.6	-79.3	-176.1	0	0	0	111.5
515	S	33.6	Very low	33.3	Very low	115 Å²	115	141.7 Å²	141.7	80%	0.804	80%	0.8	S	S	*	*			trans	-105.1	168.7	-155.1	-163.6	0	0	0	0	115
516	S	31.2	Very low	33.4	Very low	96 Å²	96	136.7 Å²	136.7	67%	0.671	80%	0.798	S	S	*	*			trans	-60	157	169.4	-51.7	0	0	0	0	113.8
517	D	33.3	Very low	33.3	Very low	157 Å²	157	136.4 Å²	136.4	84%	0.84	80%	0.802	S	S	*	*				180	175.5	106.1	-89.1	-16.4	0	0	0	113.1
518	A	36.4	Very low	33.4	Very low	104 Å²	104	134.3 Å²	134.3	86%	0.86	80%	0.797	S	S	*	*			trans	82.3	115.4	171	0	0	0	0	0	119.4
519	V	32.6	Very low	33.3	Very low	136 Å²	136	131.3 Å²	131.3	82%	0.824	78%	0.783	S	S	*	*			trans	-92.7	172.8	-173.3	-74.5	0	0	0	0	115.2
520	S	35.3	Very low	33.6	Very low	107 Å²	107	132.5 Å²	132.5	75%	0.748	79%	0.786	S	S	*	*			trans	80.7	155.3	151.1	-63.9	0	0	0	0	120.1
521	S	31.6	Very low	33.4	Very low	92 Å²	92	130.1 Å²	130.1	64%	0.643	78%	0.779	S	S	*	*			cis	-177.1	149.1	-25.6	-94.5	0	0	0	0	111.1
522	L	32.6	Very low	33.5	Very low	159 Å²	159	128 Å²	128	83%	0.832	78%	0.784	S	S	*	*			trans	60.8	165.6	163.8	-84	78.6	0	0	0	116.9
523	S	30	Very low	33.3	Very low	107 Å²	107	128.1 Å²	128.1	75%	0.748	78%	0.78	S	S	*	*			cis	-157.1	176	-25.3	-109.2	0	0	0	0	110.8
524	T	32	Very low	33.7	Very low	130 Å²	130	130.1 Å²	130.1	80%	0.798	79%	0.792	S	S	*	*			trans	-89.5	153	-175.5	51.1	0	0	0	0	115.9
525	E	34	Very low	33.3	Very low	201 Å²	201	127.1 Å²	127.1	94%	0.939	77%	0.773	S	S	*	*			trans	-162.3	-173.9	138.5	-119	173.2	-149.2	0	0	114.3
526	A	34.5	Very low	33.6	Very low	88 Å²	88	131.1 Å²	131.1	73%	0.727	78%	0.779	S	S	*	*			trans	-137	-167.5	-141.4	0	0	0	0	0	118
527	V	34.7	Very low	33.7	Very low	154 Å²	154	133.3 Å²	133.3	93%	0.933	78%	0.776	S	S	*	*			trans	76.7	145.8	-178.1	-172.2	0	0	0	0	113.7
528	G	34.1	Very low	33.8	Very low	58 Å²	58	133.9 Å²	133.9	60%	0.598	78%	0.778	S	S	*	*			cis	155.3	172.7	-2.9	0	0	0	0	0	109.6
529	E	36.4	Very low	33.6	Very low	136 Å²	136	134.1 Å²	134.1	64%	0.636	77%	0.773	S	S	*	*			cis	-169.4	-177.2	-24.1	-152.6	51.4	77.5	0	0	107.6	K301	K301-E529 IonicContact NZ-OE1 2.83Å; K301-E529 PolarHBondContact NZ-OE1 3.07Å; K301-E529 IonicContact NZ-OE2 2.94Å; K301-E529 PolarHBondContact NZ-OE2 3.16Å
530	T	36.2	Very low	33.6	Very low	133 Å²	133	135.8 Å²	135.8	82%	0.816	78%	0.775	S	S	*	*			trans	67.6	160.4	179.9	69.5	0	0	0	0	118.7
531	D	33.8	Very low	33.3	Very low	139 Å²	139	136 Å²	136	74%	0.743	78%	0.777	S	S	*	*			cis	-165	-172.4	-46.5	-156.8	-7.7	0	0	0	109.9
532	C	32.3	Very low	33.3	Very low	124 Å²	124	137.4 Å²	137.4	84%	0.838	79%	0.786	S	S	*	*			trans	105.5	141.6	167.2	-60.8	0	0	0	0	118
533	Q	30.7	Very low	33.4	Very low	163 Å²	163	134.9 Å²	134.9	76%	0.762	78%	0.782	S	S	*	*			trans	-127.6	165.4	-164.5	-48.4	175.1	19.4	0	0	113.3
534	V	34.1	Very low	33.7	Very low	147 Å²	147	135.5 Å²	135.5	89%	0.891	78%	0.784	S	S	*	*			trans	-142.4	132.8	144.7	-178.8	0	0	0	0	108.7
535	E	30.9	Very low	34	Very low	123 Å²	123	134.8 Å²	134.8	58%	0.575	78%	0.781	S	S	*	*			trans	-93.7	157.8	171.2	-65.5	-169.1	117.5	0	0	111.9	K537	E535-K537 WeakPolarHBondContact OE1-CE 3.47Å; E535-K537 IonicContact OE1-NZ 2.72Å; E535-K537 PolarHBondContact OE1-NZ 2.98Å; E535-K537 IonicContact OE2-NZ 2.78Å; E535-K537 PolarHBondContact OE2-NZ 3.32Å
536	E	38.4	Very low	33.9	Very low	199 Å²	199	131.3 Å²	131.3	93%	0.93	77%	0.774	S	S	*	*			trans	-149.1	153.2	135.7	-150	169.5	-159.2	0	0	111.1
537	K	35	Very low	34	Very low	142 Å²	142	136.8 Å²	136.8	62%	0.617	78%	0.781	S	S	*	*			trans	-129.3	134.6	-166.1	-68.4	167.4	171.4	132.7	0	112.3	E535	E535-K537 WeakPolarHBondContact OE1-CE 3.47Å; E535-K537 IonicContact OE1-NZ 2.72Å; E535-K537 PolarHBondContact OE1-NZ 2.98Å; E535-K537 IonicContact OE2-NZ 2.78Å; E535-K537 PolarHBondContact OE2-NZ 3.32Å
538	I	35.3	Very low	34.1	Very low	170 Å²	170	136 Å²	136	87%	0.872	78%	0.776	S	S	*	*			trans	-139.3	138.9	153.5	-57.8	-177.1	0	0	0	108.3
539	S	30.9	Very low	33.9	Very low	108 Å²	108	138.3 Å²	138.3	76%	0.755	78%	0.784	S	S	*	*			trans	-133.7	137.5	-175.1	-53.4	0	0	0	0	111.8
540	I	33.3	Very low	34	Very low	172 Å²	172	137.1 Å²	137.1	88%	0.882	79%	0.786	S	S	*	*			trans	-141.9	137.2	162.4	-55.8	-178.9	0	0	0	107.7
541	S	28.7	Very low	33.9	Very low	112 Å²	112	135.1 Å²	135.1	78%	0.783	77%	0.774	S	S	*	*			trans	-125.3	155.5	-179.8	53.5	0	0	0	0	111.6
542	S	32.5	Very low	34	Very low	120 Å²	120	134.9 Å²	134.9	84%	0.839	77%	0.772	S	S	*	*			trans	-150.9	148.3	168	-173.8	0	0	0	0	109.9
543	S	33.8	Very low	34.3	Very low	106 Å²	106	135 Å²	135	74%	0.741	77%	0.768	S	S	*	*			trans	-136.4	152.5	-174.4	-60.2	0	0	0	0	110.9
544	P	35.7	Very low	34.6	Very low	120 Å²	120	133 Å²	133	78%	0.779	77%	0.77	S	S	*	*			trans	-81.8	157.2	-174.2	33.9	-36.1	0	0	0	113.1
545	P	38.4	Very low	34.5	Very low	115 Å²	115	129.4 Å²	129.4	75%	0.747	76%	0.762	S	S	*	*			trans	-86.1	158.5	177.3	35.4	-35.4	0	0	0	113.4
546	V	33	Very low	34.4	Very low	129 Å²	129	131.6 Å²	131.6	78%	0.782	78%	0.776	S	S	*	*			trans	-124.8	148.5	168	175.6	0	0	0	0	107.9
547	F	36	Very low	34	Very low	203 Å²	203	129.2 Å²	129.2	89%	0.89	78%	0.775	S	S	*	*			trans	-122.6	151.5	169.8	-94.6	-86.1	0	0	0	110.5
548	V	36.7	Very low	33.7	Very low	136 Å²	136	126.9 Å²	126.9	82%	0.824	78%	0.783	S	S	*	*			trans	-112.5	151.6	-165.5	177.1	0	0	0	0	111.3
549	S	30.9	Very low	33.4	Very low	108 Å²	108	128 Å²	128	76%	0.755	78%	0.784	S	S	*	*			trans	-93.4	161.4	-179.1	-47.2	0	0	0	0	112.8
550	T	37.4	Very low	33.4	Very low	111 Å²	111	129.2 Å²	129.2	68%	0.681	79%	0.786	S	S	*	*			trans	-144.5	128.9	169.4	43.4	0	0	0	0	113.4	I1027	T550-I1027 HydrophobicContact CG2-CD1 4.35Å
551	T	35.3	Very low	33.2	Very low	91 Å²	91	128.1 Å²	128.1	56%	0.558	78%	0.778	S	S	*	*			trans	58.3	117.4	153.2	58	0	0	0	0	120.3	I1027	T551-I1027 HydrophobicContact CG2-CD1 3.62Å; T551-I1027 HydrophobicContact CG2-CG1 4.07Å
552	N	34.5	Very low	33.3	Very low	134 Å²	134	130.7 Å²	130.7	72%	0.717	78%	0.782	S	S	*	*				73.5	130.3	81.4	-127.8	-17	0	0	0	112.4
553	V	38.2	Very low	33.1	Very low	125 Å²	125	131.3 Å²	131.3	76%	0.758	77%	0.769	S	S	*	*			cis	-148.2	155.9	36.6	168.8	0	0	0	0	110
554	P	37.1	Very low	33	Very low	122 Å²	122	134.6 Å²	134.6	79%	0.792	78%	0.778	S	S	*	*			trans	-103.9	172	-155.4	39.7	-37	0	0	0	118.2
555	G	33.3	Very low	32.9	Very low	71 Å²	71	135.8 Å²	135.8	73%	0.732	78%	0.777	S	S	*	*			trans	-161.3	74.9	176.1	0	0	0	0	0	116.2
556	I	28.2	Very low	32.3	Very low	169 Å²	169	137.8 Å²	137.8	87%	0.867	78%	0.782	S	S	*	*			trans	22.8	96.3	155.9	48	165.8	0	0	0	121.3
557	V	29.3	Very low	32.4	Very low	149 Å²	149	138.8 Å²	138.8	90%	0.903	78%	0.782	S	S	*	*				-142.3	151.1	125.5	-177.8	0	0	0	0	106.8
558	A	28.7	Very low	32	Very low	94 Å²	94	136.5 Å²	136.5	78%	0.777	78%	0.779	S	S	*	*			trans	-110.2	127.8	-176.9	0	0	0	0	0	113
559	E	29.9	Very low	31.8	Very low	193 Å²	193	138.5 Å²	138.5	90%	0.902	78%	0.78	S	S	*	*			trans	-132.2	150.6	159.7	-72.6	-169.1	156.1	0	0	108.9
560	V	31.3	Very low	31.8	Very low	133 Å²	133	140 Å²	140	81%	0.806	77%	0.772	S	S	*	*			trans	-106.5	94.7	-172.3	-178.5	0	0	0	0	110.6	L562	V560-L562 HydrophobicContact CG1-CG 4.36Å
561	E	29.3	Very low	31.3	Very low	150 Å²	150	139.8 Å²	139.8	70%	0.701	78%	0.776	S	S	*	*			trans	-75.5	120	160.4	-86	-162.2	121.8	0	0	110.4	K563	E561-K563 IonicContact OE1-NZ 3.34Å; E561-K563 PolarHBondContact OE1-NZ 3.09Å; E561-K563 IonicContact OE2-NZ 3.44Å; E561-K563 PolarHBondContact OE2-NZ 2.96Å
562	L	30.6	Very low	31.3	Very low	165 Å²	165	140.4 Å²	140.4	86%	0.864	78%	0.781	S	S	*	*			trans	-103.3	92.5	157.4	-76.8	177.2	0	0	0	109.8	V560	V560-L562 HydrophobicContact CG1-CG 4.36Å
563	K	27.6	Very low	31.2	Very low	134 Å²	134	140.5 Å²	140.5	58%	0.583	79%	0.786	S	S	*	*			trans	-69.6	141.2	159.2	-69.2	177.9	168.6	63.3	0	109.1	E561	E561-K563 IonicContact OE1-NZ 3.34Å; E561-K563 PolarHBondContact OE1-NZ 3.09Å; E561-K563 IonicContact OE2-NZ 3.44Å; E561-K563 PolarHBondContact OE2-NZ 2.96Å
564	L	32.3	Very low	30.6	Very low	175 Å²	175	137.8 Å²	137.8	92%	0.916	78%	0.784	S	S	*	*			trans	-146.3	129.1	154.5	-148	77.3	0	0	0	110.1
565	D	32.7	Very low	30.5	Very low	144 Å²	144	141.9 Å²	141.9	77%	0.77	79%	0.789	S	S	*	*			trans	-89.1	171.9	-165.7	-75.3	-76.3	0	0	0	114.9
566	N	26.7	Very low	30.1	Very low	158 Å²	158	147.1 Å²	147.1	85%	0.845	79%	0.794	S	S	*	*			trans	-58.8	134.1	163.5	-76.6	-95.8	0	0	0	110.5
567	L	35.5	Very low	30.3	Very low	150 Å²	150	148.9 Å²	148.9	79%	0.785	80%	0.796	S	S	*	*			trans	-149.1	123.2	146.5	-116.3	165.2	0	0	0	112.6
568	N	25.9	Very low	30	Very low	155 Å²	155	145.9 Å²	145.9	83%	0.829	79%	0.787	S	S	*	*			trans	-104.9	105.4	176.5	166.4	31.4	0	0	0	108.2
569	Q	33.7	Very low	30.1	Very low	178 Å²	178	149.5 Å²	149.5	83%	0.832	79%	0.791	S	S	*	*			trans	-147.2	161	172	-116.3	174.6	91.2	0	0	113.4
570	K	31.2	Very low	30.2	Very low	138 Å²	138	145.5 Å²	145.5	60%	0.6	79%	0.785	S	S	*	*			trans	-128.1	111.2	-141.6	174.5	-167.8	172.7	-170.9	0	112.6
571	S	26.2	Very low	29.9	Very low	108 Å²	108	146.5 Å²	146.5	76%	0.755	79%	0.786	S	S	*	*			trans	65.8	-175.8	156.4	-134.1	0	0	0	0	114
572	P	35.9	Very low	30	Very low	104 Å²	104	147.8 Å²	147.8	68%	0.675	79%	0.792	S	S	*	*			cis	-138.2	-176.8	-5.1	45.6	-29.4	0	0	0	116.2
573	V	32.1	Very low	30.1	Very low	136 Å²	136	143.9 Å²	143.9	82%	0.824	78%	0.778	S	S	*	*			trans	65.3	131.3	159.8	176.9	0	0	0	0	117.6
574	G	26.1	Very low	30.3	Very low	68 Å²	68	145.7 Å²	145.7	70%	0.701	79%	0.794	S	S	*	*			trans	-107	175.5	166.6	0	0	0	0	0	112.6
575	K	34.5	Very low	30.7	Very low	208 Å²	208	142.7 Å²	142.7	90%	0.904	79%	0.785	S	S	*	*			trans	-144.6	140.4	166.5	-99.8	175.5	-178.2	175.8	0	111.3
576	E	25.3	Very low	30.7	Very low	180 Å²	180	143.2 Å²	143.2	84%	0.841	79%	0.793	S	S	*	*			trans	-75.4	145.9	173.8	164.8	-173.9	-128.1	0	0	111.4
577	F	30.5	Very low	31	Very low	206 Å²	206	138.4 Å²	138.4	90%	0.904	78%	0.781	S	S	*	*			trans	-168.3	140.5	149.3	-104.4	-66.6	0	0	0	110.8
578	A	24.5	Very low	31	Very low	86 Å²	86	137 Å²	137	71%	0.711	78%	0.784	S	S	*	*			trans	-116.2	164.8	171.3	0	0	0	0	0	110.5
579	I	31.1	Very low	31.5	Very low	170 Å²	170	138.4 Å²	138.4	87%	0.872	78%	0.782	S	S	*	*			trans	-171.4	160.9	154.4	-101.4	150.2	0	0	0	110.1
580	S	30.3	Very low	31.6	Very low	109 Å²	109	135.5 Å²	135.5	76%	0.762	77%	0.772	S	S	*	*			trans	-95.6	174.6	-155.3	-48.5	0	0	0	0	117.4
581	N	25.1	Very low	31.8	Very low	155 Å²	155	134.4 Å²	134.4	83%	0.829	77%	0.773	S	S	*	*			trans	-53.3	157.7	175.1	-38.1	-53.8	0	0	0	115.5
582	E	33	Very low	32.2	Very low	176 Å²	176	136 Å²	136	82%	0.822	77%	0.768	S	S	*	*				-170	137.7	122.8	-103.5	-147.4	87.1	0	0	116.5
583	S	31.7	Very low	32.3	Very low	83 Å²	83	137 Å²	137	58%	0.58	77%	0.772	S	S	*	*			trans	56	96.2	130.6	-55.3	0	0	0	0	125.9
584	L	32.4	Very low	32.5	Very low	173 Å²	173	136.8 Å²	136.8	91%	0.906	77%	0.767	S	S	*	*				68.5	158.6	126.2	-93.1	73.5	0	0	0	124.6
585	P	40.6	Very low	33	Very low	112 Å²	112	139.6 Å²	139.6	73%	0.727	77%	0.766	S	S	*	*			trans	-126.9	-177.5	-169.4	45.9	-32.5	0	0	0	116.9
586	T	33.3	Very low	33.1	Very low	154 Å²	154	135.9 Å²	135.9	95%	0.945	76%	0.756	S	S	*	*			trans	-171.4	157.3	156.9	9.7	0	0	0	0	109.3
587	G	31.7	Very low	33.7	Very low	58 Å²	58	132.7 Å²	132.7	60%	0.598	75%	0.753	S	S	*	*			cis	160.7	158.2	-8.5	0	0	0	0	0	112.6
588	S	36.4	Very low	34.1	Very low	120 Å²	120	130.4 Å²	130.4	84%	0.839	75%	0.745	S	S	*	*			trans	73.2	159.8	171.9	88.6	0	0	0	0	116.8
589	K	36.5	Very low	34.5	Very low	184 Å²	184	132.5 Å²	132.5	80%	0.8	74%	0.744	S	S	*	*			cis	-175.4	166.3	-14.7	-112.6	-166.5	173.3	-158.7	0	107.2
590	L	34.9	Very low	34.6	Very low	118 Å²	118	132.3 Å²	132.3	62%	0.618	74%	0.74	S	S	*	*			cis	-170.5	-168.5	-20.2	-138	-174.6	0	0	0	108
591	N	35.9	Very low	34.7	Very low	114 Å²	114	133 Å²	133	61%	0.61	74%	0.74	S	S	*	*			trans	76.5	145.9	156.9	-78.3	42.7	0	0	0	120.7
592	E	35	Very low	35.1	Very low	142 Å²	142	129 Å²	129	66%	0.664	74%	0.736	S	S	*	*			cis	-174.1	176.8	-30.5	-125.6	167.6	-169.6	0	0	111.1
593	T	37.6	Very low	35	Very low	124 Å²	124	127.1 Å²	127.1	76%	0.761	74%	0.736	S	S	*	*			trans	72.1	145.9	166.3	61.3	0	0	0	0	120.4
594	N	36.3	Very low	35.2	Very low	132 Å²	132	129.2 Å²	129.2	71%	0.706	75%	0.747	S	S	*	*			cis	-172.9	161.9	-32.9	-117.9	28.6	0	0	0	112
595	N	36.6	Very low	35	Very low	127 Å²	127	127.9 Å²	127.9	68%	0.679	74%	0.739	S	S	*	*			trans	67.1	158.3	158.3	-58.7	16.3	0	0	0	119.4
596	D	36.3	Very low	34.7	Very low	131 Å²	131	130.6 Å²	130.6	70%	0.701	75%	0.746	S	S	*	*			cis	-173.8	164.5	-38.9	-94.7	-31.5	0	0	0	109.8
597	S	38.3	Very low	34.5	Very low	112 Å²	112	128.3 Å²	128.3	78%	0.783	73%	0.732	S	S	*	*			trans	67.1	157.4	157.2	71.3	0	0	0	0	119.5
598	E	38.7	Very low	34.6	Very low	159 Å²	159	131.9 Å²	131.9	74%	0.743	74%	0.737	S	S	*	*			cis	-171.2	142.4	-42.1	-121.4	-178.2	-128	0	0	109.3
599	N	33.7	Very low	34.5	Very low	129 Å²	129	132 Å²	132	69%	0.69	73%	0.728	S	S	*	*			trans	59.7	169.2	156.3	-42.1	-31	0	0	0	117.3
600	E	33.5	Very low	34.5	Very low	166 Å²	166	131.5 Å²	131.5	78%	0.776	73%	0.728	S	S	*	*			cis	-154.5	168.7	-20.9	-135.4	-162.9	-144.6	0	0	110.6
601	T	32	Very low	34.2	Very low	124 Å²	124	130.5 Å²	130.5	76%	0.761	73%	0.73	S	S	*	*			trans	49	124.9	143.4	-62.4	0	0	0	0	122.4
602	G	33.2	Very low	33.9	Very low	72 Å²	72	129.7 Å²	129.7	74%	0.742	73%	0.733	S	S	*	*			trans	170.2	120.6	157.4	0	0	0	0	0	116.8
603	V	29.9	Very low	33.5	Very low	136 Å²	136	128.4 Å²	128.4	82%	0.824	74%	0.735	S	S	*	*			trans	-134.8	144.6	171.7	-178.1	0	0	0	0	109
604	P	37.8	Very low	33.1	Very low	127 Å²	127	129 Å²	129	83%	0.825	74%	0.738	S	S	*	*			trans	-140.6	165.2	137.1	36	-21.6	0	0	0	115.2
605	I	27.6	Very low	32.7	Very low	144 Å²	144	127.5 Å²	127.5	74%	0.738	74%	0.738	S	S	*	*			trans	-96.9	144.5	-177	-61.3	154.2	0	0	0	110.5	T607	I605-T607 HydrophobicContact CG2-CG2 4.46Å
606	I	34.6	Very low	32.3	Very low	170 Å²	170	127.1 Å²	127.1	87%	0.872	74%	0.743	S	S	*	*			trans	-138	130.5	148.7	-61.2	-175.5	0	0	0	109.1
607	T	28.8	Very low	32.2	Very low	105 Å²	105	127.2 Å²	127.2	64%	0.644	75%	0.748	S	S	*	*			trans	-109.4	171.1	163.1	54.9	0	0	0	0	109.8	I605	I605-T607 HydrophobicContact CG2-CG2 4.46Å
608	D	33.1	Very low	31.5	Very low	133 Å²	133	128.3 Å²	128.3	71%	0.711	75%	0.745	S	S	*	*			trans	135.3	149.2	154.3	-72.5	5.9	0	0	0	112.2
609	L	34.8	Very low	31.1	Very low	124 Å²	124	127.9 Å²	127.9	65%	0.649	75%	0.746	S	S	*	*			cis	-162.6	143	-9.8	-111.3	167.3	0	0	0	110
610	H	36.8	Very low	30.9	Very low	173 Å²	173	130.4 Å²	130.4	80%	0.801	75%	0.751	S	S	*	*			trans	59.6	159.9	149.9	-86.3	-144.3	0	0	0	121.7
611	C	27.3	Very low	30.7	Very low	96 Å²	96	129.7 Å²	129.7	65%	0.649	75%	0.751	S	S	*	*			cis	-172.8	166.4	-31.8	-161.5	0	0	0	0	110.1
612	S	30.2	Very low	30.5	Very low	98 Å²	98	129.5 Å²	129.5	69%	0.685	75%	0.752	S	S	*	*			trans	70.8	152.8	151	-95.5	0	0	0	0	120.8
613	T	27.8	Very low	30.1	Very low	115 Å²	115	132.7 Å²	132.7	71%	0.706	76%	0.756	S	S	*	*			cis	-167.7	151.7	-33.8	12.4	0	0	0	0	109.7
614	V	27.9	Very low	30.2	Very low	135 Å²	135	134 Å²	134	82%	0.818	75%	0.754	S	S	*	*			trans	57.6	115.5	153.7	178.5	0	0	0	0	119.1
615	S	28.3	Very low	29.8	Very low	101 Å²	101	134.2 Å²	134.2	71%	0.706	75%	0.748	S	S	*	*				179.1	135.7	115.6	-170.1	0	0	0	0	112
616	P	28.4	Very low	29.6	Very low	119 Å²	119	135.1 Å²	135.1	77%	0.773	75%	0.753	S	S	*	*			trans	-86.4	119.1	172.7	33	-30.9	0	0	0	111.9	N618	P616-N618 PolarHBondContact O-N 2.98Å
617	V	32.9	Very low	29.3	Very low	133 Å²	133	133.5 Å²	133.5	81%	0.806	75%	0.751	S	S	*	*			trans	-81.3	113.6	175.8	179.1	0	0	0	0	110.5
618	N	25.4	Very low	29.1	Very low	136 Å²	136	134.9 Å²	134.9	73%	0.727	75%	0.754	S	S	*	*			trans	-89.9	117.7	-176.6	-175.4	-21.3	0	0	0	110.6	P616	P616-N618 PolarHBondContact O-N 2.98Å
619	I	30.5	Very low	28.9	Very low	150 Å²	150	136.2 Å²	136.2	77%	0.769	76%	0.76	S	S	*	*			trans	-108.8	114.2	172	-60.6	-178.1	0	0	0	108.9
620	K	28.1	Very low	28.4	Very low	182 Å²	182	136.2 Å²	136.2	79%	0.791	76%	0.757	S	S	*	*			trans	-72.7	136.9	179.8	-65.1	175.4	177.5	177.3	0	111.4
621	I	29.3	Very low	28.3	Very low	151 Å²	151	133.3 Å²	133.3	77%	0.774	76%	0.756	S	S	*	*			trans	-115.3	136.8	151.1	-61.7	178.8	0	0	0	106.4
622	P	29	Very low	28.5	Very low	119 Å²	119	135.7 Å²	135.7	77%	0.773	76%	0.755	S	S	*	*			trans	-66.8	140	-174.5	-20.5	33.3	0	0	0	113
623	V	23.9	Very low	28.5	Very low	139 Å²	139	137.6 Å²	137.6	84%	0.842	76%	0.758	S	S	*	*			trans	-108.8	117.5	167.6	175.3	0	0	0	0	107.8
624	E	31.8	Very low	28.6	Very low	164 Å²	164	142.3 Å²	142.3	77%	0.766	77%	0.769	S	S	*	*			trans	-133.5	118.2	167.6	-78.1	-162.9	-159.8	0	0	111.9
625	N	28.8	Very low	28.7	Very low	132 Å²	132	143.9 Å²	143.9	71%	0.706	77%	0.769	S	S	*	*			trans	68.2	68.3	146.1	-53.7	-37.6	0	0	0	119.1
626	L	23.4	Very low	28.7	Very low	163 Å²	163	145.7 Å²	145.7	85%	0.853	77%	0.771	S	S	*	*			trans	-87.6	110.5	141.1	-93	171	0	0	0	109.7	I628	L626-I628 PolarHBondContact O-N 3.05Å
627	T	29.7	Very low	28.8	Very low	135 Å²	135	145 Å²	145	83%	0.828	77%	0.765	S	S	*	*			trans	-89.7	94.4	166.5	50.7	0	0	0	0	110.2
628	I	24.4	Very low	28.7	Very low	135 Å²	135	145.8 Å²	145.8	69%	0.692	76%	0.759	S	S	*	*			trans	-76.8	141.9	166	-63.6	172.1	0	0	0	108.6	L626 E630	L626-I628 PolarHBondContact O-N 3.05Å; I628-E630 HydrophobicContact CG2-CG 3.94Å
629	L	28	Very low	29	Very low	161 Å²	161	143.8 Å²	143.8	84%	0.843	76%	0.756	S	S	*	*			trans	-134.1	82.6	167.8	-150.8	165	0	0	0	109.6
630	E	25.3	Very low	29.2	Very low	124 Å²	124	144.8 Å²	144.8	58%	0.579	76%	0.755	S	S	*	*			trans	-74.1	150.4	168.7	-73.4	-170.8	130.8	0	0	111.7	I628 K632	I628-E630 HydrophobicContact CG2-CG 3.94Å; E630-K632 IonicContact OE1-NZ 3.18Å; E630-K632 IonicContact OE2-NZ 3.09Å; E630-K632 PolarHBondContact OE2-NZ 2.96Å
631	S	33.9	Very low	29.2	Very low	112 Å²	112	144.6 Å²	144.6	78%	0.783	76%	0.759	S	S	*	*			trans	-157.7	87.2	149.2	-74.4	0	0	0	0	107
632	K	31.1	Very low	29.3	Very low	145 Å²	145	141 Å²	141	63%	0.63	75%	0.752	S	S	*	*				51.2	112.3	82.9	-77.3	-170.8	163.1	85.4	0	114.5	E630	E630-K632 IonicContact OE1-NZ 3.18Å; E630-K632 IonicContact OE2-NZ 3.09Å; E630-K632 PolarHBondContact OE2-NZ 2.96Å
633	N	29.7	Very low	29.3	Very low	139 Å²	139	143.9 Å²	143.9	74%	0.743	76%	0.755	S	S	*	*			trans	62.1	125.6	145.3	-51.5	-12.6	0	0	0	119.3
634	F	31.2	Very low	29.5	Very low	213 Å²	213	144.8 Å²	144.8	93%	0.934	75%	0.75	S	S	*	*				-154.8	154	112.7	-115.2	-78	0	0	0	111.4
635	M	28.8	Very low	29.4	Very low	169 Å²	169	142.5 Å²	142.5	83%	0.833	75%	0.747	S	S	*	*			trans	-90.5	176.1	-177.7	-80.8	-79.8	-167.8	0	0	112.7
636	N	29.2	Very low	29.8	Very low	139 Å²	139	143.8 Å²	143.8	74%	0.743	75%	0.752	S	S	*	*			trans	112.2	118.4	133	-139.4	47.9	0	0	0	118
637	V	29.9	Very low	30.1	Very low	105 Å²	105	141.7 Å²	141.7	64%	0.636	74%	0.741	S	S	*	*			trans	60	128	130.9	168	0	0	0	0	118
638	E	32.3	Very low	30.4	Very low	148 Å²	148	141.4 Å²	141.4	69%	0.692	74%	0.735	S	S	*	*				-163	167.5	64.8	-172.5	53.7	-99.2	0	0	112.1	K640	E638-K640 IonicContact OE1-NZ 3.91Å
639	S	30.7	Very low	30.8	Very low	95 Å²	95	139.6 Å²	139.6	66%	0.664	73%	0.734	S	S	*	*			trans	-107.4	178.4	175.2	-174.8	0	0	0	0	112.4
640	K	34.4	Very low	31.1	Very low	170 Å²	170	139.8 Å²	139.8	74%	0.739	73%	0.731	S	S	*	*			trans	95.3	157.7	176.7	-59	152.2	-171.1	144.3	0	115.9	E638	E638-K640 IonicContact OE1-NZ 3.91Å
641	M	27.9	Very low	31.6	Very low	178 Å²	178	139.1 Å²	139.1	88%	0.877	73%	0.734	S	S	*	*			cis	-175.2	175.1	-25.6	-174.6	161	-178.3	0	0	108.1
642	A	32.6	Very low	31.5	Very low	77 Å²	77	138.7 Å²	138.7	64%	0.636	73%	0.727	S	S	*	*			trans	78.5	142.2	-179.5	0	0	0	0	0	114.2
643	H	27.8	Very low	31.6	Very low	179 Å²	179	139.3 Å²	139.3	83%	0.829	73%	0.732	S	S	*	*			cis	65.1	145.7	44.4	-68.1	-107.1	0	0	0	111.8
644	E	29.1	Very low	31.7	Very low	158 Å²	158	137.6 Å²	137.6	74%	0.738	73%	0.731	S	S	*	*			cis	-165.1	160.8	28.6	-149.7	-166.2	138.6	0	0	112.5
645	V	29.2	Very low	31.7	Very low	116 Å²	116	132 Å²	132	70%	0.703	72%	0.719	S	S	*	*			trans	54	170	162.7	-107.3	0	0	0	0	118.5
646	I	36.7	Very low	31.7	Very low	158 Å²	158	130.8 Å²	130.8	81%	0.81	72%	0.716	S	S	*	*			cis	-136.4	157.4	1.9	-61.5	-179.1	0	0	0	107
647	N	30.6	Very low	32	Very low	119 Å²	119	130.1 Å²	130.1	64%	0.636	72%	0.717	S	S	*	*			cis	176.9	164.9	-33.8	-167.2	10.7	0	0	0	107.6
648	N	35.3	Very low	32.3	Very low	130 Å²	130	128.1 Å²	128.1	70%	0.695	72%	0.717	S	S	*	*			trans	68.7	149.5	162.3	-63.6	-31.7	0	0	0	120
649	S	32.4	Very low	32.6	Very low	96 Å²	96	126.7 Å²	126.7	67%	0.671	72%	0.72	S	S	*	*			cis	-171.3	173.8	-24.9	56.8	0	0	0	0	111.6
650	H	34.4	Very low	32.6	Very low	166 Å²	166	126.9 Å²	126.9	77%	0.769	72%	0.722	S	S	*	*			trans	90	108	147.1	-118.4	-111.7	0	0	0	121.1
651	V	36.4	Very low	32.3	Very low	109 Å²	109	125.3 Å²	125.3	66%	0.661	73%	0.727	S	S	*	*			trans	145.9	99.7	138	84.8	0	0	0	0	114.3
652	T	31.1	Very low	32.5	Very low	103 Å²	103	120.9 Å²	120.9	63%	0.632	71%	0.713	S	S	*	*			trans	-55.5	179.4	163.8	52.7	0	0	0	0	113.6
653	E	35	Very low	32.5	Very low	158 Å²	158	126 Å²	126	74%	0.738	72%	0.721	S	S	*	*			cis	-157.2	158	22.1	-146.1	127.7	175.6	0	0	115.2
654	S	30.7	Very low	32.5	Very low	103 Å²	103	123.5 Å²	123.5	72%	0.72	71%	0.713	S	S	*	*			trans	-15.1	154.9	150.3	-32.8	0	0	0	0	117.7
655	S	30.5	Very low	32.5	Very low	97 Å²	97	122.9 Å²	122.9	68%	0.678	71%	0.71	S	S	*	*			cis	-177.5	172.5	37.3	53.2	0	0	0	0	113.8
656	N	30.1	Very low	32.7	Very low	142 Å²	142	123.9 Å²	123.9	76%	0.759	71%	0.712	S	S	*	*			trans	79.4	128	138.3	-84.6	-14.3	0	0	0	124.2
657	V	35.8	Very low	32.5	Very low	126 Å²	126	119.4 Å²	119.4	76%	0.764	70%	0.704	S	S	*	*			trans	74.9	107.3	130.3	176.7	0	0	0	0	119.1
658	G	34.5	Very low	32.6	Very low	63 Å²	63	121 Å²	121	65%	0.649	71%	0.713	S	S	*	*			trans	-84.5	178.8	145.2	0	0	0	0	0	111
659	P	40.3	Very low	32.5	Very low	117 Å²	117	120 Å²	120	76%	0.76	71%	0.707	S	S	*	*				-152.6	177.1	73.1	42	-23.6	0	0	0	116.7
660	S	29.3	Very low	32.6	Very low	99 Å²	99	123 Å²	123	69%	0.692	71%	0.708	S	S	*	*			trans	16.8	154.9	141	-49.4	0	0	0	0	123.3
661	T	29.2	Very low	32.7	Very low	137 Å²	137	124 Å²	124	84%	0.84	71%	0.71	S	S	*	*			trans	78.4	151.5	161.6	78.6	0	0	0	0	116.3
662	S	31.2	Very low	32.3	Very low	85 Å²	85	126.8 Å²	126.8	59%	0.594	72%	0.72	S	S	*	*			cis	-173.4	171.6	-27	58.7	0	0	0	0	108.6
663	K	31.9	Very low	32.4	Very low	185 Å²	185	125.8 Å²	125.8	80%	0.804	73%	0.73	S	S	*	*			trans	67	164	156	-75.8	171.8	-176.6	177.6	0	114.9
664	L	29.1	Very low	32.1	Very low	126 Å²	126	126.9 Å²	126.9	66%	0.66	74%	0.741	S	S	*	*			cis	-140.1	134.2	-14.9	-99.5	144	0	0	0	104
665	E	29.4	Very low	32	Very low	146 Å²	146	127.1 Å²	127.1	68%	0.682	74%	0.742	S	S	*	*				74.5	140.3	84	-155.7	-165.8	94.6	0	0	115.1
666	N	31.8	Very low	31.9	Very low	136 Å²	136	126 Å²	126	73%	0.727	74%	0.735	S	S	*	*			trans	73.6	134.9	174.1	-53.8	-59.7	0	0	0	117.6
667	G	34.3	Very low	32.3	Very low	64 Å²	64	127.1 Å²	127.1	66%	0.66	74%	0.74	S	S	*	*			cis	169.2	172.9	-7.5	0	0	0	0	0	113.9
668	L	31.9	Very low	31.8	Very low	154 Å²	154	130 Å²	130	81%	0.806	74%	0.743	S	S	*	*			trans	34.2	134.9	139.6	-54.6	178	0	0	0	119.3
669	D	33.8	Very low	31.8	Very low	108 Å²	108	131.2 Å²	131.2	58%	0.578	75%	0.746	S	S	*	*			cis	-165.7	169.6	6.7	-139.1	-5.1	0	0	0	114
670	K	33.9	Very low	31.4	Very low	159 Å²	159	131 Å²	131	69%	0.691	75%	0.748	S	S	*	*			trans	-6.8	127.7	156.6	-54.9	154.3	-168	79.2	0	117.8
671	K	35.4	Very low	31.8	Very low	188 Å²	188	136 Å²	136	82%	0.817	76%	0.76	S	S	*	*				176.5	133.2	111.5	-99	173.7	179.9	176.9	0	116.5
672	L	28.9	Very low	31.8	Very low	166 Å²	166	140.1 Å²	140.1	87%	0.869	76%	0.76	S	S	*	*				28	125.4	128.1	-53.6	173.8	0	0	0	120
673	G	33	Very low	31.8	Very low	82 Å²	82	145.5 Å²	145.5	85%	0.845	77%	0.768	S	S	*	*			trans	-179.3	79.2	166.2	0	0	0	0	0	115.5
674	L	29.6	Very low	32	Very low	182 Å²	182	144.1 Å²	144.1	95%	0.953	76%	0.764	S	S	*	*			trans	-73.2	139.2	161.4	-68.6	165.9	0	0	0	109.4
675	S	28.2	Very low	32.1	Very low	107 Å²	107	142.3 Å²	142.3	75%	0.748	77%	0.768	S	S	*	*				166.3	142.1	117.7	-159.5	0	0	0	0	114.7
676	S	28.9	Very low	32.5	Very low	75 Å²	75	141.1 Å²	141.1	52%	0.524	78%	0.775	S	S	.	*			trans	21.9	131.5	145.2	66.1	0	0	0	0	123.2
677	N	37.1	Very low	32.7	Very low	165 Å²	165	144.1 Å²	144.1	88%	0.882	78%	0.782	S	S	*	*				-152.6	120.5	125	-81	-50.8	0	0	0	105.7
678	F	26.8	Very low	32.9	Very low	187 Å²	187	145.8 Å²	145.8	82%	0.82	78%	0.781	S	S	*	*			cis	79.1	144.2	24	-114	-73.7	0	0	0	116
679	A	34.3	Very low	32.9	Very low	87 Å²	87	145 Å²	145	72%	0.719	78%	0.782	S	S	*	*			trans	65.6	115.4	-167.4	0	0	0	0	0	114.3
680	S	30.3	Very low	33.1	Very low	114 Å²	114	145.3 Å²	145.3	80%	0.797	79%	0.793	S	S	*	*			cis	72.5	108.2	38.6	-55.1	0	0	0	0	116.1
681	Q	38.8	Very low	33	Very low	202 Å²	202	146.9 Å²	146.9	94%	0.944	80%	0.8	S	S	*	*			trans	-141.1	155.1	131.8	-112.8	176.5	22.7	0	0	111.2
682	R	29.2	Very low	33.1	Very low	224 Å²	224	148.4 Å²	148.4	85%	0.845	81%	0.807	S	S	*	*			trans	-150	155.1	-166.3	-173.1	-167.1	-160.2	-126.9	11.3	107.5
683	R	32.3	Very low	33.2	Very low	198 Å²	198	145 Å²	145	75%	0.747	80%	0.802	S	S	*	*			trans	96.1	146.7	173.4	-59.4	-174.9	-99.2	-163.5	-3.6	113.9
684	E	34.9	Very low	33.3	Very low	157 Å²	157	146.5 Å²	146.5	73%	0.734	80%	0.797	S	S	*	*			cis	-151	178.6	-1.2	-131	145.4	-146.9	0	0	114.8
685	A	31.7	Very low	33.5	Very low	88 Å²	88	143.4 Å²	143.4	73%	0.727	79%	0.791	S	S	*	*			trans	-9.3	149	169.2	0	0	0	0	0	119.8
686	S	37.7	Very low	33.6	Very low	120 Å²	120	148.4 Å²	148.4	84%	0.839	80%	0.795	S	S	*	*			cis	-166.3	177.3	47.5	48.8	0	0	0	0	115.1
687	K	34.7	Very low	33.8	Very low	200 Å²	200	150.2 Å²	150.2	87%	0.87	81%	0.808	S	S	*	*			trans	-128.7	-177.6	-178.1	-128.4	174.6	-175.9	172.8	0	106.7
688	P	39.2	Very low	33.4	Very low	98 Å²	98	149.1 Å²	149.1	64%	0.636	80%	0.8	S	S	*	*			cis	-143.4	-171.8	-0.9	39.2	-17.3	0	0	0	116.9
689	T	32.3	Very low	33.6	Very low	137 Å²	137	147.1 Å²	147.1	84%	0.84	80%	0.798	S	S	*	*			trans	71.6	157.2	164.1	69.7	0	0	0	0	116.9
690	S	37.9	Very low	33.4	Very low	115 Å²	115	148.3 Å²	148.3	80%	0.804	80%	0.798	S	S	*	*			cis	-140.3	174.8	16	-165.9	0	0	0	0	114.7
691	K	32.8	Very low	33.4	Very low	193 Å²	193	152 Å²	152	84%	0.839	80%	0.8	S	S	*	*			trans	-86.6	143.7	-169.8	-53.3	163.2	-177.7	172	0	113.1
692	K	35.9	Very low	32.9	Very low	219 Å²	219	150.5 Å²	150.5	95%	0.952	80%	0.797	S	S	*	*				-164.9	160.8	126.8	-109	166.2	-175.7	178.8	0	112.1
693	A	30.7	Very low	33	Very low	94 Å²	94	147.7 Å²	147.7	78%	0.777	80%	0.797	S	S	*	*			trans	-113.8	165.9	-166.6	0	0	0	0	0	112
694	P	36.4	Very low	32.8	Very low	115 Å²	115	147.8 Å²	147.8	75%	0.747	80%	0.803	S	S	*	*			trans	-94.8	170.3	-160.1	37.8	-37.3	0	0	0	115
695	S	33.7	Very low	32.7	Very low	117 Å²	117	146.9 Å²	146.9	82%	0.818	81%	0.808	S	S	*	*			trans	-125.7	113.6	167	55.1	0	0	0	0	110.5
696	Y	29.5	Very low	32.5	Very low	211 Å²	211	145.9 Å²	145.9	83%	0.827	81%	0.807	S	S	*	*			trans	-74.4	143.7	173.8	-83.1	-98.1	0	0	0	111.5
697	S	32.7	Very low	32.3	Very low	114 Å²	114	145.3 Å²	145.3	80%	0.797	80%	0.803	S	S	*	*			trans	-118.8	137.2	155.6	-174.5	0	0	0	0	108.3
698	I	29.6	Very low	32	Very low	142 Å²	142	142.9 Å²	142.9	73%	0.728	80%	0.8	S	S	*	*			trans	-125.8	118.9	-179	-61	173.4	0	0	0	108
699	L	31.7	Very low	31.6	Very low	145 Å²	145	148.6 Å²	148.6	76%	0.759	81%	0.814	S	S	*	*			trans	-136	134.2	158.6	-75.8	178.7	0	0	0	109.2
700	P	29.1	Very low	31.4	Very low	111 Å²	111	147.7 Å²	147.7	72%	0.721	81%	0.814	S	S	*	*			trans	-89.1	141.4	179	34.7	-32.6	0	0	0	111.2
701	F	30.8	Very low	30.9	Very low	193 Å²	193	146 Å²	146	85%	0.846	80%	0.802	S	S	*	*			trans	-134.5	141.6	167.7	-94.7	-83.1	0	0	0	112.7
702	L	27.5	Very low	30.9	Very low	169 Å²	169	145.8 Å²	145.8	89%	0.885	80%	0.804	S	S	*	*			trans	-76.5	133.9	175.1	-68.2	139	0	0	0	110.1
703	I	31.8	Very low	30.4	Very low	166 Å²	166	141.9 Å²	141.9	85%	0.851	79%	0.792	S	S	*	*			trans	-130.4	145.1	158.8	-62.5	-175.6	0	0	0	108.5
704	K	28	Very low	30.4	Very low	199 Å²	199	144.8 Å²	144.8	87%	0.865	79%	0.793	S	S	*	*			trans	-135.9	102.2	-168.2	172.7	-161.2	169.4	-174.2	0	110.6
705	T	32.9	Very low	30	Very low	138 Å²	138	144.9 Å²	144.9	85%	0.847	79%	0.792	S	S	*	*			trans	-168.4	161.8	162.2	31.3	0	0	0	0	107.8
706	G	27.7	Very low	29.9	Very low	68 Å²	68	144.5 Å²	144.5	70%	0.701	79%	0.789	S	S	*	*			cis	136	118.7	-6.7	0	0	0	0	0	112.9
707	S	32.8	Very low	29.8	Very low	108 Å²	108	142.3 Å²	142.3	76%	0.755	79%	0.791	S	S	*	*			trans	80.9	102.6	171.5	-153.3	0	0	0	0	119.2
708	N	29	Very low	30	Very low	149 Å²	149	145.4 Å²	145.4	80%	0.797	79%	0.793	S	S	*	*				34.1	126.1	124.4	-50.5	-5.6	0	0	0	120.9
709	K	31.5	Very low	30	Very low	217 Å²	217	147.5 Å²	147.5	94%	0.943	80%	0.797	S	S	*	*				-151.4	166	127.1	-111.4	168.2	-174.3	-177.1	0	110.8
710	S	28.3	Very low	30	Very low	119 Å²	119	146.2 Å²	146.2	83%	0.832	80%	0.799	S	S	*	*			trans	-89.8	167	-157	-155.9	0	0	0	0	115.2
711	S	27.3	Very low	30.2	Very low	78 Å²	78	147.6 Å²	147.6	55%	0.545	80%	0.8	S	S	.	*			trans	-77.2	150.9	176.9	38.4	0	0	0	0	113.8
712	Q	31.5	Very low	30	Very low	190 Å²	190	146.7 Å²	146.7	89%	0.888	80%	0.8	S	S	*	*			trans	-130.5	149	140.4	-90.8	-173.9	-3.3	0	0	109
713	I	26.5	Very low	30.2	Very low	137 Å²	137	148.2 Å²	148.2	70%	0.703	80%	0.8	S	S	*	*			trans	-125.3	130.4	175.7	-61.3	175.7	0	0	0	105.9	T715	I713-T715 HydrophobicContact CG2-CG2 4.05Å
714	I	29.9	Very low	30.2	Very low	155 Å²	155	146.9 Å²	146.9	80%	0.795	80%	0.799	S	S	*	*			trans	-103.6	113	164.1	-62.1	177.6	0	0	0	106.4
715	T	27.7	Very low	30.4	Very low	117 Å²	117	146.1 Å²	146.1	72%	0.718	80%	0.796	S	S	*	*			trans	-87.8	132.9	169.8	44.4	0	0	0	0	109.4	I713	I713-T715 HydrophobicContact CG2-CG2 4.05Å
716	S	33	Very low	30.6	Very low	108 Å²	108	144.8 Å²	144.8	76%	0.755	79%	0.788	S	S	*	*			trans	-133	114.6	164.9	-56.8	0	0	0	0	107.2	E718	S716-E718 PolarHBondContact O-N 3.12Å
717	D	27.5	Very low	30.7	Very low	165 Å²	165	149.1 Å²	149.1	88%	0.882	80%	0.795	S	S	*	*			trans	-70.5	123.8	173.7	-65.6	-74.1	0	0	0	109.5
718	E	35.6	Very low	31	Very low	179 Å²	179	151 Å²	151	84%	0.836	79%	0.792	S	S	*	*			trans	-134.3	118.6	157.3	-161.3	164.2	-151.1	0	0	111.9	S716	S716-E718 PolarHBondContact O-N 3.12Å
719	K	30.4	Very low	31.2	Very low	187 Å²	187	153.1 Å²	153.1	81%	0.813	79%	0.794	S	S	*	*			trans	-65.6	125.9	177.4	173.8	-174.6	177.4	-176	0	109.9
720	C	31.9	Very low	31.5	Very low	118 Å²	118	148 Å²	148	80%	0.797	78%	0.776	S	S	*	*			trans	-134.8	127.9	175.4	-88.8	0	0	0	0	112.1
721	D	32.7	Very low	31.7	Very low	139 Å²	139	150.2 Å²	150.2	74%	0.743	78%	0.779	S	S	*	*			trans	-81	175.4	-176.3	-78.5	-73.3	0	0	0	114.3
722	M	26	Very low	32	Very low	174 Å²	174	153.3 Å²	153.3	86%	0.857	79%	0.788	S	S	*	*			trans	-41.5	136.6	-174.3	-48.3	178.9	-162.6	0	0	116.3
723	K	32.6	Very low	31.9	Very low	202 Å²	202	151.6 Å²	151.6	88%	0.878	79%	0.785	S	S	*	*				-163.6	101.2	126.5	-109	152.3	-174	166.9	0	112.3	K725	K723-K725 PolarHBondContact O-N 3.14Å
724	V	31.2	Very low	32.4	Very low	137 Å²	137	151.1 Å²	151.1	83%	0.83	79%	0.789	S	S	*	*			trans	-65.3	127.4	161.1	177.3	0	0	0	0	107.6	T726	V724-T726 HydrophobicContact CG1-CG2 4.35Å
725	K	32.9	Very low	32.4	Very low	183 Å²	183	149.8 Å²	149.8	80%	0.796	79%	0.791	S	S	*	*			trans	-121.1	91.8	176.5	-157.5	171	-172.4	178.8	0	109.4	K723 N727	K723-K725 PolarHBondContact O-N 3.14Å; K725-N727 PolarHBondContact O-N 3.1Å
726	T	36.7	Very low	32.5	Very low	110 Å²	110	153 Å²	153	68%	0.675	80%	0.799	S	S	*	*			trans	-67.3	107.3	176.4	33.7	0	0	0	0	110.2	V724 E728	V724-T726 HydrophobicContact CG1-CG2 4.35Å; T726-E728 PolarHBondContact O-N 3.05Å; T726-E728 VanDerWaalsContact O-N 3.17Å
727	N	29.8	Very low	32.4	Very low	159 Å²	159	155.7 Å²	155.7	85%	0.85	80%	0.804	S	S	*	*			trans	-85.9	64.5	164.7	-79.4	-17.9	0	0	0	109.3	K725	K725-N727 PolarHBondContact O-N 3.1Å
728	E	38.9	Very low	32.6	Very low	147 Å²	147	156.5 Å²	156.5	69%	0.687	81%	0.805	S	S	*	*			trans	-93.1	101.3	175.2	-166.8	168.3	-150.3	0	0	109.3	T726 L730	T726-E728 PolarHBondContact O-N 3.05Å; T726-E728 VanDerWaalsContact O-N 3.17Å; E728-L730 HydrophobicContact CG-CD2 4.47Å; E728-L730 HydrophobicContact CG-CG 4.18Å; E728-L730 PolarHBondContact O-N 3.38Å
729	K	34	Very low	32.5	Very low	195 Å²	195	156.9 Å²	156.9	85%	0.848	81%	0.809	S	S	*	*			trans	-88.6	83.7	175.2	-169.8	-179	178.7	-175.3	0	109
730	L	36.1	Very low	32.6	Very low	109 Å²	109	155.9 Å²	155.9	57%	0.571	81%	0.813	S	S	*	*			trans	-64.3	131	174.1	-74.5	165.4	0	0	0	111.2	E728 L732	E728-L730 HydrophobicContact CG-CD2 4.47Å; E728-L730 HydrophobicContact CG-CG 4.18Å; E728-L730 PolarHBondContact O-N 3.38Å; L730-L732 HydrophobicContact CB-CD1 4.12Å; L730-L732 HydrophobicContact CB-CG 4.07Å; L730-L732 HydrophobicContact CD1-CD1 3.98Å; L730-L732 HydrophobicContact CD1-CG 4.5Å; L730-L732 PolarHBondContact O-N 2.97Å
731	D	32.7	Very low	32.7	Very low	165 Å²	165	159.5 Å²	159.5	88%	0.882	82%	0.818	S	S	*	*			trans	-78.3	73.6	161.2	-78.3	-45.7	0	0	0	109.1	N733	D731-N733 PolarHBondContact O-N 3.45Å
732	L	34.2	Very low	32.7	Very low	143 Å²	143	159 Å²	159	75%	0.749	82%	0.824	S	S	*	*			trans	-82.5	94.6	172.1	-88.7	163.7	0	0	0	110.1	L730	L730-L732 HydrophobicContact CB-CD1 4.12Å; L730-L732 HydrophobicContact CB-CG 4.07Å; L730-L732 HydrophobicContact CD1-CD1 3.98Å; L730-L732 HydrophobicContact CD1-CG 4.5Å; L730-L732 PolarHBondContact O-N 2.97Å
733	N	30.5	Very low	33	Very low	155 Å²	155	158 Å²	158	83%	0.829	82%	0.822	S	S	*	*			trans	-152.9	48.2	165.9	-167.1	24	0	0	0	112.8	D731	D731-N733 PolarHBondContact O-N 3.45Å
734	V	35.1	Very low	32.9	Very low	127 Å²	127	153.6 Å²	153.6	77%	0.77	81%	0.812	S	S	*	*	S	Bend	trans	-144.3	145	163.5	-167	0	0	0	0	106.6
735	C	30.3	Very low	32.9	Very low	126 Å²	126	153 Å²	153	85%	0.851	80%	0.804	S	S	*	*			trans	69.8	46	177.7	-57.7	0	0	0	0	117.7
736	E	30.3	Very low	32.8	Very low	186 Å²	186	151.7 Å²	151.7	87%	0.869	80%	0.801	S	S	*	*			trans	-87.2	157.7	136.5	-80.4	-169.8	130.7	0	0	109.3
737	N	30.5	Very low	32.4	Very low	163 Å²	163	152.9 Å²	152.9	87%	0.872	80%	0.802	S	S	*	*	S	Bend	trans	77.7	59.5	-174.2	-54.9	-44.9	0	0	0	117.5
738	M	32.8	Very low	32.5	Very low	182 Å²	182	152.3 Å²	152.3	90%	0.897	80%	0.799	S	S	*	*			trans	-160.7	160.3	139.5	-105.6	164.7	95.8	0	0	109.1
739	M	33.1	Very low	32.1	Very low	188 Å²	188	151.3 Å²	151.3	93%	0.926	80%	0.803	S	S	*	*			trans	70.1	56.7	-177.7	-52.7	-173.5	-176.7	0	0	117.1
740	N	32.4	Very low	31.9	Very low	166 Å²	166	148 Å²	148	89%	0.888	80%	0.802	S	S	*	*			trans	-106.7	101.6	142.3	-93.1	-27.8	0	0	0	107.7
741	E	34.5	Very low	31.5	Very low	193 Å²	193	148.9 Å²	148.9	90%	0.902	81%	0.812	S	S	*	*			trans	168.1	166	147.8	-97.4	178.2	171.4	0	0	112.6
742	C	32.1	Very low	31.6	Very low	130 Å²	130	149.2 Å²	149.2	88%	0.878	81%	0.81	S	S	*	*			trans	65.4	67	173.1	-77.8	0	0	0	0	119.4
743	N	32.1	Very low	31.3	Very low	151 Å²	151	149 Å²	149	81%	0.807	81%	0.81	S	S	*	*			trans	-31.3	133.4	145.3	-81.1	-30	0	0	0	118.2
744	T	29.8	Very low	31.5	Very low	110 Å²	110	146.8 Å²	146.8	68%	0.675	81%	0.806	S	S	*	*				73.4	149.2	129.5	-31.3	0	0	0	0	122.5
745	D	31.3	Very low	31.4	Very low	125 Å²	125	145.9 Å²	145.9	67%	0.668	81%	0.806	S	S	*	*			trans	77.3	145.7	160.7	-65.8	-45.2	0	0	0	121
746	Q	31.4	Very low	31.5	Very low	156 Å²	156	146.3 Å²	146.3	73%	0.729	80%	0.804	S	S	*	*			cis	-160.7	137.5	-45.1	-127.7	-171.2	106.9	0	0	111.3
747	L	29.7	Very low	31.5	Very low	134 Å²	134	142.9 Å²	142.9	70%	0.702	80%	0.798	S	S	*	*			trans	31.4	135.5	150.5	-70.1	172.7	0	0	0	124.3
748	N	30.2	Very low	31.5	Very low	147 Å²	147	142.9 Å²	142.9	79%	0.786	80%	0.797	S	S	*	*			trans	99.1	148.3	136	-71.4	-14.1	0	0	0	123.2
749	T	30.3	Very low	31.6	Very low	126 Å²	126	143.1 Å²	143.1	77%	0.773	80%	0.795	S	S	*	*			trans	-96.7	176.9	179.3	53.9	0	0	0	0	111.9
750	P	31.5	Very low	31.4	Very low	126 Å²	126	138.8 Å²	138.8	82%	0.818	78%	0.784	S	S	*	*			trans	-139.8	161.2	132.5	37.6	-25.9	0	0	0	115.2
751	V	27.4	Very low	31.4	Very low	128 Å²	128	138.9 Å²	138.9	78%	0.776	78%	0.784	S	S	*	*			trans	-107.3	155.6	165.1	174	0	0	0	0	108.4
752	M	34.5	Very low	31.1	Very low	172 Å²	172	137.2 Å²	137.2	85%	0.847	78%	0.781	S	S	*	*			trans	-147.7	144.1	169.8	-103	-64.7	-66	0	0	111.9
753	D	28.3	Very low	31.1	Very low	138 Å²	138	140.3 Å²	140.3	74%	0.738	78%	0.783	S	S	*	*			trans	-100.5	161.6	-166.4	-61.8	-76.2	0	0	0	116.1
754	S	33.3	Very low	30.8	Very low	109 Å²	109	139 Å²	139	76%	0.762	79%	0.785	S	S	*	*			trans	-158.4	120.7	142.2	40.4	0	0	0	0	108.8
755	S	33.1	Very low	30.9	Very low	108 Å²	108	140.6 Å²	140.6	76%	0.755	80%	0.795	S	S	*	*				60.8	130.2	91.2	-61.3	0	0	0	0	114.3
756	T	32.5	Very low	30.7	Very low	134 Å²	134	142.5 Å²	142.5	82%	0.822	80%	0.8	S	S	*	*			cis	-162.3	164.1	9.4	5.8	0	0	0	0	110.4
757	P	30.4	Very low	30.6	Very low	115 Å²	115	141.1 Å²	141.1	75%	0.747	80%	0.796	S	S	*	*			trans	-103.8	155	-168.3	38.8	-33.9	0	0	0	116
758	I	31.9	Very low	30.6	Very low	163 Å²	163	142.3 Å²	142.3	84%	0.836	80%	0.804	S	S	*	*			trans	-141.3	123.5	169.1	-64.7	-175.8	0	0	0	112.4
759	H	33.6	Very low	30.4	Very low	186 Å²	186	142.2 Å²	142.2	86%	0.861	80%	0.803	S	S	*	*			trans	39	140	155.3	-88.4	-91.1	0	0	0	125
760	S	28.8	Very low	30.4	Very low	98 Å²	98	141.9 Å²	141.9	69%	0.685	81%	0.806	S	S	*	*			trans	-82.5	166.5	173.6	-17.2	0	0	0	0	114.3
761	N	33.7	Very low	30.2	Very low	168 Å²	168	141.9 Å²	141.9	90%	0.898	81%	0.809	S	S	*	*			trans	-153.2	144.5	134.9	-96.9	-27.7	0	0	0	110.4
762	N	27	Very low	30.3	Very low	157 Å²	157	143.4 Å²	143.4	84%	0.84	81%	0.811	S	S	*	*			trans	-100.8	134.2	173.5	-70.3	-16.6	0	0	0	109.5
763	E	32	Very low	29.9	Very low	195 Å²	195	140.9 Å²	140.9	91%	0.911	81%	0.811	S	S	*	*			trans	-133.7	133.8	149.9	-79.3	-162.6	131.2	0	0	109.8
764	S	26.7	Very low	29.9	Very low	123 Å²	123	138.3 Å²	138.3	86%	0.86	80%	0.803	S	S	*	*			trans	-110.1	113.6	-177.7	55.3	0	0	0	0	109.9
765	V	31.9	Very low	29.7	Very low	144 Å²	144	136 Å²	136	87%	0.873	80%	0.797	S	S	*	*			trans	-115.4	143.3	172.1	-179.3	0	0	0	0	109.4
766	Q	27.7	Very low	29.6	Very low	166 Å²	166	138.5 Å²	138.5	78%	0.776	79%	0.794	S	S	*	*			trans	-95.8	154.9	-166.8	-106.1	-178.8	18.3	0	0	113.4
767	L	27.3	Very low	29.8	Very low	126 Å²	126	139.1 Å²	139.1	66%	0.66	79%	0.786	S	S	*	*			trans	65.1	122.6	155.2	-61.5	162	0	0	0	117.9
768	N	30.9	Very low	30.1	Very low	159 Å²	159	139.3 Å²	139.3	85%	0.85	78%	0.78	S	S	*	*				-163.1	136.4	95.8	-90.3	-39.6	0	0	0	111.2
769	N	26.2	Very low	30.2	Very low	146 Å²	146	137 Å²	137	78%	0.781	77%	0.766	S	S	*	*			trans	-83.2	143.9	178.8	-68.9	-19.2	0	0	0	110.9
770	S	30.4	Very low	30.5	Very low	119 Å²	119	129.4 Å²	129.4	83%	0.832	73%	0.733	S	S	*	*			trans	-149.2	111.9	161.6	-76.5	0	0	0	0	108.9	I772	S770-I772 PolarHBondContact O-N 2.98Å
771	S	26.3	Very low	31.2	Very low	126 Å²	126	128.8 Å²	128.8	88%	0.881	72%	0.722	S	S	*	*			trans	-77	113.2	-164.8	-50.9	0	0	0	0	112.5
772	I	29.2	Very low	31.6	Very low	160 Å²	160	125.4 Å²	125.4	82%	0.821	70%	0.697	S	S	*	*			trans	-99.7	111	163.8	-60.2	179.3	0	0	0	107.6	S770 S774	S770-I772 PolarHBondContact O-N 2.98Å; I772-S774 PolarHBondContact O-N 3.27Å
773	S	26.3	Very low	32.5	Very low	119 Å²	119	121.1 Å²	121.1	83%	0.832	67%	0.674	S	S	*	*			trans	-79.4	97.6	179.9	-171.6	0	0	0	0	110.5	G775	S773-G775 PolarHBondContact O-N 3.17Å; S773-G775 VanDerWaalsContact O-N 3.1Å
774	S	29.9	Very low	33	Very low	83 Å²	83	119.8 Å²	119.8	58%	0.58	66%	0.66	S	S	*	*			trans	-75.1	91.9	171.7	57	0	0	0	0	110.2	I772 F776	I772-S774 PolarHBondContact O-N 3.27Å; S774-F776 WeakPolarHBondContact O-CD2 3.36Å; S774-F776 PolarHBondContact O-N 2.81Å
775	G	28.5	Very low	33.9	Very low	61 Å²	61	117.4 Å²	117.4	63%	0.629	64%	0.637	S	S	*	*			trans	-68.6	91.6	179.5	0	0	0	0	0	113.2	S773 K777	S773-G775 PolarHBondContact O-N 3.17Å; S773-G775 VanDerWaalsContact O-N 3.1Å; G775-K777 PolarHBondContact O-N 2.75Å
776	F	31.4	Very low	34.5	Very low	160 Å²	160	113.6 Å²	113.6	70%	0.702	62%	0.617	S	S	*	*			trans	-59.9	123.9	172	-67.6	-88.8	0	0	0	110.8	S774 N778	S774-F776 WeakPolarHBondContact O-CD2 3.36Å; S774-F776 PolarHBondContact O-N 2.81Å; F776-N778 PolarHBondContact O-N 3.2Å
777	K	35.5	Very low	35.2	Very low	148 Å²	148	115.4 Å²	115.4	64%	0.643	62%	0.617	S	S	*	*			trans	-93.1	98.8	-175.8	-67.6	179.6	-178.5	175.1	0	111.1	M163 G775 H779	M163-K777 PolarHBondContact SD-NZ 2.95Å; G775-K777 PolarHBondContact O-N 2.75Å; K777-H779 PolarHBondContact O-CE1 3.4Å; K777-H779 VanDerWaalsContact O-CE1 3.25Å; K777-H779 PolarHBondContact O-N 2.75Å; K777-H779 PolarHBondContact O-ND1 3.08Å
778	N	36.6	Very low	35.9	Very low	119 Å²	119	116 Å²	116	64%	0.636	62%	0.616	S	S	*	*			trans	-44.9	131.9	178.9	-66.5	-22.8	0	0	0	113.5	F776	F776-N778 PolarHBondContact O-N 3.2Å
779	H	34.2	Very low	37.3	Very low	114 Å²	114	111 Å²	111	53%	0.528	60%	0.602	S	S	.	*			trans	-91.4	106.9	-174.8	-42.9	-25.9	0	0	0	111.2	K777 L781	K777-H779 PolarHBondContact O-CE1 3.4Å; K777-H779 VanDerWaalsContact O-CE1 3.25Å; K777-H779 PolarHBondContact O-N 2.75Å; K777-H779 PolarHBondContact O-ND1 3.08Å; H779-L781 PolarHBondContact O-N 3.24Å; H779-L781 VanDerWaalsContact O-N 3.14Å
780	S	39.9	Very low	38.2	Very low	26 Å²	26	110.2 Å²	110.2	18%	0.182	61%	0.608	C	S	.	*			trans	-76.9	95.1	-177.1	-175.1	0	0	0	0	112.2	R782 D799	S780-R782 PolarHBondContact O-N 2.98Å; S780-D799 WeakPolarHBondContact CB-OD2 3.28Å; S780-D799 PolarHBondContact OG-OD2 2.97Å
781	L	43.2	Very low	38.2	Very low	86 Å²	86	111.9 Å²	111.9	45%	0.45	60%	0.603	S	S	.	*			trans	-75.3	55.8	175.9	-67.5	-173.8	0	0	0	113.4	H779 L783 L932	H779-L781 PolarHBondContact O-N 3.24Å; H779-L781 VanDerWaalsContact O-N 3.14Å; L781-L783 PolarHBondContact O-N 3.08Å; L781-L932 HydrophobicContact CB-CD1 4.34Å; L781-L932 HydrophobicContact CD1-CD1 3.66Å; L781-L932 HydrophobicContact CG-CD1 3.91Å
782	R	41.9	Very low	39	Very low	97 Å²	97	109 Å²	109	37%	0.366	58%	0.577	S	S	.	*			trans	-83.2	98.4	173.8	-96.6	-178.4	164	164.2	2	111.8	S780 R784	S780-R782 PolarHBondContact O-N 2.98Å; R782-R784 PolarHBondContact O-N 3.25Å
783	L	45.6	Very low	39.7	Very low	67 Å²	67	105 Å²	105	35%	0.351	56%	0.556	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-74.1	111.1	174.9	-56.6	-179.8	0	0	0	111.1	L781 V794 L897	L781-L783 PolarHBondContact O-N 3.08Å; L783-V794 HydrophobicContact CD2-CG1 3.81Å; L783-L897 HydrophobicContact CD1-CD1 4.31Å
784	R	44.2	Very low	40.2	Very low	167 Å²	167	103.3 Å²	103.3	63%	0.63	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	105	166.8	-115.2	-172.1	170.9	99.1	0.2	110.3	R782 S786 L795 L797	R782-R784 PolarHBondContact O-N 3.25Å; R784-S786 PolarHBondContact O-N 3.39Å; R784-L795 PolarHBondContact N-O 3.46Å; R784-L797 HydrophobicContact CB-CD1 4.13Å; R784-L797 HydrophobicContact CG-CD1 4.36Å
785	L	44.4	Very low	40.8	Very low	72 Å²	72	103.8 Å²	103.8	38%	0.377	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	101.2	175.5	-62.3	177.1	0	0	0	110.5	L792 V794 V904	L785-L792 HydrophobicContact CB-CD2 3.98Å; L785-L792 HydrophobicContact CD2-CD2 3.64Å; L785-L792 HydrophobicContact CG-CD2 4.41Å; L785-V794 HydrophobicContact CD2-CG2 4.49Å; L785-V904 HydrophobicContact CD1-CG1 4.41Å
786	S	45.6	Very low	41.2	Very low	64 Å²	64	106.2 Å²	106.2	45%	0.448	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	122.9	176.1	-170	0	0	0	0	111.4	R784 L792 I793	R784-S786 PolarHBondContact O-N 3.39Å; S786-L792 CarbonylContact O-C 3.52Å; S786-L792 WeakPolarHBondContact O-CA 3.43Å; S786-I793 PolarHBondContact N-O 3.44Å; S786-I793 PolarHBondContact O-N 2.95Å
787	R	42.5	Very low	41.5	Very low	204 Å²	204	101.3 Å²	101.3	77%	0.77	52%	0.522	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.7	111.4	-177.2	180	-177.1	163.5	-158.2	-5	111.4	G789	R787-G789 PolarHBondContact NE-O 2.79Å; R787-G789 PolarHBondContact NH2-O 3.4Å
788	Q	42.3	Very low	41.4	Very low	140 Å²	140	99.7 Å²	99.7	65%	0.654	53%	0.529	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	86.2	174.4	-170.1	165.5	-16.4	0	0	109.8	S790 Q791	Q788-S790 PolarHBondContact O-N 3.25Å; Q788-Q791 CarbonylContact C-O 3.35Å; Q788-Q791 PolarHBondContact N-O 3Å; Q788-Q791 PolarHBondContact O-N 2.92Å
789	G	58.4	Low	41.2	Very low	53 Å²	53	98.1 Å²	98.1	55%	0.546	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	75	-108.5	-176.6	0	0	0	0	0	112.3	R787	R787-G789 PolarHBondContact NE-O 2.79Å; R787-G789 PolarHBondContact NH2-O 3.4Å
790	S	45.2	Very low	41	Very low	129 Å²	129	98.1 Å²	98.1	90%	0.902	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.2	-11.3	173.9	52.7	0	0	0	0	113.6	Q788	Q788-S790 PolarHBondContact O-N 3.25Å
791	Q	31.6	Very low	40.9	Very low	155 Å²	155	102.5 Å²	102.5	72%	0.724	56%	0.559	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93	152	171.5	-94.8	176.7	-28.7	0	0	110.9	Q788	Q788-Q791 CarbonylContact C-O 3.35Å; Q788-Q791 PolarHBondContact N-O 3Å; Q788-Q791 PolarHBondContact O-N 2.92Å
792	L	41.7	Very low	40.3	Very low	65 Å²	65	105.9 Å²	105.9	34%	0.34	58%	0.578	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-129.5	126.1	-179.4	-159.9	161.2	0	0	0	108.1	L785 S786 M905	L785-L792 HydrophobicContact CB-CD2 3.98Å; L785-L792 HydrophobicContact CD2-CD2 3.64Å; L785-L792 HydrophobicContact CG-CD2 4.41Å; S786-L792 CarbonylContact O-C 3.52Å; S786-L792 WeakPolarHBondContact O-CA 3.43Å; L792-M905 HydrophobicContact CD1-CG 3.95Å; L792-M905 HydrophobicContact CD1-SD 4.03Å
793	I	44.1	Very low	39.6	Very low	77 Å²	77	107.4 Å²	107.4	40%	0.395	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.8	127.2	-179.3	-55.3	175.2	0	0	0	108	S786 L795	S786-I793 PolarHBondContact N-O 3.44Å; S786-I793 PolarHBondContact O-N 2.95Å; I793-L795 HydrophobicContact CG2-CD2 3.87Å; I793-L795 HydrophobicContact CG2-CG 4.1Å
794	V	38.2	Very low	38.8	Very low	83 Å²	83	108.9 Å²	108.9	50%	0.503	62%	0.619	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.2	124.2	167.9	177.3	0	0	0	0	107.8	L783 L785	L783-V794 HydrophobicContact CD2-CG1 3.81Å; L785-V794 HydrophobicContact CD2-CG2 4.49Å
795	L	42.7	Very low	38	Very low	93 Å²	93	110.9 Å²	110.9	49%	0.487	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.4	122.3	172.2	-63.9	175.9	0	0	0	109.1	R784 I793	R784-L795 PolarHBondContact N-O 3.46Å; I793-L795 HydrophobicContact CG2-CD2 3.87Å; I793-L795 HydrophobicContact CG2-CG 4.1Å
796	P	35.3	Very low	37.3	Very low	112 Å²	112	116.8 Å²	116.8	73%	0.727	66%	0.659	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.2	139.7	165.4	30.7	-32.6	0	0	0	109.1
797	L	38.1	Very low	36.5	Very low	57 Å²	57	118.7 Å²	118.7	30%	0.298	67%	0.672	S	S	.	*			trans	-93.8	127	168.8	-96.6	67.8	0	0	0	109.2	R784	R784-L797 HydrophobicContact CB-CD1 4.13Å; R784-L797 HydrophobicContact CG-CD1 4.36Å
798	S	34.1	Very low	35.9	Very low	113 Å²	113	116.8 Å²	116.8	79%	0.79	68%	0.676	S	S	*	*			trans	-86.5	113.7	157.2	-55.1	0	0	0	0	107.5	S800	S798-S800 PolarHBondContact O-N 3.17Å
799	D	31.5	Very low	35.1	Very low	87 Å²	87	117.4 Å²	117.4	47%	0.465	68%	0.684	S	S	.	*			trans	-67.6	115.1	-179.2	-75.8	-48.5	0	0	0	110.5	S780	S780-D799 WeakPolarHBondContact CB-OD2 3.28Å; S780-D799 PolarHBondContact OG-OD2 2.97Å
800	S	31.1	Very low	33.7	Very low	113 Å²	113	121.1 Å²	121.1	79%	0.79	70%	0.696	S	S	*	*			trans	-129.2	73.8	170.1	41.2	0	0	0	0	107.7	S798 D802	S798-S800 PolarHBondContact O-N 3.17Å; S800-D802 PolarHBondContact O-N 3.49Å
801	T	36.7	Very low	32.8	Very low	119 Å²	119	120.3 Å²	120.3	73%	0.73	69%	0.691	S	S	*	*			trans	-87.2	104.3	-179.6	49.1	0	0	0	0	110.5	S803	T801-S803 PolarHBondContact O-N 2.9Å; T801-S803 VanDerWaalsContact O-N 3.11Å
802	D	30.5	Very low	32.7	Very low	156 Å²	156	118.8 Å²	118.8	83%	0.834	69%	0.694	S	S	*	*			trans	-57.3	113.7	161.2	-77	-43	0	0	0	109.2	S800 S804	S800-D802 PolarHBondContact O-N 3.49Å; D802-S804 PolarHBondContact O-N 3.22Å
803	S	28.2	Very low	32.3	Very low	129 Å²	129	124.4 Å²	124.4	90%	0.902	72%	0.716	S	S	*	*			trans	-78.4	64.4	-177.2	57.7	0	0	0	0	111.6	T801	T801-S803 PolarHBondContact O-N 2.9Å; T801-S803 VanDerWaalsContact O-N 3.11Å
804	S	27.6	Very low	31.5	Very low	98 Å²	98	128.7 Å²	128.7	69%	0.685	73%	0.734	S	S	*	*			trans	-135	57.1	-175.9	-177.2	0	0	0	0	112.9	D802	D802-S804 PolarHBondContact O-N 3.22Å
805	F	29.2	Very low	31.2	Very low	209 Å²	209	129 Å²	129	92%	0.917	75%	0.745	S	S	*	*			trans	-128.8	119.6	158.9	-87.1	-81.2	0	0	0	110.3	S807	F805-S807 PolarHBondContact O-N 3.38Å
806	Q	29.3	Very low	30.4	Very low	197 Å²	197	128.7 Å²	128.7	92%	0.921	76%	0.756	S	S	*	*			trans	-66.7	123.8	178.8	-69.4	170.3	-27.9	0	0	109.8	L808	Q806-L808 PolarHBondContact O-N 3.24Å
807	S	28	Very low	30.1	Very low	103 Å²	103	130.5 Å²	130.5	72%	0.72	75%	0.753	S	S	*	*			trans	-70.1	116	178.1	-169.2	0	0	0	0	110.5	F805 N809	F805-S807 PolarHBondContact O-N 3.38Å; S807-N809 PolarHBondContact O-N 2.87Å
808	L	29.6	Very low	29.6	Very low	164 Å²	164	135.2 Å²	135.2	86%	0.859	78%	0.778	S	S	*	*			trans	-80.4	109.1	166.1	-83.2	169.1	0	0	0	108.4	Q806 T810	Q806-L808 PolarHBondContact O-N 3.24Å; L808-T810 PolarHBondContact O-N 2.88Å
809	N	25.5	Very low	29.7	Very low	153 Å²	153	137.6 Å²	137.6	82%	0.818	78%	0.782	S	S	*	*			trans	-59.9	114.3	-171.3	-65.3	-45.3	0	0	0	113.3	S807	S807-N809 PolarHBondContact O-N 2.87Å
810	T	29	Very low	29.7	Very low	131 Å²	131	141.3 Å²	141.3	80%	0.804	80%	0.797	S	S	*	*			trans	-126	117.4	157.3	54.3	0	0	0	0	108.7	L808	L808-T810 PolarHBondContact O-N 2.88Å
811	S	26.6	Very low	29.8	Very low	113 Å²	113	141.4 Å²	141.4	79%	0.79	80%	0.796	S	S	*	*			trans	-65.8	131.8	-165.5	-174.3	0	0	0	0	114	K813	S811-K813 PolarHBondContact O-N 3.09Å
812	P	30.6	Very low	29.7	Very low	123 Å²	123	142.6 Å²	142.6	80%	0.799	79%	0.793	S	S	*	*			trans	-79.6	111.5	168.8	32	-30.8	0	0	0	110
813	K	32.3	Very low	29.9	Very low	183 Å²	183	143.3 Å²	143.3	80%	0.796	80%	0.797	S	S	*	*			trans	-95.2	101.4	176.8	-161	175	-173.9	-177.8	0	111.8	S811	S811-K813 PolarHBondContact O-N 3.09Å
814	E	28.2	Very low	31	Very low	166 Å²	166	141.6 Å²	141.6	78%	0.776	78%	0.781	S	S	*	*			trans	34.9	104.8	153.1	-63	170.4	122.4	0	0	118.5
815	A	29.9	Very low	32.9	Very low	89 Å²	89	140.1 Å²	140.1	74%	0.736	77%	0.771	S	S	*	*			trans	-128.9	84	142.4	0	0	0	0	0	107.5	F817	A815-F817 PolarHBondContact O-N 2.85Å
816	A	26.7	Very low	35.3	Very low	87 Å²	87	133.8 Å²	133.8	72%	0.719	74%	0.741	S	S	*	*			trans	-64.9	127.8	179.7	0	0	0	0	0	110.4
817	F	29.4	Very low	37.5	Very low	151 Å²	151	128.6 Å²	128.6	66%	0.662	71%	0.714	S	S	*	*			trans	-134.3	107.4	165.2	-81.8	-82.6	0	0	0	107.2	A815 N819	A815-F817 PolarHBondContact O-N 2.85Å; F817-N819 PolarHBondContact O-N 3.36Å
818	D	27.9	Very low	39.8	Very low	156 Å²	156	125.9 Å²	125.9	83%	0.834	69%	0.694	S	S	*	*			trans	-68.3	101.1	174.2	-59.1	-70.2	0	0	0	108.9	E820	D818-E820 PolarHBondContact O-N 3.07Å
819	N	35.6	Very low	42.4	Very low	162 Å²	162	119.8 Å²	119.8	87%	0.866	66%	0.66	S	S	*	*			trans	-77.7	71.9	173.2	-81.1	-22.2	0	0	0	109.9	F817	F817-N819 PolarHBondContact O-N 3.36Å
820	E	32.2	Very low	44.9	Very low	165 Å²	165	112.5 Å²	112.5	77%	0.771	62%	0.621	S	S	*	*			trans	-61.3	142	167.6	-171	165.1	-152.2	0	0	110.5	D818 H822	D818-E820 PolarHBondContact O-N 3.07Å; E820-H822 PolarHBondContact O-N 3.5Å
821	C	33.8	Very low	47.2	Very low	116 Å²	116	109 Å²	109	78%	0.784	60%	0.598	S	S	*	*			trans	-80.7	109.6	-167.7	176.5	0	0	0	0	112.4
822	H	34.1	Very low	49.7	Very low	143 Å²	143	109.7 Å²	109.7	66%	0.662	59%	0.588	S	S	*	*			trans	-138.3	130	166.8	-76.5	-47	0	0	0	114.1	E820 T824	E820-H822 PolarHBondContact O-N 3.5Å; H822-T824 PolarHBondContact O-N 3.23Å; H822-T824 PolarHBondContact O-OG1 3.01Å
823	D	35.1	Very low	52.2	Low	172 Å²	172	104 Å²	104	92%	0.92	55%	0.551	S	S	*	*			trans	-51.6	103.3	163.9	-73.2	-66.9	0	0	0	110.5
824	T	50.1	Low	54.5	Low	92 Å²	92	95.7 Å²	95.7	56%	0.564	52%	0.516	S	S	*	.			trans	-125.9	131.1	174.1	38.5	0	0	0	0	108.4	H822	H822-T824 PolarHBondContact O-N 3.23Å; H822-T824 PolarHBondContact O-OG1 3.01Å
825	S	66.9	Low	56.9	Low	68 Å²	68	91.1 Å²	91.1	48%	0.476	50%	0.502	S	S	.	.			trans	-55.9	152.9	-172.6	71.8	0	0	0	0	111.7	Y827 S828 W829	S825-Y827 PolarHBondContact O-N 3.18Å; S825-S828 WeakPolarHBondContact O-CA 3.4Å; S825-S828 WeakPolarHBondContact O-CB 3.2Å; S825-S828 PolarHBondContact O-N 2.98Å; S825-S828 PolarHBondContact OG-OG 2.97Å; S825-W829 PolarHBondContact O-N 2.64Å
826	W	80.1	Confident	59.3	Low	76 Å²	76	87.8 Å²	87.8	29%	0.288	47%	0.471	S	S	.	.	H	α-helix	trans	-55.8	-23.6	178.1	71.7	-95	0	0	0	112.8	W829 A830 L881 I886 K889 F892	W826-W829 PolarHBondContact O-N 3.41Å; W826-A830 HydrophobicContact CE3-CB 4.34Å; W826-A830 HydrophobicContact CZ3-CB 4.33Å; W826-A830 WeakPolarHBondContact O-CB 3.4Å; W826-A830 PolarHBondContact O-N 2.67Å; W826-L881 HydrophobicContact CH2-CD2 4.13Å; W826-L881 HydrophobicContact CZ3-CD2 4.05Å; W826-I886 HydrophobicContact CH2-CB 4.34Å; W826-I886 HydrophobicContact CH2-CG2 3.71Å; W826-I886 VanDerWaalsContact CH2-O 3.24Å; W826-I886 WeakPolarHBondContact CH2-O 3.12Å; W826-I886 WeakPolarHBondContact CZ2-O 3.34Å; W826-I886 HydrophobicContact CZ3-CG2 3.97Å; W826-K889 HydrophobicContact CB-CB 4.1Å; W826-K889 HydrophobicContact CB-CG 4.42Å; W826-K889 HydrophobicContact CG-CB 4.47Å; W826-F892 HydrophobicContact CZ3-CB 4.09Å
827	Y	76.8	Confident	61.6	Low	88 Å²	88	83.7 Å²	83.7	35%	0.345	44%	0.438	S	S	.	.	H	α-helix	trans	-65.5	-40.5	172.7	-169.2	-96.9	0	0	0	112.5	S825 A830 N831 L881	S825-Y827 PolarHBondContact O-N 3.18Å; Y827-A830 PolarHBondContact O-N 3Å; Y827-N831 WeakPolarHBondContact CD1-ND2 3.47Å; Y827-N831 VanDerWaalsContact CE1-ND2 3.25Å; Y827-N831 WeakPolarHBondContact CE1-ND2 3.26Å; Y827-N831 PolarHBondContact O-N 2.92Å; Y827-N831 PolarHBondContact O-ND2 3.4Å; Y827-L881 HydrophobicContact CD2-CD2 4.16Å; Y827-L881 HydrophobicContact CE2-CB 4.14Å; Y827-L881 HydrophobicContact CE2-CD2 4.06Å
828	S	75	Confident	63.6	Low	45 Å²	45	79.6 Å²	79.6	32%	0.315	42%	0.421	S	S	.	.	H	α-helix	trans	-63.1	-44.3	174.2	-54.4	0	0	0	0	111.2	S825 N831 Q832	S825-S828 WeakPolarHBondContact O-CA 3.4Å; S825-S828 WeakPolarHBondContact O-CB 3.2Å; S825-S828 PolarHBondContact O-N 2.98Å; S825-S828 PolarHBondContact OG-OG 2.97Å; S828-N831 PolarHBondContact O-N 2.65Å; S828-Q832 WeakPolarHBondContact O-CG 3.35Å; S828-Q832 PolarHBondContact O-N 2.86Å
829	W	83.6	Confident	65.9	Low	36 Å²	36	79.1 Å²	79.1	14%	0.136	41%	0.407	C	S	.	.	H	α-helix	trans	-63.2	-41.8	174.1	174.1	86.1	0	0	0	112.5	S825 W826 N831 Q832 L833 K889 F892 V893 L928 N931	S825-W829 PolarHBondContact O-N 2.64Å; W826-W829 PolarHBondContact O-N 3.41Å; W829-N831 PolarHBondContact O-N 3.5Å; W829-Q832 PolarHBondContact O-N 3.4Å; W829-L833 HydrophobicContact CH2-CD2 4.46Å; W829-L833 PolarHBondContact O-N 3.12Å; W829-K889 HydrophobicContact CE3-CD 4.25Å; W829-K889 HydrophobicContact CE3-CG 3.89Å; W829-K889 HydrophobicContact CH2-CG 4.2Å; W829-K889 HydrophobicContact CZ3-CD 4.14Å; W829-K889 HydrophobicContact CZ3-CG 3.54Å; W829-F892 AromaticContact CZ3-CD1 3.82Å; W829-F892 HydrophobicContact CZ3-CD1 3.82Å; W829-F892 AromaticContact CZ3-CE1 3.95Å; W829-F892 HydrophobicContact CZ3-CE1 3.95Å; W829-V893 HydrophobicContact CH2-CG2 4.12Å; W829-V893 HydrophobicContact CZ3-CG2 4.4Å; W829-L928 HydrophobicContact CH2-CD2 4.31Å; W829-N931 HydrophobicContact CZ2-CB 4.01Å; W829-N931 PolarHBondContact NE1-OD1 3.09Å
830	A	79.7	Confident	67.7	Low	0 Å²	0	72.5 Å²	72.5	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-61.2	-42.2	176	0	0	0	0	0	112.2	W826 Y827 L833 L834 F892	W826-A830 HydrophobicContact CE3-CB 4.34Å; W826-A830 HydrophobicContact CZ3-CB 4.33Å; W826-A830 WeakPolarHBondContact O-CB 3.4Å; W826-A830 PolarHBondContact O-N 2.67Å; Y827-A830 PolarHBondContact O-N 3Å; A830-L833 PolarHBondContact O-N 3.04Å; A830-L834 WeakPolarHBondContact O-CG 3.33Å; A830-L834 PolarHBondContact O-N 2.82Å; A830-L834 VanDerWaalsContact O-N 3.16Å; A830-F892 HydrophobicContact CB-CD1 3.97Å; A830-F892 HydrophobicContact CB-CD2 4.05Å; A830-F892 HydrophobicContact CB-CE1 3.72Å; A830-F892 HydrophobicContact CB-CE2 3.84Å; A830-F892 HydrophobicContact CB-CG 4.11Å; A830-F892 HydrophobicContact CB-CZ 3.66Å
831	N	77.6	Confident	69.4	Low	59 Å²	59	64.9 Å²	64.9	32%	0.316	34%	0.336	S	S	.	.	H	α-helix	trans	-66.3	-42.1	174.6	-78.4	-77.9	0	0	0	112.1	Y827 S828 W829 L833 L834 S835	Y827-N831 WeakPolarHBondContact CD1-ND2 3.47Å; Y827-N831 VanDerWaalsContact CE1-ND2 3.25Å; Y827-N831 WeakPolarHBondContact CE1-ND2 3.26Å; Y827-N831 PolarHBondContact O-N 2.92Å; Y827-N831 PolarHBondContact O-ND2 3.4Å; S828-N831 PolarHBondContact O-N 2.65Å; W829-N831 PolarHBondContact O-N 3.5Å; N831-L833 VanDerWaalsContact C-N 3.31Å; N831-L833 PolarHBondContact O-N 3.27Å; N831-L834 PolarHBondContact O-N 3.45Å; N831-S835 PolarHBondContact O-N 3.16Å; N831-S835 PolarHBondContact O-OG 3.37Å
832	Q	78.1	Confident	71.1	Confident	126 Å²	126	62 Å²	62	59%	0.589	32%	0.318	S	S	*	.	H	α-helix	trans	-58.4	-40.8	173.4	-73.8	173.8	-2.2	0	0	112.3	S828 W829 N836	S828-Q832 WeakPolarHBondContact O-CG 3.35Å; S828-Q832 PolarHBondContact O-N 2.86Å; W829-Q832 PolarHBondContact O-N 3.4Å; Q832-N836 VanDerWaalsContact O-CB 3.28Å; Q832-N836 WeakPolarHBondContact O-CB 3.47Å; Q832-N836 PolarHBondContact O-N 2.86Å
833	L	82.9	Confident	72.8	Confident	3 Å²	3	57.2 Å²	57.2	2%	0.016	30%	0.302	C	S	.	.	H	α-helix	trans	-62.6	-42.4	177.2	-169.7	72.5	0	0	0	112	W829 A830 N831 N836 G837 F892 L896 W924 Q927 L928	W829-L833 HydrophobicContact CH2-CD2 4.46Å; W829-L833 PolarHBondContact O-N 3.12Å; A830-L833 PolarHBondContact O-N 3.04Å; N831-L833 VanDerWaalsContact C-N 3.31Å; N831-L833 PolarHBondContact O-N 3.27Å; L833-N836 PolarHBondContact O-N 2.91Å; L833-G837 PolarHBondContact O-N 3.4Å; L833-F892 HydrophobicContact CD2-CE1 3.64Å; L833-F892 HydrophobicContact CD2-CZ 4.09Å; L833-L896 HydrophobicContact CD2-CD2 3.72Å; L833-W924 HydrophobicContact CD1-CB 4.48Å; L833-W924 HydrophobicContact CD1-CG 4.03Å; L833-W924 HydrophobicContact CG-CG 4.32Å; L833-W924 PolarHBondContact O-NE1 3.48Å; L833-Q927 HydrophobicContact CD1-CB 3.89Å; L833-Q927 VanDerWaalsContact CD1-OE1 3.28Å; L833-L928 HydrophobicContact CD2-CD2 4.33Å
834	L	80.9	Confident	74.3	Confident	10 Å²	10	51.7 Å²	51.7	5%	0.052	27%	0.269	C	S	.	.	H	α-helix	trans	-66.2	-51	177.1	-69.6	168.8	0	0	0	111.4	A830 N831 N836 G837 E838 L874 I877 I878 L881 F892	A830-L834 WeakPolarHBondContact O-CG 3.33Å; A830-L834 PolarHBondContact O-N 2.82Å; A830-L834 VanDerWaalsContact O-N 3.16Å; N831-L834 PolarHBondContact O-N 3.45Å; L834-N836 PolarHBondContact O-N 3.03Å; L834-G837 WeakPolarHBondContact O-CA 3.48Å; L834-G837 PolarHBondContact O-N 3.02Å; L834-E838 PolarHBondContact O-N 3.27Å; L834-L874 HydrophobicContact CD2-CD2 3.75Å; L834-I877 HydrophobicContact CD2-CG2 4.36Å; L834-I878 HydrophobicContact CD1-CG1 4.28Å; L834-L881 HydrophobicContact CD1-CD1 3.62Å; L834-F892 HydrophobicContact CD1-CE2 4.32Å; L834-F892 HydrophobicContact CG-CZ 4.31Å
835	S	79.3	Confident	74.8	Confident	69 Å²	69	50.9 Å²	50.9	48%	0.483	26%	0.26	S	S	.	.	H	α-helix	trans	-61.7	-31.1	176.4	-60.3	0	0	0	0	112.7	N831 E838 R839	N831-S835 PolarHBondContact O-N 3.16Å; N831-S835 PolarHBondContact O-OG 3.37Å; S835-E838 PolarHBondContact O-N 2.74Å; S835-R839 VanDerWaalsContact O-CB 3.26Å; S835-R839 WeakPolarHBondContact O-CB 3.38Å; S835-R839 PolarHBondContact O-N 3.38Å
836	N	79.7	Confident	74.6	Confident	19 Å²	19	54.4 Å²	54.4	10%	0.102	27%	0.272	C	S	.	.	H	α-helix	trans	-65.7	-39.8	172.1	-169	37.3	0	0	0	111.6	Q832 L833 L834 R839 I840 Q927	Q832-N836 VanDerWaalsContact O-CB 3.28Å; Q832-N836 WeakPolarHBondContact O-CB 3.47Å; Q832-N836 PolarHBondContact O-N 2.86Å; L833-N836 PolarHBondContact O-N 2.91Å; L834-N836 PolarHBondContact O-N 3.03Å; N836-R839 PolarHBondContact O-N 3.1Å; N836-R839 PolarHBondContact OD1-NE 3.34Å; N836-R839 PolarHBondContact OD1-NH2 2.91Å; N836-I840 WeakPolarHBondContact O-CB 3.18Å; N836-I840 WeakPolarHBondContact O-CD1 3.48Å; N836-I840 WeakPolarHBondContact O-CG1 3.34Å; N836-I840 PolarHBondContact O-N 3.46Å; N836-Q927 PolarHBondContact ND2-NE2 2.99Å; N836-Q927 PolarHBondContact ND2-OE1 3.48Å; N836-Q927 VanDerWaalsContact ND2-OE1 3.08Å
837	G	73.9	Confident	73.1	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.01	28%	0.282	C	S	.	.	H	α-helix	trans	-60.7	-46.7	173.1	0	0	0	0	0	112.8	L833 L834 R839 I840 V841	L833-G837 PolarHBondContact O-N 3.4Å; L834-G837 WeakPolarHBondContact O-CA 3.48Å; L834-G837 PolarHBondContact O-N 3.02Å; G837-R839 VanDerWaalsContact C-N 3.34Å; G837-R839 PolarHBondContact O-N 3.14Å; G837-I840 PolarHBondContact O-N 3.04Å; G837-V841 WeakPolarHBondContact O-CG2 3.44Å; G837-V841 PolarHBondContact O-N 2.71Å
838	E	73.4	Confident	71.6	Confident	65 Å²	65	58.6 Å²	58.6	30%	0.304	31%	0.306	S	S	.	.	H	α-helix	trans	-64.1	-37.1	175.4	-64.2	-170.3	138	0	0	112.4	L834 S835 V841 S842 H871 L874	L834-E838 PolarHBondContact O-N 3.27Å; S835-E838 PolarHBondContact O-N 2.74Å; E838-V841 PolarHBondContact O-N 3.44Å; E838-S842 WeakPolarHBondContact O-CB 3.01Å; E838-S842 PolarHBondContact O-N 3.41Å; E838-S842 PolarHBondContact O-OG 3.23Å; E838-H871 IonicContact OE1-CE1 2.88Å; E838-H871 PolarHBondContact OE1-CE1 2.99Å; E838-H871 IonicContact OE1-ND1 2.63Å; E838-L874 HydrophobicContact CG-CD1 3.93Å
839	R	75.3	Confident	70.2	Confident	146 Å²	146	65.4 Å²	65.4	55%	0.551	33%	0.333	S	S	*	.	H	α-helix	trans	-66	-41.3	174.8	-175.6	178.3	66.7	159.5	-0.2	112.3	S835 N836 G837 S842 A843	S835-R839 VanDerWaalsContact O-CB 3.26Å; S835-R839 WeakPolarHBondContact O-CB 3.38Å; S835-R839 PolarHBondContact O-N 3.38Å; N836-R839 PolarHBondContact O-N 3.1Å; N836-R839 PolarHBondContact OD1-NE 3.34Å; N836-R839 PolarHBondContact OD1-NH2 2.91Å; G837-R839 VanDerWaalsContact C-N 3.34Å; G837-R839 PolarHBondContact O-N 3.14Å; R839-S842 PolarHBondContact O-N 3.35Å; R839-A843 WeakPolarHBondContact O-CB 3.35Å; R839-A843 PolarHBondContact O-N 3.33Å
840	I	73.2	Confident	68.1	Low	23 Å²	23	67.3 Å²	67.3	12%	0.118	35%	0.352	C	S	.	.	H	α-helix	trans	-62.6	-46.3	176	-73.4	161.2	0	0	0	110.4	N836 G837 S842 A843 W844 Q923	N836-I840 WeakPolarHBondContact O-CB 3.18Å; N836-I840 WeakPolarHBondContact O-CD1 3.48Å; N836-I840 WeakPolarHBondContact O-CG1 3.34Å; N836-I840 PolarHBondContact O-N 3.46Å; G837-I840 PolarHBondContact O-N 3.04Å; I840-S842 VanDerWaalsContact C-N 3.3Å; I840-S842 PolarHBondContact O-N 3.47Å; I840-A843 WeakPolarHBondContact O-CB 3.26Å; I840-A843 PolarHBondContact O-N 2.91Å; I840-A843 VanDerWaalsContact O-N 3.12Å; I840-W844 HydrophobicContact CG2-CD2 4.45Å; I840-W844 HydrophobicContact CG2-CH2 4.17Å; I840-W844 HydrophobicContact CG2-CZ2 3.41Å; I840-W844 VanDerWaalsContact CG2-CZ2 3.41Å; I840-W844 PolarHBondContact O-N 3.36Å; I840-Q923 HydrophobicContact CD1-CB 3.88Å; I840-Q923 HydrophobicContact CD1-CG 4.23Å; I840-Q923 HydrophobicContact CG2-CG 4.35Å
841	V	68.1	Low	66.3	Low	6 Å²	6	76.4 Å²	76.4	4%	0.036	40%	0.397	C	S	.	.	H	α-helix	trans	-61.7	-39.1	175.6	168.5	0	0	0	0	111.3	G837 E838 W844 M845 V870 L920	G837-V841 WeakPolarHBondContact O-CG2 3.44Å; G837-V841 PolarHBondContact O-N 2.71Å; E838-V841 PolarHBondContact O-N 3.44Å; V841-W844 HydrophobicContact CB-CE3 4.48Å; V841-W844 HydrophobicContact CG2-CE3 4.07Å; V841-W844 HydrophobicContact CG2-CH2 4.41Å; V841-W844 HydrophobicContact CG2-CZ3 3.81Å; V841-W844 WeakPolarHBondContact O-CB 3.44Å; V841-W844 PolarHBondContact O-N 3.14Å; V841-M845 HydrophobicContact CG1-CE 3.75Å; V841-M845 PolarHBondContact O-N 3.22Å; V841-V870 HydrophobicContact CG1-CG2 4.05Å; V841-V870 HydrophobicContact CG2-CG1 4.24Å; V841-V870 HydrophobicContact CG2-CG2 3.76Å; V841-L920 HydrophobicContact CG2-CD2 4.28Å
842	S	69.8	Low	64.8	Low	56 Å²	56	80.8 Å²	80.8	39%	0.392	42%	0.419	S	S	.	.	H	α-helix	trans	-67.5	-33.6	174.4	-56.5	0	0	0	0	112.6	E838 R839 I840 W844 M845 L846	E838-S842 WeakPolarHBondContact O-CB 3.01Å; E838-S842 PolarHBondContact O-N 3.41Å; E838-S842 PolarHBondContact O-OG 3.23Å; R839-S842 PolarHBondContact O-N 3.35Å; I840-S842 VanDerWaalsContact C-N 3.3Å; I840-S842 PolarHBondContact O-N 3.47Å; S842-W844 VanDerWaalsContact C-N 3.34Å; S842-M845 WeakPolarHBondContact O-CB 3.47Å; S842-M845 PolarHBondContact O-N 2.8Å; S842-M845 VanDerWaalsContact O-N 3.15Å; S842-L846 PolarHBondContact O-N 3.17Å
843	A	69	Low	63.1	Low	41 Å²	41	77.6 Å²	77.6	34%	0.339	41%	0.406	S	S	.	.	H	α-helix	trans	-67.9	-32.7	173.7	0	0	0	0	0	112.3	R839 I840 M845 L846 N847	R839-A843 WeakPolarHBondContact O-CB 3.35Å; R839-A843 PolarHBondContact O-N 3.33Å; I840-A843 WeakPolarHBondContact O-CB 3.26Å; I840-A843 PolarHBondContact O-N 2.91Å; I840-A843 VanDerWaalsContact O-N 3.12Å; A843-M845 VanDerWaalsContact C-N 3.28Å; A843-M845 PolarHBondContact O-N 3.02Å; A843-L846 PolarHBondContact O-N 3.4Å; A843-N847 PolarHBondContact O-N 3.44Å; A843-N847 VanDerWaalsContact O-N 3.12Å
844	W	66.5	Low	61.4	Low	57 Å²	57	80.6 Å²	80.6	22%	0.216	43%	0.427	C	S	.	.	H	α-helix	trans	-67.4	-26	170.1	-57.1	-20.5	0	0	0	113	I840 V841 S842 L853 E919	I840-W844 HydrophobicContact CG2-CD2 4.45Å; I840-W844 HydrophobicContact CG2-CH2 4.17Å; I840-W844 HydrophobicContact CG2-CZ2 3.41Å; I840-W844 VanDerWaalsContact CG2-CZ2 3.41Å; I840-W844 PolarHBondContact O-N 3.36Å; V841-W844 HydrophobicContact CB-CE3 4.48Å; V841-W844 HydrophobicContact CG2-CE3 4.07Å; V841-W844 HydrophobicContact CG2-CH2 4.41Å; V841-W844 HydrophobicContact CG2-CZ3 3.81Å; V841-W844 WeakPolarHBondContact O-CB 3.44Å; V841-W844 PolarHBondContact O-N 3.14Å; S842-W844 VanDerWaalsContact C-N 3.34Å; W844-L853 HydrophobicContact CB-CD1 4.44Å; W844-L853 HydrophobicContact CD2-CD2 4.37Å; W844-L853 HydrophobicContact CG-CD2 4.34Å; W844-E919 HydrophobicContact CH2-CB 3.9Å; W844-E919 HydrophobicContact CH2-CG 3.6Å; W844-E919 HydrophobicContact CZ2-CB 4.21Å; W844-E919 HydrophobicContact CZ2-CG 3.37Å
845	M	60.9	Low	59.9	Low	75 Å²	75	85.3 Å²	85.3	37%	0.369	46%	0.459	S	S	.	.	H	α-helix	trans	-77.5	-30.1	174.8	-64.2	172.8	-171.7	0	0	113	V841 S842 A843 K867	V841-M845 HydrophobicContact CG1-CE 3.75Å; V841-M845 PolarHBondContact O-N 3.22Å; S842-M845 WeakPolarHBondContact O-CB 3.47Å; S842-M845 PolarHBondContact O-N 2.8Å; S842-M845 VanDerWaalsContact O-N 3.15Å; A843-M845 VanDerWaalsContact C-N 3.28Å; A843-M845 PolarHBondContact O-N 3.02Å; M845-K867 HydrophobicContact CE-CB 3.77Å; M845-K867 HydrophobicContact CE-CG 4.44Å
846	L	62.5	Low	58.3	Low	142 Å²	142	89.5 Å²	89.5	74%	0.743	46%	0.464	S	S	*	.	H	α-helix	trans	-88.7	-35.4	-176	-72.9	164.9	0	0	0	113.4	S842 A843	S842-L846 PolarHBondContact O-N 3.17Å; A843-L846 PolarHBondContact O-N 3.4Å
847	N	48.4	Very low	57	Low	93 Å²	93	90.1 Å²	90.1	50%	0.497	47%	0.465	S	S	.	.			trans	-102.8	85.8	-169.5	-70.4	-32.8	0	0	0	113.6	A843 E849 S850	A843-N847 PolarHBondContact O-N 3.44Å; A843-N847 VanDerWaalsContact O-N 3.12Å; N847-E849 PolarHBondContact O-N 3.42Å; N847-S850 PolarHBondContact O-N 2.92Å
848	N	47	Very low	56.1	Low	158 Å²	158	98 Å²	98	85%	0.845	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-16.8	174.1	-92.7	-41.7	0	0	0	115
849	E	44.7	Very low	55.1	Low	189 Å²	189	100.6 Å²	100.6	88%	0.883	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.3	-3.4	-172.8	-59.2	-162.3	127.9	0	0	115.2	N847 M851	N847-E849 PolarHBondContact O-N 3.42Å; E849-M851 PolarHBondContact O-N 3.31Å; E849-M851 VanDerWaalsContact O-N 3.09Å
850	S	39.2	Very low	54	Low	75 Å²	75	100.6 Å²	100.6	52%	0.524	52%	0.521	S	S	.	.			trans	-75.5	107.5	-172.2	-166.1	0	0	0	0	113.8	N847 L852	N847-S850 PolarHBondContact O-N 2.92Å; S850-L852 PolarHBondContact O-N 3.32Å
851	M	42.2	Very low	53.2	Low	192 Å²	192	101.3 Å²	101.3	95%	0.946	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-36.2	-7.4	-173.5	-124.8	171.9	177.8	0	0	121.8	E849	E849-M851 PolarHBondContact O-N 3.31Å; E849-M851 VanDerWaalsContact O-N 3.09Å
852	L	45.7	Very low	53	Low	150 Å²	150	103.1 Å²	103.1	79%	0.785	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-17.9	-170.5	-74.4	172.1	0	0	0	115.7	S850 S854	S850-L852 PolarHBondContact O-N 3.32Å; L852-S854 PolarHBondContact O-N 3.42Å
853	L	43.1	Very low	52.5	Low	59 Å²	59	104.5 Å²	104.5	31%	0.309	55%	0.548	S	S	.	.	S	Bend	trans	-67.4	107.9	177.7	-74.3	176.3	0	0	0	111.1	W844 F857	W844-L853 HydrophobicContact CB-CD1 4.44Å; W844-L853 HydrophobicContact CD2-CD2 4.37Å; W844-L853 HydrophobicContact CG-CD2 4.34Å; L853-F857 HydrophobicContact CD2-CD2 4.09Å; L853-F857 HydrophobicContact CD2-CE2 4.31Å
854	S	47.6	Very low	52.2	Low	67 Å²	67	106.6 Å²	106.6	47%	0.469	56%	0.559	S	S	.	*			trans	-48.9	140.7	175.4	-166	0	0	0	0	111	L852 R856 F857	L852-S854 PolarHBondContact O-N 3.42Å; S854-R856 PolarHBondContact O-N 2.88Å; S854-F857 PolarHBondContact O-N 3.45Å
855	P	49.2	Very low	52.2	Low	109 Å²	109	107.1 Å²	107.1	71%	0.708	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	-1.2	-167.6	-28.6	35.7	0	0	0	118
856	R	45.5	Very low	52.5	Low	156 Å²	156	104.8 Å²	104.8	59%	0.589	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	-27.5	-179.6	-63.2	178.8	175.6	176.8	-0.6	114.1	S854 L915	S854-R856 PolarHBondContact O-N 2.88Å; R856-L915 HydrophobicContact CB-CD1 3.97Å
857	F	52.6	Low	52.8	Low	32 Å²	32	103.6 Å²	103.6	14%	0.14	54%	0.544	C	S	.	.	G	3₁₀ helix	trans	-77	-26.5	-174.7	-78.7	-79.2	0	0	0	114.2	L853 S854 N859 I912 L915 V916	L853-F857 HydrophobicContact CD2-CD2 4.09Å; L853-F857 HydrophobicContact CD2-CE2 4.31Å; S854-F857 PolarHBondContact O-N 3.45Å; F857-N859 PolarHBondContact O-N 2.7Å; F857-I912 HydrophobicContact CE1-CG2 4.26Å; F857-L915 HydrophobicContact CE1-CB 4.29Å; F857-L915 HydrophobicContact CE2-CB 4.08Å; F857-L915 HydrophobicContact CE2-CD1 4.48Å; F857-L915 HydrophobicContact CZ-CB 3.57Å; F857-L915 HydrophobicContact CZ-CD1 4.4Å; F857-V916 HydrophobicContact CE1-CG2 3.98Å; F857-V916 HydrophobicContact CZ-CG2 4.21Å
858	K	53.7	Low	54.1	Low	167 Å²	167	105.8 Å²	105.8	73%	0.726	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-68.3	-4	-164.9	-65.5	-163.1	172.4	-165.1	0	116.8
859	N	53.5	Low	55.1	Low	120 Å²	120	99.3 Å²	99.3	64%	0.642	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-121.8	-15	-164.5	-64.9	-3.9	0	0	0	116.4	F857	F857-N859 PolarHBondContact O-N 2.7Å
860	H	51	Low	56.3	Low	145 Å²	145	90.5 Å²	90.5	67%	0.671	48%	0.476	S	S	*	.	S	Bend	trans	-143.5	8	-154.8	-60.1	-42.6	0	0	0	118.1
861	T	57.9	Low	57.8	Low	39 Å²	39	90.5 Å²	90.5	24%	0.239	47%	0.467	C	S	.	.			trans	-140.7	138.5	-175.1	-27.9	0	0	0	0	111.3	D865 L866 I912	T861-D865 HydrophobicContact CG2-CB 3.94Å; T861-L866 HydrophobicContact CG2-CD1 4.46Å; T861-L866 HydrophobicContact CG2-CG 4.18Å; T861-I912 HydrophobicContact CG2-CD1 4.03Å; T861-I912 HydrophobicContact CG2-CG2 4.19Å; T861-I912 VanDerWaalsContact OG1-CD1 3.28Å; T861-I912 WeakPolarHBondContact OG1-CD1 3.35Å
862	S	63.2	Low	59.4	Low	43 Å²	43	85.6 Å²	85.6	30%	0.301	44%	0.442	S	S	.	.			trans	-81.2	155	165.9	97	0	0	0	0	110.4	S864 D865 L866	S862-S864 PolarHBondContact O-N 2.83Å; S862-S864 PolarHBondContact OG-N 3Å; S862-D865 WeakPolarHBondContact CA-OD2 3.31Å; S862-D865 WeakPolarHBondContact CB-OD2 3.31Å; S862-D865 PolarHBondContact N-OD2 3.29Å; S862-D865 PolarHBondContact O-N 3Å; S862-D865 PolarHBondContact OG-N 2.88Å; S862-D865 PolarHBondContact OG-OD1 3.06Å; S862-D865 PolarHBondContact OG-OD2 2.9Å; S862-L866 PolarHBondContact O-N 3.47Å
863	P	59	Low	60.6	Low	86 Å²	86	78.9 Å²	78.9	56%	0.558	41%	0.407	S	S	*	.	H	α-helix	trans	-62.6	-28	176.4	25.6	-33.9	0	0	0	112.4	L866 K867	P863-L866 PolarHBondContact O-N 3Å; P863-K867 PolarHBondContact O-N 3.48Å; P863-K867 VanDerWaalsContact O-N 3.16Å
864	S	63.5	Low	62.1	Low	84 Å²	84	76.3 Å²	76.3	59%	0.587	39%	0.394	S	S	*	.	H	α-helix	trans	-65.7	-49	175.4	-55	0	0	0	0	111.6	S862 L866 K867 E868	S862-S864 PolarHBondContact O-N 2.83Å; S862-S864 PolarHBondContact OG-N 3Å; S864-L866 PolarHBondContact O-N 3.28Å; S864-K867 PolarHBondContact O-N 3.05Å; S864-K867 VanDerWaalsContact O-N 3.08Å; S864-E868 PolarHBondContact O-N 3.33Å
865	D	65.5	Low	63.4	Low	68 Å²	68	76.6 Å²	76.6	36%	0.364	40%	0.396	S	S	.	.	H	α-helix	trans	-61.6	-34.5	179.8	-25.6	-37.9	0	0	0	110.5	T861 S862 E868 L869	T861-D865 HydrophobicContact CG2-CB 3.94Å; S862-D865 WeakPolarHBondContact CA-OD2 3.31Å; S862-D865 WeakPolarHBondContact CB-OD2 3.31Å; S862-D865 PolarHBondContact N-OD2 3.29Å; S862-D865 PolarHBondContact O-N 3Å; S862-D865 PolarHBondContact OG-N 2.88Å; S862-D865 PolarHBondContact OG-OD1 3.06Å; S862-D865 PolarHBondContact OG-OD2 2.9Å; D865-E868 PolarHBondContact O-N 3.32Å; D865-L869 VanDerWaalsContact O-CB 3.27Å; D865-L869 WeakPolarHBondContact O-CB 3.23Å; D865-L869 WeakPolarHBondContact O-CD1 3.45Å; D865-L869 WeakPolarHBondContact O-CG 3.48Å; D865-L869 PolarHBondContact O-N 2.99Å
866	L	66.7	Low	64.7	Low	27 Å²	27	73.9 Å²	73.9	14%	0.141	38%	0.378	C	S	.	.	H	α-helix	trans	-66.4	-39	176.7	-117.5	165.2	0	0	0	112.4	T861 S862 P863 S864 V870 V916	T861-L866 HydrophobicContact CG2-CD1 4.46Å; T861-L866 HydrophobicContact CG2-CG 4.18Å; S862-L866 PolarHBondContact O-N 3.47Å; P863-L866 PolarHBondContact O-N 3Å; S864-L866 PolarHBondContact O-N 3.28Å; L866-V870 WeakPolarHBondContact O-CG2 3.11Å; L866-V870 PolarHBondContact O-N 3.48Å; L866-V916 HydrophobicContact CD2-CG2 3.74Å
867	K	69.4	Low	66.2	Low	117 Å²	117	66.5 Å²	66.5	51%	0.509	35%	0.35	S	S	.	.	H	α-helix	trans	-69.1	-43.3	173.5	-168.9	171.9	176.1	174.7	0	111.8	M845 P863 S864 V870 H871	M845-K867 HydrophobicContact CE-CB 3.77Å; M845-K867 HydrophobicContact CE-CG 4.44Å; P863-K867 PolarHBondContact O-N 3.48Å; P863-K867 VanDerWaalsContact O-N 3.16Å; S864-K867 PolarHBondContact O-N 3.05Å; S864-K867 VanDerWaalsContact O-N 3.08Å; K867-V870 PolarHBondContact O-N 3.39Å; K867-H871 WeakPolarHBondContact CE-NE2 3.47Å; K867-H871 PolarHBondContact O-CD2 2.91Å; K867-H871 PolarHBondContact O-N 2.82Å
868	E	75	Confident	67.4	Low	138 Å²	138	67.9 Å²	67.9	65%	0.645	36%	0.358	S	S	*	.	H	α-helix	trans	-62	-45.9	178.1	-170.5	178.9	170.2	0	0	111.6	S864 D865 V870 H871 E872	S864-E868 PolarHBondContact O-N 3.33Å; D865-E868 PolarHBondContact O-N 3.32Å; E868-V870 VanDerWaalsContact C-N 3.25Å; E868-V870 PolarHBondContact O-N 2.98Å; E868-H871 PolarHBondContact O-N 2.75Å; E868-E872 WeakPolarHBondContact O-CB 3.47Å; E868-E872 PolarHBondContact O-N 2.68Å
869	L	69	Low	68.4	Low	23 Å²	23	62.5 Å²	62.5	12%	0.12	34%	0.342	C	S	.	.	H	α-helix	trans	-58.7	-34.2	174.4	-76.3	169.4	0	0	0	112.9	D865 E872 L873 I912 R913	D865-L869 VanDerWaalsContact O-CB 3.27Å; D865-L869 WeakPolarHBondContact O-CB 3.23Å; D865-L869 WeakPolarHBondContact O-CD1 3.45Å; D865-L869 WeakPolarHBondContact O-CG 3.48Å; D865-L869 PolarHBondContact O-N 2.99Å; L869-E872 WeakPolarHBondContact CD2-OE2 3.45Å; L869-L873 WeakPolarHBondContact O-CD1 3.18Å; L869-L873 WeakPolarHBondContact O-CG 3.31Å; L869-L873 PolarHBondContact O-N 2.82Å; L869-L873 VanDerWaalsContact O-N 3.16Å; L869-I912 HydrophobicContact CD1-CB 4.36Å; L869-I912 HydrophobicContact CD1-CG2 3.81Å; L869-R913 HydrophobicContact CD2-CB 4.13Å; L869-R913 HydrophobicContact CD2-CG 4.13Å; L869-R913 VanDerWaalsContact CD2-CZ 3.47Å
870	V	69.9	Low	69.5	Low	4 Å²	4	57.5 Å²	57.5	2%	0.024	32%	0.315	C	S	.	.	H	α-helix	trans	-77.7	-40.2	178.7	169.8	0	0	0	0	111.1	V841 L866 K867 E868 E872 L873 L874 V916	V841-V870 HydrophobicContact CG1-CG2 4.05Å; V841-V870 HydrophobicContact CG2-CG1 4.24Å; V841-V870 HydrophobicContact CG2-CG2 3.76Å; L866-V870 WeakPolarHBondContact O-CG2 3.11Å; L866-V870 PolarHBondContact O-N 3.48Å; K867-V870 PolarHBondContact O-N 3.39Å; E868-V870 VanDerWaalsContact C-N 3.25Å; E868-V870 PolarHBondContact O-N 2.98Å; V870-E872 VanDerWaalsContact C-N 3.34Å; V870-E872 PolarHBondContact O-N 3.06Å; V870-L873 PolarHBondContact O-N 3.05Å; V870-L874 HydrophobicContact CG1-CD1 3.85Å; V870-L874 HydrophobicContact CG1-CG 4.28Å; V870-L874 WeakPolarHBondContact O-CB 3.32Å; V870-L874 WeakPolarHBondContact O-CG 3.38Å; V870-L874 PolarHBondContact O-N 2.94Å; V870-V916 HydrophobicContact CG2-CG1 3.86Å
871	H	69.7	Low	70.7	Confident	74 Å²	74	51 Å²	51	34%	0.343	29%	0.285	S	S	.	.	H	α-helix	trans	-66.3	-33.4	171.2	-68.1	-50.5	0	0	0	112.6	E838 K867 E868 L873 L874 S875	E838-H871 IonicContact OE1-CE1 2.88Å; E838-H871 PolarHBondContact OE1-CE1 2.99Å; E838-H871 IonicContact OE1-ND1 2.63Å; K867-H871 WeakPolarHBondContact CE-NE2 3.47Å; K867-H871 PolarHBondContact O-CD2 2.91Å; K867-H871 PolarHBondContact O-N 2.82Å; E868-H871 PolarHBondContact O-N 2.75Å; H871-L873 VanDerWaalsContact C-N 3.31Å; H871-L873 PolarHBondContact O-N 3.25Å; H871-L874 PolarHBondContact O-N 2.91Å; H871-S875 WeakPolarHBondContact O-CA 3.1Å; H871-S875 WeakPolarHBondContact O-CB 3.4Å; H871-S875 PolarHBondContact O-N 3.29Å
872	E	75.7	Confident	71.4	Confident	89 Å²	89	54.3 Å²	54.3	42%	0.416	30%	0.302	S	S	.	.	H	α-helix	trans	-61.5	-37.7	170.7	-174	-161.7	-179.5	0	0	111.9	E868 L869 V870 P876 R913	E868-E872 WeakPolarHBondContact O-CB 3.47Å; E868-E872 PolarHBondContact O-N 2.68Å; L869-E872 WeakPolarHBondContact CD2-OE2 3.45Å; V870-E872 VanDerWaalsContact C-N 3.34Å; V870-E872 PolarHBondContact O-N 3.06Å; E872-P876 WeakPolarHBondContact O-CD 3.4Å; E872-R913 IonicContact OE1-CZ 3.13Å; E872-R913 VanDerWaalsContact OE1-CZ 3.32Å; E872-R913 IonicContact OE1-NE 2.75Å; E872-R913 PolarHBondContact OE1-NE 3.38Å; E872-R913 IonicContact OE1-NH2 3.06Å; E872-R913 PolarHBondContact OE1-NH2 3.36Å; E872-R913 IonicContact OE2-CZ 2.86Å; E872-R913 IonicContact OE2-NE 2.67Å; E872-R913 PolarHBondContact OE2-NE 2.71Å; E872-R913 IonicContact OE2-NH2 3.81Å; E872-R913 PolarHBondContact OE2-NH2 3.24Å
873	L	72.3	Confident	71.9	Confident	10 Å²	10	57 Å²	57	5%	0.052	31%	0.313	C	S	.	.	H	α-helix	trans	-74.3	-36.4	177	-71.5	168.5	0	0	0	113.1	L869 V870 H871 T903 R913 V916	L869-L873 WeakPolarHBondContact O-CD1 3.18Å; L869-L873 WeakPolarHBondContact O-CG 3.31Å; L869-L873 PolarHBondContact O-N 2.82Å; L869-L873 VanDerWaalsContact O-N 3.16Å; V870-L873 PolarHBondContact O-N 3.05Å; H871-L873 VanDerWaalsContact C-N 3.31Å; H871-L873 PolarHBondContact O-N 3.25Å; L873-T903 HydrophobicContact CD2-CG2 3.29Å; L873-R913 HydrophobicContact CD1-CG 4.42Å; L873-R913 HydrophobicContact CD2-CG 4.29Å; L873-V916 HydrophobicContact CD1-CG1 4.15Å
874	L	74.5	Confident	72.6	Confident	4 Å²	4	60.2 Å²	60.2	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-93.1	-28.1	-174	-64.8	-176.2	0	0	0	114.3	L834 E838 V870 H871 P876 I877 I878 W924	L834-L874 HydrophobicContact CD2-CD2 3.75Å; E838-L874 HydrophobicContact CG-CD1 3.93Å; V870-L874 HydrophobicContact CG1-CD1 3.85Å; V870-L874 HydrophobicContact CG1-CG 4.28Å; V870-L874 WeakPolarHBondContact O-CB 3.32Å; V870-L874 WeakPolarHBondContact O-CG 3.38Å; V870-L874 PolarHBondContact O-N 2.94Å; H871-L874 PolarHBondContact O-N 2.91Å; L874-P876 VanDerWaalsContact C-CD 3.47Å; L874-I877 PolarHBondContact O-N 3.42Å; L874-I878 HydrophobicContact CB-CD1 3.97Å; L874-I878 WeakPolarHBondContact O-CG1 3.21Å; L874-I878 PolarHBondContact O-N 2.88Å; L874-W924 HydrophobicContact CD2-CH2 3.96Å
875	S	75.2	Confident	73	Confident	73 Å²	73	61.7 Å²	61.7	51%	0.51	32%	0.321	S	S	.	.	H	α-helix	trans	-50.9	-43.8	-178.5	171	0	0	0	0	113.9	H871 I877 I878 S879	H871-S875 WeakPolarHBondContact O-CA 3.1Å; H871-S875 WeakPolarHBondContact O-CB 3.4Å; H871-S875 PolarHBondContact O-N 3.29Å; S875-I877 VanDerWaalsContact C-N 3.32Å; S875-I877 PolarHBondContact O-N 3.11Å; S875-I878 PolarHBondContact O-N 3.12Å; S875-S879 VanDerWaalsContact O-CB 3.31Å; S875-S879 WeakPolarHBondContact O-CB 3.44Å; S875-S879 PolarHBondContact O-N 3.31Å
876	P	76.8	Confident	73.5	Confident	53 Å²	53	59.2 Å²	59.2	34%	0.344	31%	0.307	S	S	.	.	H	α-helix	trans	-59.3	-42	175.4	-23.6	34.5	0	0	0	112.7	E872 L874 S879 D880 I899	E872-P876 WeakPolarHBondContact O-CD 3.4Å; L874-P876 VanDerWaalsContact C-CD 3.47Å; P876-S879 WeakPolarHBondContact O-CB 3.34Å; P876-S879 PolarHBondContact O-N 2.84Å; P876-D880 WeakPolarHBondContact O-CB 3.46Å; P876-D880 PolarHBondContact O-N 3.48Å; P876-I899 HydrophobicContact CB-CD1 4.05Å
877	I	77.1	Confident	73.9	Confident	1 Å²	1	65.7 Å²	65.7	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-70.6	-42.2	-177.5	-53.6	180	0	0	0	110.9	L834 L874 S875 S879 D880 L881 F892 L896 I899	L834-I877 HydrophobicContact CD2-CG2 4.36Å; L874-I877 PolarHBondContact O-N 3.42Å; S875-I877 VanDerWaalsContact C-N 3.32Å; S875-I877 PolarHBondContact O-N 3.11Å; I877-S879 VanDerWaalsContact C-N 3.32Å; I877-D880 PolarHBondContact O-N 3.19Å; I877-L881 HydrophobicContact CG2-CD1 4.38Å; I877-L881 WeakPolarHBondContact O-CB 3.26Å; I877-L881 WeakPolarHBondContact O-CG 3.46Å; I877-L881 PolarHBondContact O-N 3.29Å; I877-F892 HydrophobicContact CG2-CD2 4.17Å; I877-F892 HydrophobicContact CG2-CE2 3.71Å; I877-L896 HydrophobicContact CD1-CB 4.37Å; I877-L896 HydrophobicContact CD1-CD1 3.47Å; I877-L896 VanDerWaalsContact CD1-CD1 3.47Å; I877-I899 HydrophobicContact CD1-CD1 3.95Å; I877-I899 HydrophobicContact CG1-CD1 3.42Å; I877-I899 VanDerWaalsContact CG1-CD1 3.42Å
878	I	76.4	Confident	74.3	Confident	60 Å²	60	62.2 Å²	62.2	31%	0.308	33%	0.325	S	S	.	.	H	α-helix	trans	-65.2	-39.2	177	-64.7	165.9	0	0	0	110.1	L834 L874 S875 N882	L834-I878 HydrophobicContact CD1-CG1 4.28Å; L874-I878 HydrophobicContact CB-CD1 3.97Å; L874-I878 WeakPolarHBondContact O-CG1 3.21Å; L874-I878 PolarHBondContact O-N 2.88Å; S875-I878 PolarHBondContact O-N 3.12Å; I878-N882 WeakPolarHBondContact O-CB 3.36Å; I878-N882 VanDerWaalsContact O-CG 3.22Å; I878-N882 PolarHBondContact O-N 2.88Å; I878-N882 PolarHBondContact O-ND2 3.13Å
879	S	76.1	Confident	74.5	Confident	54 Å²	54	58.4 Å²	58.4	38%	0.378	31%	0.306	S	S	.	.	H	α-helix	trans	-63.2	-47.7	172.1	-170.3	0	0	0	0	112	S875 P876 I877 L881 N882 N883	S875-S879 VanDerWaalsContact O-CB 3.31Å; S875-S879 WeakPolarHBondContact O-CB 3.44Å; S875-S879 PolarHBondContact O-N 3.31Å; P876-S879 WeakPolarHBondContact O-CB 3.34Å; P876-S879 PolarHBondContact O-N 2.84Å; I877-S879 VanDerWaalsContact C-N 3.32Å; S879-L881 VanDerWaalsContact C-N 3.29Å; S879-L881 PolarHBondContact O-N 3.38Å; S879-N882 PolarHBondContact O-N 3.15Å; S879-N883 WeakPolarHBondContact O-CB 3.22Å; S879-N883 PolarHBondContact O-N 3.48Å; S879-N883 PolarHBondContact O-ND2 2.99Å; S879-N883 PolarHBondContact OG-ND2 3.27Å
880	D	76.5	Confident	75	Confident	16 Å²	16	61.4 Å²	61.4	9%	0.086	32%	0.322	C	S	.	.	H	α-helix	trans	-65.2	-30.3	-179.8	-65.1	-40.8	0	0	0	113	P876 I877 L885 I886 R895	P876-D880 WeakPolarHBondContact O-CB 3.46Å; P876-D880 PolarHBondContact O-N 3.48Å; I877-D880 PolarHBondContact O-N 3.19Å; D880-L885 PolarHBondContact O-N 2.72Å; D880-I886 HydrophobicContact CB-CD1 3.64Å; D880-I886 HydrophobicContact CB-CG1 3.92Å; D880-I886 PolarHBondContact O-N 2.96Å; D880-R895 VanDerWaalsContact CG-NH2 3.3Å; D880-R895 IonicContact OD1-NH2 3.88Å; D880-R895 PolarHBondContact OD1-NH2 3.21Å; D880-R895 VanDerWaalsContact OD1-NH2 3.09Å; D880-R895 IonicContact OD2-CZ 2.7Å; D880-R895 IonicContact OD2-NE 2.71Å; D880-R895 PolarHBondContact OD2-NE 3.17Å; D880-R895 IonicContact OD2-NH2 2.75Å; D880-R895 PolarHBondContact OD2-NH2 3.3Å
881	L	75.2	Confident	75.4	Confident	7 Å²	7	66.8 Å²	66.8	4%	0.037	35%	0.347	C	S	.	.	H	α-helix	trans	-70.4	-50.2	171.5	-76.3	171.7	0	0	0	111.7	W826 Y827 L834 I877 S879 N883 E884 I886 F892	W826-L881 HydrophobicContact CH2-CD2 4.13Å; W826-L881 HydrophobicContact CZ3-CD2 4.05Å; Y827-L881 HydrophobicContact CD2-CD2 4.16Å; Y827-L881 HydrophobicContact CE2-CB 4.14Å; Y827-L881 HydrophobicContact CE2-CD2 4.06Å; L834-L881 HydrophobicContact CD1-CD1 3.62Å; I877-L881 HydrophobicContact CG2-CD1 4.38Å; I877-L881 WeakPolarHBondContact O-CB 3.26Å; I877-L881 WeakPolarHBondContact O-CG 3.46Å; I877-L881 PolarHBondContact O-N 3.29Å; S879-L881 VanDerWaalsContact C-N 3.29Å; S879-L881 PolarHBondContact O-N 3.38Å; L881-N883 PolarHBondContact O-N 3.19Å; L881-E884 PolarHBondContact O-N 3Å; L881-I886 HydrophobicContact CD2-CB 4.28Å; L881-I886 HydrophobicContact CD2-CD1 4.21Å; L881-I886 HydrophobicContact CD2-CG2 4.4Å; L881-I886 HydrophobicContact CG-CD1 4.23Å; L881-F892 HydrophobicContact CD1-CD2 4.38Å; L881-F892 HydrophobicContact CD1-CE2 4.04Å; L881-F892 HydrophobicContact CD2-CD2 4.14Å
882	N	73.3	Confident	76.1	Confident	109 Å²	109	63.2 Å²	63.2	58%	0.583	33%	0.33	S	S	*	.	H	α-helix	trans	-65.5	-24.2	-178.4	-72.5	-24.4	0	0	0	113.4	I878 S879	I878-N882 WeakPolarHBondContact O-CB 3.36Å; I878-N882 VanDerWaalsContact O-CG 3.22Å; I878-N882 PolarHBondContact O-N 2.88Å; I878-N882 PolarHBondContact O-ND2 3.13Å; S879-N882 PolarHBondContact O-N 3.15Å
883	N	73.3	Confident	76.5	Confident	100 Å²	100	59.2 Å²	59.2	54%	0.535	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	13.5	178.7	-68.5	-58.7	0	0	0	113.9	S879 L881 L885	S879-N883 WeakPolarHBondContact O-CB 3.22Å; S879-N883 PolarHBondContact O-N 3.48Å; S879-N883 PolarHBondContact O-ND2 2.99Å; S879-N883 PolarHBondContact OG-ND2 3.27Å; L881-N883 PolarHBondContact O-N 3.19Å; N883-L885 HydrophobicContact CB-CD1 4.15Å; N883-L885 HydrophobicContact CB-CG 4.19Å; N883-L885 PolarHBondContact O-N 2.9Å
884	E	72.7	Confident	76.9	Confident	154 Å²	154	64.1 Å²	64.1	72%	0.72	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.3	18.4	-178.3	-58.4	-168.2	167.9	0	0	115.8	L881 I886 K887	L881-E884 PolarHBondContact O-N 3Å; E884-I886 VanDerWaalsContact C-N 3.28Å; E884-I886 PolarHBondContact O-N 2.76Å; E884-K887 VanDerWaalsContact O-CE 3.26Å; E884-K887 WeakPolarHBondContact O-CE 3.48Å
885	L	73.3	Confident	77.3	Confident	115 Å²	115	69.1 Å²	69.1	60%	0.602	35%	0.353	S	S	*	.			trans	-69.6	-30.4	179.1	-70	168.6	0	0	0	111.4	D880 N883	D880-L885 PolarHBondContact O-N 2.72Å; N883-L885 HydrophobicContact CB-CD1 4.15Å; N883-L885 HydrophobicContact CB-CG 4.19Å; N883-L885 PolarHBondContact O-N 2.9Å
886	I	76.6	Confident	77.8	Confident	15 Å²	15	65.8 Å²	65.8	8%	0.077	33%	0.329	C	S	.	.			trans	-95.9	112.4	178.1	-58.8	176.4	0	0	0	109.2	W826 D880 L881 E884 Q891 F892 R895	W826-I886 HydrophobicContact CH2-CB 4.34Å; W826-I886 HydrophobicContact CH2-CG2 3.71Å; W826-I886 VanDerWaalsContact CH2-O 3.24Å; W826-I886 WeakPolarHBondContact CH2-O 3.12Å; W826-I886 WeakPolarHBondContact CZ2-O 3.34Å; W826-I886 HydrophobicContact CZ3-CG2 3.97Å; D880-I886 HydrophobicContact CB-CD1 3.64Å; D880-I886 HydrophobicContact CB-CG1 3.92Å; D880-I886 PolarHBondContact O-N 2.96Å; L881-I886 HydrophobicContact CD2-CB 4.28Å; L881-I886 HydrophobicContact CD2-CD1 4.21Å; L881-I886 HydrophobicContact CD2-CG2 4.4Å; L881-I886 HydrophobicContact CG-CD1 4.23Å; E884-I886 VanDerWaalsContact C-N 3.28Å; E884-I886 PolarHBondContact O-N 2.76Å; I886-Q891 HydrophobicContact CG2-CB 3.99Å; I886-F892 HydrophobicContact CD1-CD2 4.42Å; I886-F892 HydrophobicContact CG2-CB 3.74Å; I886-R895 HydrophobicContact CD1-CB 4.33Å; I886-R895 HydrophobicContact CD1-CG 4.25Å
887	K	74.6	Confident	78.2	Confident	164 Å²	164	64.4 Å²	64.4	71%	0.713	32%	0.319	S	S	*	.			trans	-107.2	-0.7	-173.7	-57.4	-167.8	178.1	-166.7	0	115.2	E884	E884-K887 VanDerWaalsContact O-CE 3.26Å; E884-K887 WeakPolarHBondContact O-CE 3.48Å
888	S	78.1	Confident	78.5	Confident	44 Å²	44	67.7 Å²	67.7	31%	0.308	34%	0.342	S	S	.	.	S	Bend	trans	-154.2	158.6	179.3	74	0	0	0	0	113.2	L890 Q891 F892	S888-L890 PolarHBondContact O-N 2.83Å; S888-Q891 PolarHBondContact O-N 3.27Å; S888-Q891 VanDerWaalsContact O-N 3.13Å; S888-Q891 PolarHBondContact OG-N 3Å; S888-F892 PolarHBondContact O-N 3.32Å
889	K	79.1	Confident	78.8	Confident	57 Å²	57	66 Å²	66	25%	0.248	33%	0.334	C	S	.	.	H	α-helix	trans	-52	-40.3	172.9	-159.6	178.9	-169.4	178.5	0	111.9	W826 W829 F892 V893 N931	W826-K889 HydrophobicContact CB-CB 4.1Å; W826-K889 HydrophobicContact CB-CG 4.42Å; W826-K889 HydrophobicContact CG-CB 4.47Å; W829-K889 HydrophobicContact CE3-CD 4.25Å; W829-K889 HydrophobicContact CE3-CG 3.89Å; W829-K889 HydrophobicContact CH2-CG 4.2Å; W829-K889 HydrophobicContact CZ3-CD 4.14Å; W829-K889 HydrophobicContact CZ3-CG 3.54Å; K889-F892 PolarHBondContact O-N 3.2Å; K889-V893 WeakPolarHBondContact O-CG2 3.33Å; K889-V893 PolarHBondContact O-N 3.01Å; K889-N931 WeakPolarHBondContact CE-O 3.35Å; K889-N931 PolarHBondContact NZ-O 2.9Å; K889-N931 PolarHBondContact NZ-OD1 2.63Å
890	L	78	Confident	79.2	Confident	87 Å²	87	64.1 Å²	64.1	46%	0.455	32%	0.319	S	S	.	.	H	α-helix	trans	-68.7	-42.6	178.7	-174.3	63.9	0	0	0	112.4	S888 F892 V893 H894	S888-L890 PolarHBondContact O-N 2.83Å; L890-F892 VanDerWaalsContact C-N 3.33Å; L890-F892 PolarHBondContact O-N 2.88Å; L890-V893 PolarHBondContact O-N 3.38Å; L890-H894 WeakPolarHBondContact O-CB 3.49Å; L890-H894 PolarHBondContact O-CD2 3.4Å; L890-H894 PolarHBondContact O-N 3.38Å
891	Q	79.3	Confident	79.6	Confident	116 Å²	116	64.4 Å²	64.4	54%	0.542	32%	0.324	S	S	.	.	H	α-helix	trans	-61.5	-41.7	174.6	-76.8	-71.8	-7	0	0	111.5	I886 S888 H894 R895	I886-Q891 HydrophobicContact CG2-CB 3.99Å; S888-Q891 PolarHBondContact O-N 3.27Å; S888-Q891 VanDerWaalsContact O-N 3.13Å; S888-Q891 PolarHBondContact OG-N 3Å; Q891-H894 PolarHBondContact O-N 3.45Å; Q891-R895 WeakPolarHBondContact O-CB 3.42Å; Q891-R895 PolarHBondContact O-N 3.07Å
892	F	84.5	Confident	79.9	Confident	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-59.6	-49.9	174.8	174.7	-107.8	0	0	0	111.8	W826 W829 A830 L833 L834 I877 L881 I886 S888 K889 L890 H894 R895 L896	W826-F892 HydrophobicContact CZ3-CB 4.09Å; W829-F892 AromaticContact CZ3-CD1 3.82Å; W829-F892 HydrophobicContact CZ3-CD1 3.82Å; W829-F892 AromaticContact CZ3-CE1 3.95Å; W829-F892 HydrophobicContact CZ3-CE1 3.95Å; A830-F892 HydrophobicContact CB-CD1 3.97Å; A830-F892 HydrophobicContact CB-CD2 4.05Å; A830-F892 HydrophobicContact CB-CE1 3.72Å; A830-F892 HydrophobicContact CB-CE2 3.84Å; A830-F892 HydrophobicContact CB-CG 4.11Å; A830-F892 HydrophobicContact CB-CZ 3.66Å; L833-F892 HydrophobicContact CD2-CE1 3.64Å; L833-F892 HydrophobicContact CD2-CZ 4.09Å; L834-F892 HydrophobicContact CD1-CE2 4.32Å; L834-F892 HydrophobicContact CG-CZ 4.31Å; I877-F892 HydrophobicContact CG2-CD2 4.17Å; I877-F892 HydrophobicContact CG2-CE2 3.71Å; L881-F892 HydrophobicContact CD1-CD2 4.38Å; L881-F892 HydrophobicContact CD1-CE2 4.04Å; L881-F892 HydrophobicContact CD2-CD2 4.14Å; I886-F892 HydrophobicContact CD1-CD2 4.42Å; I886-F892 HydrophobicContact CG2-CB 3.74Å; S888-F892 PolarHBondContact O-N 3.32Å; K889-F892 PolarHBondContact O-N 3.2Å; L890-F892 VanDerWaalsContact C-N 3.33Å; L890-F892 PolarHBondContact O-N 2.88Å; F892-H894 PolarHBondContact O-N 2.91Å; F892-R895 PolarHBondContact O-N 2.58Å; F892-L896 HydrophobicContact CE1-CD2 4.49Å; F892-L896 WeakPolarHBondContact O-CB 3.38Å; F892-L896 PolarHBondContact O-N 2.85Å
893	V	84	Confident	80.1	Confident	4 Å²	4	64.6 Å²	64.6	2%	0.024	32%	0.321	C	S	.	.	H	α-helix	trans	-62.1	-42.6	178.2	171.2	0	0	0	0	111.6	W829 K889 L890 R895 L896 L897 L928	W829-V893 HydrophobicContact CH2-CG2 4.12Å; W829-V893 HydrophobicContact CZ3-CG2 4.4Å; K889-V893 WeakPolarHBondContact O-CG2 3.33Å; K889-V893 PolarHBondContact O-N 3.01Å; L890-V893 PolarHBondContact O-N 3.38Å; V893-R895 PolarHBondContact O-N 3.12Å; V893-L896 PolarHBondContact O-N 3.48Å; V893-L897 HydrophobicContact CG1-CD1 3.74Å; V893-L897 HydrophobicContact CG1-CG 4.29Å; V893-L897 WeakPolarHBondContact O-CB 3.43Å; V893-L897 VanDerWaalsContact O-CG 3.25Å; V893-L897 WeakPolarHBondContact O-CG 3.34Å; V893-L897 PolarHBondContact O-N 3.16Å; V893-L928 HydrophobicContact CG1-CD2 4.18Å; V893-L928 HydrophobicContact CG2-CD2 3.74Å
894	H	81.3	Confident	80.6	Confident	113 Å²	113	61.4 Å²	61.4	52%	0.523	31%	0.306	S	S	.	.	H	α-helix	trans	-61.9	-42.2	174.7	-91.8	-102.8	0	0	0	112.7	L890 Q891 F892 S898	L890-H894 WeakPolarHBondContact O-CB 3.49Å; L890-H894 PolarHBondContact O-CD2 3.4Å; L890-H894 PolarHBondContact O-N 3.38Å; Q891-H894 PolarHBondContact O-N 3.45Å; F892-H894 PolarHBondContact O-N 2.91Å; H894-S898 WeakPolarHBondContact O-CB 3.47Å; H894-S898 PolarHBondContact O-N 3.18Å
895	R	81.8	Confident	80.7	Confident	110 Å²	110	59.5 Å²	59.5	42%	0.415	30%	0.298	S	S	.	.	H	α-helix	trans	-67	-43.9	178.7	-170.4	60.7	162.7	-167.9	-11	111.7	D880 I886 Q891 F892 V893 S898 I899	D880-R895 VanDerWaalsContact CG-NH2 3.3Å; D880-R895 IonicContact OD1-NH2 3.88Å; D880-R895 PolarHBondContact OD1-NH2 3.21Å; D880-R895 VanDerWaalsContact OD1-NH2 3.09Å; D880-R895 IonicContact OD2-CZ 2.7Å; D880-R895 IonicContact OD2-NE 2.71Å; D880-R895 PolarHBondContact OD2-NE 3.17Å; D880-R895 IonicContact OD2-NH2 2.75Å; D880-R895 PolarHBondContact OD2-NH2 3.3Å; I886-R895 HydrophobicContact CD1-CB 4.33Å; I886-R895 HydrophobicContact CD1-CG 4.25Å; Q891-R895 WeakPolarHBondContact O-CB 3.42Å; Q891-R895 PolarHBondContact O-N 3.07Å; F892-R895 PolarHBondContact O-N 2.58Å; V893-R895 PolarHBondContact O-N 3.12Å; R895-S898 PolarHBondContact O-N 2.91Å; R895-I899 HydrophobicContact CG-CD1 4.18Å; R895-I899 PolarHBondContact O-N 3.4Å; R895-I899 VanDerWaalsContact O-N 3.07Å
896	L	85	Confident	80.9	Confident	2 Å²	2	57.7 Å²	57.7	1%	0.01	29%	0.292	C	S	.	.	H	α-helix	trans	-58.8	-52.2	174.9	-177.6	67.3	0	0	0	111.6	L833 I877 F892 V893 S898 I899 L900 W924	L833-L896 HydrophobicContact CD2-CD2 3.72Å; I877-L896 HydrophobicContact CD1-CB 4.37Å; I877-L896 HydrophobicContact CD1-CD1 3.47Å; I877-L896 VanDerWaalsContact CD1-CD1 3.47Å; F892-L896 HydrophobicContact CE1-CD2 4.49Å; F892-L896 WeakPolarHBondContact O-CB 3.38Å; F892-L896 PolarHBondContact O-N 2.85Å; V893-L896 PolarHBondContact O-N 3.48Å; L896-S898 VanDerWaalsContact C-N 3.31Å; L896-S898 PolarHBondContact O-N 3.45Å; L896-I899 PolarHBondContact O-N 2.91Å; L896-L900 HydrophobicContact CG-CD1 4.26Å; L896-L900 WeakPolarHBondContact O-CG 3.44Å; L896-L900 PolarHBondContact O-N 3.14Å; L896-W924 HydrophobicContact CD1-CE3 4.22Å; L896-W924 HydrophobicContact CD1-CH2 3.92Å; L896-W924 HydrophobicContact CD1-CZ3 3.65Å; L896-W924 HydrophobicContact CD2-CE3 4.32Å; L896-W924 HydrophobicContact CG-CZ3 4.37Å
897	L	86	Confident	80.9	Confident	24 Å²	24	61.1 Å²	61.1	13%	0.126	30%	0.304	C	S	.	.	H	α-helix	trans	-63.2	-36.3	177.5	-69.9	173.7	0	0	0	112.2	L783 V893 A901 Y921 L928	L783-L897 HydrophobicContact CD1-CD1 4.31Å; V893-L897 HydrophobicContact CG1-CD1 3.74Å; V893-L897 HydrophobicContact CG1-CG 4.29Å; V893-L897 WeakPolarHBondContact O-CB 3.43Å; V893-L897 VanDerWaalsContact O-CG 3.25Å; V893-L897 WeakPolarHBondContact O-CG 3.34Å; V893-L897 PolarHBondContact O-N 3.16Å; L897-A901 WeakPolarHBondContact O-CB 3.45Å; L897-A901 PolarHBondContact O-N 3.1Å; L897-Y921 HydrophobicContact CD2-CD2 4.06Å; L897-Y921 HydrophobicContact CD2-CE2 3.68Å; L897-L928 HydrophobicContact CD2-CD1 4.49Å
898	S	84.4	Confident	80.9	Confident	70 Å²	70	56.1 Å²	56.1	49%	0.49	29%	0.293	S	S	.	.	H	α-helix	trans	-63.3	-42.3	176.5	-175	0	0	0	0	112.3	H894 R895 L896 A901 H902	H894-S898 WeakPolarHBondContact O-CB 3.47Å; H894-S898 PolarHBondContact O-N 3.18Å; R895-S898 PolarHBondContact O-N 2.91Å; L896-S898 VanDerWaalsContact C-N 3.31Å; L896-S898 PolarHBondContact O-N 3.45Å; S898-A901 PolarHBondContact O-N 3.28Å; S898-H902 VanDerWaalsContact O-CB 3.22Å; S898-H902 WeakPolarHBondContact O-CB 3.46Å; S898-H902 PolarHBondContact O-N 3.05Å
899	I	82.6	Confident	80.6	Confident	26 Å²	26	58.1 Å²	58.1	13%	0.133	31%	0.307	C	S	.	.	H	α-helix	trans	-72.2	-39.4	179.4	-71.1	161.5	0	0	0	111.6	P876 I877 R895 L896 H902 T903	P876-I899 HydrophobicContact CB-CD1 4.05Å; I877-I899 HydrophobicContact CD1-CD1 3.95Å; I877-I899 HydrophobicContact CG1-CD1 3.42Å; I877-I899 VanDerWaalsContact CG1-CD1 3.42Å; R895-I899 HydrophobicContact CG-CD1 4.18Å; R895-I899 PolarHBondContact O-N 3.4Å; R895-I899 VanDerWaalsContact O-N 3.07Å; L896-I899 PolarHBondContact O-N 2.91Å; I899-H902 PolarHBondContact O-N 3.42Å; I899-T903 WeakPolarHBondContact O-CB 3.45Å; I899-T903 VanDerWaalsContact O-CG2 3.26Å; I899-T903 WeakPolarHBondContact O-CG2 3.33Å; I899-T903 PolarHBondContact O-N 3.29Å; I899-T903 PolarHBondContact O-OG1 3.12Å
900	L	84.4	Confident	80.1	Confident	14 Å²	14	61.6 Å²	61.6	7%	0.073	33%	0.328	C	S	.	.	H	α-helix	trans	-61.8	-47	171.3	-69.8	169.5	0	0	0	111.5	L896 T903 V904 A917 Y921 W924	L896-L900 HydrophobicContact CG-CD1 4.26Å; L896-L900 WeakPolarHBondContact O-CG 3.44Å; L896-L900 PolarHBondContact O-N 3.14Å; L900-T903 PolarHBondContact O-N 3.46Å; L900-T903 PolarHBondContact O-OG1 3.32Å; L900-T903 VanDerWaalsContact O-OG1 3.04Å; L900-V904 WeakPolarHBondContact O-CB 3.42Å; L900-V904 WeakPolarHBondContact O-CG2 3.38Å; L900-V904 PolarHBondContact O-N 2.87Å; L900-A917 HydrophobicContact CD2-CB 4.06Å; L900-Y921 HydrophobicContact CD1-CD2 4.22Å; L900-W924 HydrophobicContact CD1-CE3 3.99Å; L900-W924 HydrophobicContact CD1-CZ3 3.97Å; L900-W924 HydrophobicContact CD2-CZ3 4.17Å; L900-W924 HydrophobicContact CG-CZ3 4.45Å
901	A	84.2	Confident	80.1	Confident	22 Å²	22	59.6 Å²	59.6	18%	0.182	32%	0.32	C	S	.	.	H	α-helix	trans	-61.7	-46.5	175.8	0	0	0	0	0	111.5	L897 S898 T903 V904 M905	L897-A901 WeakPolarHBondContact O-CB 3.45Å; L897-A901 PolarHBondContact O-N 3.1Å; S898-A901 PolarHBondContact O-N 3.28Å; A901-T903 VanDerWaalsContact C-N 3.31Å; A901-T903 PolarHBondContact O-N 3.45Å; A901-V904 PolarHBondContact O-N 3.08Å; A901-M905 HydrophobicContact CB-CE 4.14Å; A901-M905 VanDerWaalsContact O-CB 3.28Å; A901-M905 WeakPolarHBondContact O-CB 3.05Å; A901-M905 WeakPolarHBondContact O-CG 3.48Å; A901-M905 PolarHBondContact O-N 3.12Å
902	H	80.9	Confident	79.8	Confident	106 Å²	106	56.4 Å²	56.4	49%	0.491	31%	0.306	S	S	.	.	H	α-helix	trans	-58.6	-40.8	178.3	177.3	-111.9	0	0	0	112.3	S898 I899 M905 T906	S898-H902 VanDerWaalsContact O-CB 3.22Å; S898-H902 WeakPolarHBondContact O-CB 3.46Å; S898-H902 PolarHBondContact O-N 3.05Å; I899-H902 PolarHBondContact O-N 3.42Å; H902-M905 PolarHBondContact O-N 2.91Å; H902-T906 WeakPolarHBondContact NE2-CG2 3.42Å; H902-T906 WeakPolarHBondContact O-CB 3.22Å; H902-T906 WeakPolarHBondContact O-CG2 3.27Å; H902-T906 PolarHBondContact O-N 3.33Å; H902-T906 PolarHBondContact O-OG1 2.86Å
903	T	79.2	Confident	79.4	Confident	13 Å²	13	58.6 Å²	58.6	8%	0.08	31%	0.314	C	S	.	.	H	α-helix	trans	-77.3	-31.5	-178.4	54.1	0	0	0	0	112.8	L873 I899 L900 A901 R907	L873-T903 HydrophobicContact CD2-CG2 3.29Å; I899-T903 WeakPolarHBondContact O-CB 3.45Å; I899-T903 VanDerWaalsContact O-CG2 3.26Å; I899-T903 WeakPolarHBondContact O-CG2 3.33Å; I899-T903 PolarHBondContact O-N 3.29Å; I899-T903 PolarHBondContact O-OG1 3.12Å; L900-T903 PolarHBondContact O-N 3.46Å; L900-T903 PolarHBondContact O-OG1 3.32Å; L900-T903 VanDerWaalsContact O-OG1 3.04Å; A901-T903 VanDerWaalsContact C-N 3.31Å; A901-T903 PolarHBondContact O-N 3.45Å; T903-R907 WeakPolarHBondContact O-CB 3.37Å; T903-R907 WeakPolarHBondContact O-CG 3.43Å; T903-R907 PolarHBondContact O-N 3.27Å
904	V	81.9	Confident	79.2	Confident	34 Å²	34	59 Å²	59	21%	0.206	32%	0.316	C	S	.	.	H	α-helix	trans	-71.7	-31.8	168.7	172.9	0	0	0	0	112.3	L785 L900 A901 N914 A917 M918	L785-V904 HydrophobicContact CD1-CG1 4.41Å; L900-V904 WeakPolarHBondContact O-CB 3.42Å; L900-V904 WeakPolarHBondContact O-CG2 3.38Å; L900-V904 PolarHBondContact O-N 2.87Å; A901-V904 PolarHBondContact O-N 3.08Å; V904-N914 PolarHBondContact O-ND2 2.8Å; V904-N914 VanDerWaalsContact O-ND2 3.12Å; V904-A917 HydrophobicContact CG2-CB 3.99Å; V904-M918 HydrophobicContact CG1-SD 4.23Å; V904-M918 HydrophobicContact CG2-CG 4.09Å; V904-M918 HydrophobicContact CG2-SD 3.93Å
905	M	76.1	Confident	79	Confident	114 Å²	114	55 Å²	55	56%	0.562	30%	0.299	S	S	*	.	H	α-helix	trans	-79	-40.5	177.9	-74.6	-172.3	-64.6	0	0	113.6	L792 A901 H902	L792-M905 HydrophobicContact CD1-CG 3.95Å; L792-M905 HydrophobicContact CD1-SD 4.03Å; A901-M905 HydrophobicContact CB-CE 4.14Å; A901-M905 VanDerWaalsContact O-CB 3.28Å; A901-M905 WeakPolarHBondContact O-CB 3.05Å; A901-M905 WeakPolarHBondContact O-CG 3.48Å; A901-M905 PolarHBondContact O-N 3.12Å; H902-M905 PolarHBondContact O-N 2.91Å
906	T	77.3	Confident	78.8	Confident	76 Å²	76	49.8 Å²	49.8	47%	0.466	28%	0.279	S	S	.	.	H	α-helix	trans	-81.6	-21.3	-176	51.6	0	0	0	0	114.3	H902	H902-T906 WeakPolarHBondContact NE2-CG2 3.42Å; H902-T906 WeakPolarHBondContact O-CB 3.22Å; H902-T906 WeakPolarHBondContact O-CG2 3.27Å; H902-T906 PolarHBondContact O-N 3.33Å; H902-T906 PolarHBondContact O-OG1 2.86Å
907	R	77.1	Confident	78.7	Confident	87 Å²	87	49.7 Å²	49.7	33%	0.328	28%	0.279	S	S	.	.	S	Bend	trans	-117.5	133.7	-175.1	-49.2	-59.3	-172	163.3	5.2	110.5	T903 T911 N914	T903-R907 WeakPolarHBondContact O-CB 3.37Å; T903-R907 WeakPolarHBondContact O-CG 3.43Å; T903-R907 PolarHBondContact O-N 3.27Å; R907-T911 WeakPolarHBondContact CB-OG1 3.48Å; R907-N914 HydrophobicContact CB-CB 4.39Å; R907-N914 PolarHBondContact O-ND2 3.11Å
908	A	74.8	Confident	78.4	Confident	59 Å²	59	52.8 Å²	52.8	49%	0.488	29%	0.293	S	S	.	.			trans	-62	151.8	-178.8	0	0	0	0	0	112.4	N910 T911 N914	A908-N910 VanDerWaalsContact CB-OD1 3.22Å; A908-N910 WeakPolarHBondContact CB-OD1 3.1Å; A908-N910 PolarHBondContact O-N 3.29Å; A908-T911 HydrophobicContact CB-CG2 4.34Å; A908-T911 WeakPolarHBondContact O-CB 3.41Å; A908-T911 WeakPolarHBondContact O-CG2 3.1Å; A908-T911 PolarHBondContact O-N 3.5Å; A908-T911 PolarHBondContact O-OG1 3.16Å; A908-N914 WeakPolarHBondContact O-CB 3.3Å
909	S	72	Confident	77.9	Confident	87 Å²	87	51.8 Å²	51.8	61%	0.608	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	4.6	-172.9	60.2	0	0	0	0	115.6
910	N	67.8	Low	77.8	Confident	130 Å²	130	50.7 Å²	50.7	70%	0.695	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.4	-1	170.4	66.8	-36.8	0	0	0	112.8	A908	A908-N910 VanDerWaalsContact CB-OD1 3.22Å; A908-N910 WeakPolarHBondContact CB-OD1 3.1Å; A908-N910 PolarHBondContact O-N 3.29Å
911	T	77.4	Confident	77.8	Confident	45 Å²	45	52.4 Å²	52.4	28%	0.276	28%	0.281	S	S	.	.	S	Bend	trans	-87.4	144.4	179.6	64.2	0	0	0	0	111.5	R907 A908 R913 N914 L915	R907-T911 WeakPolarHBondContact CB-OG1 3.48Å; A908-T911 HydrophobicContact CB-CG2 4.34Å; A908-T911 WeakPolarHBondContact O-CB 3.41Å; A908-T911 WeakPolarHBondContact O-CG2 3.1Å; A908-T911 PolarHBondContact O-N 3.5Å; A908-T911 PolarHBondContact O-OG1 3.16Å; T911-R913 VanDerWaalsContact C-N 3.31Å; T911-R913 PolarHBondContact O-N 2.74Å; T911-N914 PolarHBondContact O-N 3.36Å; T911-N914 VanDerWaalsContact O-N 3.15Å; T911-N914 WeakPolarHBondContact OG1-CB 3.27Å; T911-N914 PolarHBondContact OG1-N 3.16Å; T911-L915 PolarHBondContact O-N 3.46Å; T911-L915 VanDerWaalsContact O-N 3.13Å
912	I	74.1	Confident	77.6	Confident	48 Å²	48	56.3 Å²	56.3	25%	0.246	30%	0.296	C	S	.	.	H	α-helix	trans	-57	-44.8	179.4	-60.5	147	0	0	0	110.7	F857 T861 L869 N914 L915 V916	F857-I912 HydrophobicContact CE1-CG2 4.26Å; T861-I912 HydrophobicContact CG2-CD1 4.03Å; T861-I912 HydrophobicContact CG2-CG2 4.19Å; T861-I912 VanDerWaalsContact OG1-CD1 3.28Å; T861-I912 WeakPolarHBondContact OG1-CD1 3.35Å; L869-I912 HydrophobicContact CD1-CB 4.36Å; L869-I912 HydrophobicContact CD1-CG2 3.81Å; I912-N914 VanDerWaalsContact C-N 3.31Å; I912-N914 PolarHBondContact O-N 3.08Å; I912-L915 PolarHBondContact O-N 2.91Å; I912-L915 VanDerWaalsContact O-N 3.12Å; I912-V916 HydrophobicContact CG2-CG2 4.19Å; I912-V916 WeakPolarHBondContact O-CG2 3.47Å; I912-V916 PolarHBondContact O-N 3.25Å
913	R	75.3	Confident	77.3	Confident	46 Å²	46	54.7 Å²	54.7	17%	0.174	29%	0.288	C	S	.	.	H	α-helix	trans	-59.8	-36.1	178.7	-161.3	-174	-76.8	104.5	-16.9	113.1	L869 E872 L873 T911 A917	L869-R913 HydrophobicContact CD2-CB 4.13Å; L869-R913 HydrophobicContact CD2-CG 4.13Å; L869-R913 VanDerWaalsContact CD2-CZ 3.47Å; E872-R913 IonicContact OE1-CZ 3.13Å; E872-R913 VanDerWaalsContact OE1-CZ 3.32Å; E872-R913 IonicContact OE1-NE 2.75Å; E872-R913 PolarHBondContact OE1-NE 3.38Å; E872-R913 IonicContact OE1-NH2 3.06Å; E872-R913 PolarHBondContact OE1-NH2 3.36Å; E872-R913 IonicContact OE2-CZ 2.86Å; E872-R913 IonicContact OE2-NE 2.67Å; E872-R913 PolarHBondContact OE2-NE 2.71Å; E872-R913 IonicContact OE2-NH2 3.81Å; E872-R913 PolarHBondContact OE2-NH2 3.24Å; L873-R913 HydrophobicContact CD1-CG 4.42Å; L873-R913 HydrophobicContact CD2-CG 4.29Å; T911-R913 VanDerWaalsContact C-N 3.31Å; T911-R913 PolarHBondContact O-N 2.74Å; R913-A917 WeakPolarHBondContact O-CB 3.44Å; R913-A917 PolarHBondContact O-N 3.26Å; R913-A917 VanDerWaalsContact O-N 3.11Å
914	N	80.9	Confident	77.4	Confident	12 Å²	12	54.2 Å²	54.2	6%	0.064	29%	0.285	C	S	.	.	H	α-helix	trans	-70	-43	174.8	-175.8	-65.2	0	0	0	111.2	V904 R907 A908 T911 I912 A917 M918	V904-N914 PolarHBondContact O-ND2 2.8Å; V904-N914 VanDerWaalsContact O-ND2 3.12Å; R907-N914 HydrophobicContact CB-CB 4.39Å; R907-N914 PolarHBondContact O-ND2 3.11Å; A908-N914 WeakPolarHBondContact O-CB 3.3Å; T911-N914 PolarHBondContact O-N 3.36Å; T911-N914 VanDerWaalsContact O-N 3.15Å; T911-N914 WeakPolarHBondContact OG1-CB 3.27Å; T911-N914 PolarHBondContact OG1-N 3.16Å; I912-N914 VanDerWaalsContact C-N 3.31Å; I912-N914 PolarHBondContact O-N 3.08Å; N914-A917 PolarHBondContact O-N 2.57Å; N914-M918 WeakPolarHBondContact O-CB 3.49Å; N914-M918 WeakPolarHBondContact O-CG 3.48Å; N914-M918 PolarHBondContact O-N 3.41Å
915	L	76.7	Confident	77.1	Confident	30 Å²	30	52.9 Å²	52.9	16%	0.157	28%	0.277	C	S	.	.	H	α-helix	trans	-63.2	-43.4	177	-62.9	171.9	0	0	0	112.2	R856 F857 T911 I912 M918 E919	R856-L915 HydrophobicContact CB-CD1 3.97Å; F857-L915 HydrophobicContact CE1-CB 4.29Å; F857-L915 HydrophobicContact CE2-CB 4.08Å; F857-L915 HydrophobicContact CE2-CD1 4.48Å; F857-L915 HydrophobicContact CZ-CB 3.57Å; F857-L915 HydrophobicContact CZ-CD1 4.4Å; T911-L915 PolarHBondContact O-N 3.46Å; T911-L915 VanDerWaalsContact O-N 3.13Å; I912-L915 PolarHBondContact O-N 2.91Å; I912-L915 VanDerWaalsContact O-N 3.12Å; L915-M918 PolarHBondContact O-N 3.18Å; L915-E919 WeakPolarHBondContact O-CB 3.37Å; L915-E919 PolarHBondContact O-N 2.99Å
916	V	77.8	Confident	76.7	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.2	-44	176.9	171.9	0	0	0	0	111.4	F857 L866 V870 L873 I912 M918 E919 L920	F857-V916 HydrophobicContact CE1-CG2 3.98Å; F857-V916 HydrophobicContact CZ-CG2 4.21Å; L866-V916 HydrophobicContact CD2-CG2 3.74Å; V870-V916 HydrophobicContact CG2-CG1 3.86Å; L873-V916 HydrophobicContact CD1-CG1 4.15Å; I912-V916 HydrophobicContact CG2-CG2 4.19Å; I912-V916 WeakPolarHBondContact O-CG2 3.47Å; I912-V916 PolarHBondContact O-N 3.25Å; V916-M918 PolarHBondContact O-N 3.44Å; V916-E919 PolarHBondContact O-N 3.21Å; V916-L920 HydrophobicContact CG1-CD1 3.89Å; V916-L920 HydrophobicContact CG1-CG 4.37Å; V916-L920 WeakPolarHBondContact O-CB 3.42Å; V916-L920 WeakPolarHBondContact O-CG 3.49Å; V916-L920 PolarHBondContact O-N 3.32Å
917	A	82.6	Confident	76.2	Confident	1 Å²	1	53.7 Å²	53.7	1%	0.008	27%	0.274	C	S	.	.	H	α-helix	trans	-63.1	-40.1	176.2	0	0	0	0	0	112.5	L900 V904 R913 N914 Y921	L900-A917 HydrophobicContact CD2-CB 4.06Å; V904-A917 HydrophobicContact CG2-CB 3.99Å; R913-A917 WeakPolarHBondContact O-CB 3.44Å; R913-A917 PolarHBondContact O-N 3.26Å; R913-A917 VanDerWaalsContact O-N 3.11Å; N914-A917 PolarHBondContact O-N 2.57Å; A917-Y921 WeakPolarHBondContact O-CB 3.39Å; A917-Y921 PolarHBondContact O-N 3.31Å
918	M	79.8	Confident	75.8	Confident	88 Å²	88	50.4 Å²	50.4	43%	0.433	26%	0.263	S	S	.	.	H	α-helix	trans	-64.8	-40	175.3	-77	-61.1	-48.6	0	0	112.8	V904 N914 L915 V916 H922	V904-M918 HydrophobicContact CG1-SD 4.23Å; V904-M918 HydrophobicContact CG2-CG 4.09Å; V904-M918 HydrophobicContact CG2-SD 3.93Å; N914-M918 WeakPolarHBondContact O-CB 3.49Å; N914-M918 WeakPolarHBondContact O-CG 3.48Å; N914-M918 PolarHBondContact O-N 3.41Å; L915-M918 PolarHBondContact O-N 3.18Å; V916-M918 PolarHBondContact O-N 3.44Å; M918-H922 PolarHBondContact O-N 2.78Å
919	E	73.1	Confident	75	Confident	50 Å²	50	49.8 Å²	49.8	23%	0.234	25%	0.25	C	C	.	.	H	α-helix	trans	-73.4	-42.7	179.8	-167.7	61.9	-134.2	0	0	111.6	W844 L915 V916 Y921 H922 Q923	W844-E919 HydrophobicContact CH2-CB 3.9Å; W844-E919 HydrophobicContact CH2-CG 3.6Å; W844-E919 HydrophobicContact CZ2-CB 4.21Å; W844-E919 HydrophobicContact CZ2-CG 3.37Å; L915-E919 WeakPolarHBondContact O-CB 3.37Å; L915-E919 PolarHBondContact O-N 2.99Å; V916-E919 PolarHBondContact O-N 3.21Å; E919-Y921 VanDerWaalsContact C-N 3.31Å; E919-Y921 PolarHBondContact O-N 2.78Å; E919-H922 WeakPolarHBondContact O-CB 3.28Å; E919-H922 PolarHBondContact O-N 3Å; E919-H922 IonicContact OE1-CD2 2.88Å; E919-Q923 WeakPolarHBondContact O-CG 3.27Å; E919-Q923 PolarHBondContact O-N 2.8Å; E919-Q923 PolarHBondContact OE1-NE2 3.12Å; E919-Q923 VanDerWaalsContact OE1-NE2 3.08Å
920	L	80.3	Confident	74.1	Confident	3 Å²	3	50 Å²	50	2%	0.016	25%	0.248	C	C	.	.	H	α-helix	trans	-58.6	-42.4	171.9	-73.8	171.9	0	0	0	111.7	V841 V916 H922 Q923 W924	V841-L920 HydrophobicContact CG2-CD2 4.28Å; V916-L920 HydrophobicContact CG1-CD1 3.89Å; V916-L920 HydrophobicContact CG1-CG 4.37Å; V916-L920 WeakPolarHBondContact O-CB 3.42Å; V916-L920 WeakPolarHBondContact O-CG 3.49Å; V916-L920 PolarHBondContact O-N 3.32Å; L920-H922 VanDerWaalsContact C-N 3.33Å; L920-H922 PolarHBondContact O-N 3.44Å; L920-Q923 PolarHBondContact O-N 3.22Å; L920-W924 HydrophobicContact CB-CE3 4.04Å; L920-W924 HydrophobicContact CB-CH2 4.27Å; L920-W924 HydrophobicContact CB-CZ3 3.84Å; L920-W924 HydrophobicContact CD1-CH2 4.33Å; L920-W924 HydrophobicContact CD2-CH2 4.4Å; L920-W924 HydrophobicContact CD2-CZ2 4.38Å; L920-W924 WeakPolarHBondContact O-CB 3.47Å; L920-W924 PolarHBondContact O-N 3.4Å
921	Y	84.1	Confident	73	Confident	49 Å²	49	46.2 Å²	46.2	19%	0.192	23%	0.227	C	C	.	.	H	α-helix	trans	-61.2	-40.2	172.8	177.6	-109	0	0	0	112.3	L897 L900 A917 E919 S925	L897-Y921 HydrophobicContact CD2-CD2 4.06Å; L897-Y921 HydrophobicContact CD2-CE2 3.68Å; L900-Y921 HydrophobicContact CD1-CD2 4.22Å; A917-Y921 WeakPolarHBondContact O-CB 3.39Å; A917-Y921 PolarHBondContact O-N 3.31Å; E919-Y921 VanDerWaalsContact C-N 3.31Å; E919-Y921 PolarHBondContact O-N 2.78Å; Y921-S925 VanDerWaalsContact O-CB 3.28Å; Y921-S925 WeakPolarHBondContact O-CB 3.13Å; Y921-S925 PolarHBondContact O-N 3.05Å
922	H	81	Confident	71.6	Confident	104 Å²	104	45.9 Å²	45.9	48%	0.481	22%	0.224	S	C	.	.	H	α-helix	trans	-60.9	-50.1	177.7	-173.7	10.3	0	0	0	111.6	M918 E919 L920 S925	M918-H922 PolarHBondContact O-N 2.78Å; E919-H922 WeakPolarHBondContact O-CB 3.28Å; E919-H922 PolarHBondContact O-N 3Å; E919-H922 IonicContact OE1-CD2 2.88Å; L920-H922 VanDerWaalsContact C-N 3.33Å; L920-H922 PolarHBondContact O-N 3.44Å; H922-S925 WeakPolarHBondContact O-CB 3.14Å; H922-S925 PolarHBondContact O-N 2.78Å; H922-S925 PolarHBondContact O-OG 3.4Å
923	Q	74.9	Confident	69.7	Low	72 Å²	72	48.8 Å²	48.8	34%	0.336	25%	0.249	S	C	.	.	H	α-helix	trans	-66.3	-43.1	-178.6	-60.8	-66.5	-36	0	0	112.3	I840 E919 L920 S925	I840-Q923 HydrophobicContact CD1-CB 3.88Å; I840-Q923 HydrophobicContact CD1-CG 4.23Å; I840-Q923 HydrophobicContact CG2-CG 4.35Å; E919-Q923 WeakPolarHBondContact O-CG 3.27Å; E919-Q923 PolarHBondContact O-N 2.8Å; E919-Q923 PolarHBondContact OE1-NE2 3.12Å; E919-Q923 VanDerWaalsContact OE1-NE2 3.08Å; L920-Q923 PolarHBondContact O-N 3.22Å; Q923-S925 VanDerWaalsContact C-N 3.27Å; Q923-S925 PolarHBondContact O-N 2.68Å
924	W	81.6	Confident	67.9	Low	4 Å²	4	53.8 Å²	53.8	2%	0.015	27%	0.274	C	S	.	.	H	α-helix	trans	-71.9	-18.2	175.3	-70	-37.7	0	0	0	113.4	L833 L874 L896 L900 L920 E926 Q927 L928	L833-W924 HydrophobicContact CD1-CB 4.48Å; L833-W924 HydrophobicContact CD1-CG 4.03Å; L833-W924 HydrophobicContact CG-CG 4.32Å; L833-W924 PolarHBondContact O-NE1 3.48Å; L874-W924 HydrophobicContact CD2-CH2 3.96Å; L896-W924 HydrophobicContact CD1-CE3 4.22Å; L896-W924 HydrophobicContact CD1-CH2 3.92Å; L896-W924 HydrophobicContact CD1-CZ3 3.65Å; L896-W924 HydrophobicContact CD2-CE3 4.32Å; L896-W924 HydrophobicContact CG-CZ3 4.37Å; L900-W924 HydrophobicContact CD1-CE3 3.99Å; L900-W924 HydrophobicContact CD1-CZ3 3.97Å; L900-W924 HydrophobicContact CD2-CZ3 4.17Å; L900-W924 HydrophobicContact CG-CZ3 4.45Å; L920-W924 HydrophobicContact CB-CE3 4.04Å; L920-W924 HydrophobicContact CB-CH2 4.27Å; L920-W924 HydrophobicContact CB-CZ3 3.84Å; L920-W924 HydrophobicContact CD1-CH2 4.33Å; L920-W924 HydrophobicContact CD2-CH2 4.4Å; L920-W924 HydrophobicContact CD2-CZ2 4.38Å; L920-W924 WeakPolarHBondContact O-CB 3.47Å; L920-W924 PolarHBondContact O-N 3.4Å; W924-E926 VanDerWaalsContact C-N 3.28Å; W924-E926 PolarHBondContact O-N 3.15Å; W924-Q927 PolarHBondContact O-N 3.02Å; W924-Q927 VanDerWaalsContact O-N 3.08Å; W924-L928 HydrophobicContact CB-CD1 4.12Å; W924-L928 HydrophobicContact CB-CG 4.44Å; W924-L928 WeakPolarHBondContact O-CB 3.44Å; W924-L928 VanDerWaalsContact O-CG 3.3Å; W924-L928 WeakPolarHBondContact O-CG 3.36Å; W924-L928 PolarHBondContact O-N 2.78Å
925	S	74.4	Confident	65.7	Low	5 Å²	5	57.8 Å²	57.8	4%	0.035	30%	0.3	C	S	.	.	H	α-helix	trans	-58.2	-38.3	-172.6	74.6	0	0	0	0	112.9	Y921 H922 Q923 L928 Q929	Y921-S925 VanDerWaalsContact O-CB 3.28Å; Y921-S925 WeakPolarHBondContact O-CB 3.13Å; Y921-S925 PolarHBondContact O-N 3.05Å; H922-S925 WeakPolarHBondContact O-CB 3.14Å; H922-S925 PolarHBondContact O-N 2.78Å; H922-S925 PolarHBondContact O-OG 3.4Å; Q923-S925 VanDerWaalsContact C-N 3.27Å; Q923-S925 PolarHBondContact O-N 2.68Å; S925-L928 PolarHBondContact O-N 3.18Å; S925-Q929 VanDerWaalsContact C-NE2 3.25Å; S925-Q929 WeakPolarHBondContact O-CB 3.46Å; S925-Q929 VanDerWaalsContact O-CG 3.24Å; S925-Q929 WeakPolarHBondContact O-CG 3.44Å; S925-Q929 PolarHBondContact O-N 3.31Å; S925-Q929 PolarHBondContact O-NE2 3.28Å
926	E	68.9	Low	63.5	Low	134 Å²	134	62.1 Å²	62.1	63%	0.626	32%	0.324	S	S	*	.	H	α-helix	trans	-70.4	-38.7	177.6	-58.3	-172.8	157.5	0	0	112.3	W924 L928 Q929 T930	W924-E926 VanDerWaalsContact C-N 3.28Å; W924-E926 PolarHBondContact O-N 3.15Å; E926-L928 VanDerWaalsContact C-N 3.3Å; E926-L928 PolarHBondContact O-N 3.2Å; E926-Q929 PolarHBondContact O-N 3.43Å; E926-T930 WeakPolarHBondContact O-CG2 3.5Å; E926-T930 PolarHBondContact O-N 3.24Å; E926-T930 PolarHBondContact O-OG1 3.3Å
927	Q	65.6	Low	61.2	Low	74 Å²	74	71.8 Å²	71.8	35%	0.346	37%	0.366	S	S	.	.	H	α-helix	trans	-72.1	-23.7	176.7	-64.7	-172.7	-20.8	0	0	112.6	L833 N836 W924 T930 N931	L833-Q927 HydrophobicContact CD1-CB 3.89Å; L833-Q927 VanDerWaalsContact CD1-OE1 3.28Å; N836-Q927 PolarHBondContact ND2-NE2 2.99Å; N836-Q927 PolarHBondContact ND2-OE1 3.48Å; N836-Q927 VanDerWaalsContact ND2-OE1 3.08Å; W924-Q927 PolarHBondContact O-N 3.02Å; W924-Q927 VanDerWaalsContact O-N 3.08Å; Q927-T930 PolarHBondContact O-OG1 2.67Å; Q927-N931 WeakPolarHBondContact O-CB 3.35Å
928	L	68.6	Low	58.7	Low	17 Å²	17	76.2 Å²	76.2	9%	0.089	40%	0.397	C	S	.	.	H	α-helix	trans	-82.6	-31.5	172.8	-67.7	170.2	0	0	0	112.9	W829 L833 V893 L897 W924 S925 E926	W829-L928 HydrophobicContact CH2-CD2 4.31Å; L833-L928 HydrophobicContact CD2-CD2 4.33Å; V893-L928 HydrophobicContact CG1-CD2 4.18Å; V893-L928 HydrophobicContact CG2-CD2 3.74Å; L897-L928 HydrophobicContact CD2-CD1 4.49Å; W924-L928 HydrophobicContact CB-CD1 4.12Å; W924-L928 HydrophobicContact CB-CG 4.44Å; W924-L928 WeakPolarHBondContact O-CB 3.44Å; W924-L928 VanDerWaalsContact O-CG 3.3Å; W924-L928 WeakPolarHBondContact O-CG 3.36Å; W924-L928 PolarHBondContact O-N 2.78Å; S925-L928 PolarHBondContact O-N 3.18Å; E926-L928 VanDerWaalsContact C-N 3.3Å; E926-L928 PolarHBondContact O-N 3.2Å
929	Q	58.8	Low	56.4	Low	46 Å²	46	77.1 Å²	77.1	22%	0.215	41%	0.412	C	S	.	.	H	α-helix	trans	-77	-27	-179.9	-78.3	153.7	50.3	0	0	113.7	S925 E926	S925-Q929 VanDerWaalsContact C-NE2 3.25Å; S925-Q929 WeakPolarHBondContact O-CB 3.46Å; S925-Q929 VanDerWaalsContact O-CG 3.24Å; S925-Q929 WeakPolarHBondContact O-CG 3.44Å; S925-Q929 PolarHBondContact O-N 3.31Å; S925-Q929 PolarHBondContact O-NE2 3.28Å; E926-Q929 PolarHBondContact O-N 3.43Å
930	T	52.1	Low	54.4	Low	93 Å²	93	80.6 Å²	80.6	57%	0.571	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-0.7	-173.5	44	0	0	0	0	114.9	E926 Q927	E926-T930 WeakPolarHBondContact O-CG2 3.5Å; E926-T930 PolarHBondContact O-N 3.24Å; E926-T930 PolarHBondContact O-OG1 3.3Å; Q927-T930 PolarHBondContact O-OG1 2.67Å
931	N	44.9	Very low	51.9	Low	49 Å²	49	85.7 Å²	85.7	26%	0.262	47%	0.47	S	S	.	.			trans	-138.3	6.5	-152.3	-104.1	-85.7	0	0	0	115.9	W829 K889 Q927 S933	W829-N931 HydrophobicContact CZ2-CB 4.01Å; W829-N931 PolarHBondContact NE1-OD1 3.09Å; K889-N931 WeakPolarHBondContact CE-O 3.35Å; K889-N931 PolarHBondContact NZ-O 2.9Å; K889-N931 PolarHBondContact NZ-OD1 2.63Å; Q927-N931 WeakPolarHBondContact O-CB 3.35Å; N931-S933 PolarHBondContact O-N 2.77Å
932	L	48.1	Very low	49.3	Very low	38 Å²	38	88.1 Å²	88.1	20%	0.199	49%	0.494	C	S	.	.			trans	-99.2	63.6	-177.2	-67.3	172.5	0	0	0	111.9	L781	L781-L932 HydrophobicContact CB-CD1 4.34Å; L781-L932 HydrophobicContact CD1-CD1 3.66Å; L781-L932 HydrophobicContact CG-CD1 3.91Å
933	S	35.3	Very low	46.7	Very low	110 Å²	110	88.9 Å²	88.9	77%	0.769	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-75.7	118.2	163	-46.2	0	0	0	0	108.9	N931	N931-S933 PolarHBondContact O-N 2.77Å
934	E	35.9	Very low	44.7	Very low	150 Å²	150	95.3 Å²	95.3	70%	0.701	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-74.7	147.3	164.7	-65.5	-162.1	134	0	0	109.9
935	P	35.2	Very low	42.1	Very low	96 Å²	96	103.2 Å²	103.2	62%	0.623	57%	0.574	S	S	*	*	P	Polyproline II helix	trans	-75.9	135.4	171.3	31.3	-33.3	0	0	0	110.7	F937	P935-F937 HydrophobicContact CG-CD2 4.23Å; P935-F937 HydrophobicContact CG-CE2 3.77Å; P935-F937 PolarHBondContact O-N 3.46Å
936	D	30.4	Very low	40.1	Very low	122 Å²	122	108 Å²	108	65%	0.652	61%	0.608	S	S	*	*			trans	-63.6	94.2	179	-74.3	-62.4	0	0	0	112.7	S938	D936-S938 PolarHBondContact O-N 3.05Å
937	F	30.4	Very low	38.3	Very low	202 Å²	202	111 Å²	111	89%	0.886	62%	0.619	S	S	*	*			trans	-77.6	40.9	165.9	-76	-72.5	0	0	0	112.4	P935	P935-F937 HydrophobicContact CG-CD2 4.23Å; P935-F937 HydrophobicContact CG-CE2 3.77Å; P935-F937 PolarHBondContact O-N 3.46Å
938	S	29.1	Very low	36.8	Very low	95 Å²	95	113.6 Å²	113.6	66%	0.664	64%	0.64	S	S	*	*			trans	-113.5	48.8	173.8	66.6	0	0	0	0	111.6	D936	D936-S938 PolarHBondContact O-N 3.05Å
939	S	32.6	Very low	35.2	Very low	106 Å²	106	118.2 Å²	118.2	74%	0.741	67%	0.671	S	S	*	*			trans	-141	101.8	171.6	-79.4	0	0	0	0	110.4
940	T	30.4	Very low	34.1	Very low	123 Å²	123	121.8 Å²	121.8	76%	0.755	70%	0.698	S	S	*	*			trans	-54.7	127.7	171.4	-47.7	0	0	0	0	109.4	C942	T940-C942 VanDerWaalsContact C-N 3.34Å; T940-C942 PolarHBondContact O-N 2.87Å
941	P	28.5	Very low	33.1	Very low	110 Å²	110	122.5 Å²	122.5	71%	0.714	71%	0.707	S	S	*	*			trans	-68.5	94.2	175.6	28	-33.5	0	0	0	109.2	C943	P941-C943 PolarHBondContact O-N 3.26Å
942	C	28	Very low	32.6	Very low	101 Å²	101	132.1 Å²	132.1	68%	0.682	74%	0.739	S	S	*	*			trans	-62.1	106.7	174.8	-71.2	0	0	0	0	108.8	T940 Y944	T940-C942 VanDerWaalsContact C-N 3.34Å; T940-C942 PolarHBondContact O-N 2.87Å; C942-Y944 HydrophobicContact CB-CD2 4.49Å; C942-Y944 PolarHBondContact O-N 3.44Å
943	C	27	Very low	31.6	Very low	120 Å²	120	135.4 Å²	135.4	81%	0.811	77%	0.766	S	S	*	*			trans	-67.9	79.8	-179.2	-59.1	0	0	0	0	111.3	P941 N945	P941-C943 PolarHBondContact O-N 3.26Å; C943-N945 PolarHBondContact O-N 3.47Å; C943-N945 VanDerWaalsContact O-N 3.08Å
944	Y	33	Very low	31.5	Very low	207 Å²	207	137 Å²	137	81%	0.812	77%	0.77	S	S	*	*			trans	-68.5	106.5	173.3	-105.1	-83.4	0	0	0	110.2	C942 S946	C942-Y944 HydrophobicContact CB-CD2 4.49Å; C942-Y944 PolarHBondContact O-N 3.44Å; Y944-S946 PolarHBondContact O-N 3.17Å
945	N	26.9	Very low	31.3	Very low	170 Å²	170	138 Å²	138	91%	0.909	78%	0.775	S	S	*	*			trans	-65.6	94.2	169.4	-89.3	-49.7	0	0	0	110.3	C943	C943-N945 PolarHBondContact O-N 3.47Å; C943-N945 VanDerWaalsContact O-N 3.08Å
946	S	33.6	Very low	31.3	Very low	105 Å²	105	141.3 Å²	141.3	73%	0.734	79%	0.786	S	S	*	*			trans	-130.6	133.8	161.4	56.5	0	0	0	0	110.4	Y944	Y944-S946 PolarHBondContact O-N 3.17Å
947	K	29.7	Very low	31.3	Very low	197 Å²	197	144.3 Å²	144.3	86%	0.857	80%	0.796	S	S	*	*			trans	-73.2	167.2	-175.8	-65	170	178.5	172.8	0	111.9
948	T	33.9	Very low	31.7	Very low	128 Å²	128	141.2 Å²	141.2	79%	0.785	79%	0.789	S	S	*	*			trans	85.7	106.8	161.7	-23.2	0	0	0	0	115.4
949	P	35.3	Very low	32	Very low	115 Å²	115	143.1 Å²	143.1	75%	0.747	79%	0.791	S	S	*	*			trans	-79.3	139.6	163.5	33	-31.7	0	0	0	110.3	S951	P949-S951 PolarHBondContact O-N 3.48Å
950	P	36.3	Very low	32.1	Very low	121 Å²	121	142.1 Å²	142.1	79%	0.786	78%	0.784	S	S	*	*			trans	-79	115.3	170.3	30.9	-31.3	0	0	0	110.2
951	S	31.4	Very low	32.3	Very low	107 Å²	107	143.3 Å²	143.3	75%	0.748	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-75.3	125.2	169	52.9	0	0	0	0	110.5	P949	P949-S951 PolarHBondContact O-N 3.48Å
952	W	33	Very low	32.6	Very low	251 Å²	251	144.2 Å²	144.2	95%	0.951	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-86	124.8	161.3	-82.5	-2	0	0	0	109.9
953	S	28.5	Very low	33	Very low	107 Å²	107	145.4 Å²	145.4	75%	0.748	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-74.2	131.7	-178.6	-49.2	0	0	0	0	111.5
954	V	33.4	Very low	33.2	Very low	144 Å²	144	145 Å²	145	87%	0.873	79%	0.786	S	S	*	*			trans	-127	119.2	146.8	178.4	0	0	0	0	105.9
955	E	30.2	Very low	33.3	Very low	170 Å²	170	146.9 Å²	146.9	79%	0.794	79%	0.791	S	S	*	*			trans	-76.5	144.9	178.4	-61.2	174.8	161.5	0	0	110.4
956	I	35.1	Very low	33.7	Very low	167 Å²	167	146 Å²	146	86%	0.856	79%	0.787	S	S	*	*			trans	179.7	106	135.8	-89.6	149.7	0	0	0	105.8
957	E	31.4	Very low	34.2	Very low	184 Å²	184	146.6 Å²	146.6	86%	0.86	79%	0.788	S	S	*	*			trans	-87.9	141.3	161.4	-64.4	-173.5	120.1	0	0	108.5
958	D	38.6	Very low	34.9	Very low	137 Å²	137	143.3 Å²	143.3	73%	0.733	79%	0.787	S	S	*	*				-173.4	127.3	118.6	-116.8	-25.3	0	0	0	112.9
959	N	34.4	Very low	34.8	Very low	135 Å²	135	143.3 Å²	143.3	72%	0.722	79%	0.787	S	S	*	*			trans	61.5	144.4	151.6	-63	-57.8	0	0	0	121.3
960	S	35.8	Very low	34.9	Very low	85 Å²	85	146.2 Å²	146.2	59%	0.594	80%	0.795	S	S	*	*			cis	-171.3	157.4	-15.9	54.8	0	0	0	0	111.4
961	L	35.4	Very low	34.6	Very low	148 Å²	148	146.4 Å²	146.4	78%	0.775	79%	0.794	S	S	*	*			trans	67.2	152	166.1	-50.5	161.2	0	0	0	115.3
962	N	34.8	Very low	34.6	Very low	130 Å²	130	149.3 Å²	149.3	70%	0.695	80%	0.8	S	S	*	*			cis	-170.2	162.2	-10.2	-105.2	-2.4	0	0	0	106.8
963	T	35.7	Very low	34.6	Very low	125 Å²	125	141 Å²	141	77%	0.767	79%	0.785	S	S	*	*			cis	-159	177.4	2.3	2.7	0	0	0	0	110.5
964	C	31.1	Very low	34.9	Very low	111 Å²	111	141.5 Å²	141.5	75%	0.75	79%	0.789	S	S	*	*			trans	-80.2	157.3	-172.1	-35.9	0	0	0	0	117.6
965	R	35.9	Very low	35	Very low	247 Å²	247	139.2 Å²	139.2	93%	0.932	78%	0.779	S	S	*	*				-178.3	157.3	111.9	-104	-177.5	172.9	-179.8	-1.7	115.9
966	D	34.7	Very low	35.2	Very low	153 Å²	153	135.8 Å²	135.8	82%	0.818	77%	0.774	S	S	*	*			trans	-107.1	168.8	-167.3	-70.9	-70.9	0	0	0	116.2
967	P	43.4	Very low	35.2	Very low	117 Å²	117	137.1 Å²	137.1	76%	0.76	77%	0.774	S	S	*	*			trans	-105.7	-179.6	-173.8	41.7	-36.4	0	0	0	115.3
968	P	44.2	Very low	35.2	Very low	128 Å²	128	134.9 Å²	134.9	83%	0.831	77%	0.768	S	S	*	*			trans	-122.4	164.4	170	39.6	-28	0	0	0	115.9
969	T	32.3	Very low	34.9	Very low	128 Å²	128	133.3 Å²	133.3	79%	0.785	77%	0.768	S	S	*	*			trans	-121.7	148.4	-179.8	-53	0	0	0	0	111.7
970	L	37.1	Very low	34.9	Very low	176 Å²	176	132.6 Å²	132.6	92%	0.921	77%	0.773	S	S	*	*			trans	-147.5	169.2	163.1	-80.2	-173.4	0	0	0	113
971	T	29.6	Very low	34.8	Very low	124 Å²	124	133.2 Å²	133.2	76%	0.761	78%	0.778	S	S	*	*			trans	-145.5	179.8	-165.5	-44.8	0	0	0	0	111.1
972	L	33.2	Very low	34.8	Very low	168 Å²	168	130.7 Å²	130.7	88%	0.88	77%	0.773	S	S	*	*			trans	104.6	153.1	171	-58.2	164.3	0	0	0	115.4
973	A	32.3	Very low	34.9	Very low	77 Å²	77	132 Å²	132	64%	0.636	77%	0.774	S	S	*	*			cis	-175.4	169.7	-26.3	0	0	0	0	0	111.2
974	S	33.7	Very low	34.8	Very low	117 Å²	117	134.9 Å²	134.9	82%	0.818	78%	0.776	S	S	*	*			trans	74	152.9	156.8	-61.4	0	0	0	0	119.3
975	S	35.8	Very low	35	Very low	97 Å²	97	134.1 Å²	134.1	68%	0.678	77%	0.772	S	S	*	*			cis	-173.9	144.8	-11.3	49.1	0	0	0	0	113.9
976	S	34.7	Very low	35	Very low	98 Å²	98	126.5 Å²	126.5	69%	0.685	76%	0.757	S	S	*	*			trans	56.1	159.4	147.8	-48	0	0	0	0	119.9
977	F	35.1	Very low	35.1	Very low	194 Å²	194	127.8 Å²	127.8	85%	0.851	76%	0.758	S	S	*	*			cis	-144.4	173.9	12	-77.9	-96.9	0	0	0	108.5
978	N	31.5	Very low	34.6	Very low	138 Å²	138	129.1 Å²	129.1	74%	0.738	76%	0.764	S	S	*	*			cis	158	151.8	-22	-155.8	14.4	0	0	0	106.8
979	S	33.1	Very low	34	Very low	104 Å²	104	127.2 Å²	127.2	73%	0.727	76%	0.759	S	S	*	*			trans	91.4	122.8	177.8	-40.8	0	0	0	0	116.1
980	S	33.4	Very low	34.1	Very low	119 Å²	119	130.7 Å²	130.7	83%	0.832	76%	0.763	S	S	*	*			cis	97.7	135.2	44.5	-73.4	0	0	0	0	112.5
981	S	34	Very low	34	Very low	99 Å²	99	127.7 Å²	127.7	69%	0.692	76%	0.757	S	S	*	*			cis	-167.3	168.4	-3.9	69.8	0	0	0	0	112.6
982	S	35.5	Very low	34.4	Very low	95 Å²	95	129.1 Å²	129.1	66%	0.664	76%	0.759	S	S	*	*			trans	70.9	150.4	149.5	-58.5	0	0	0	0	118.9
983	Q	35.7	Very low	34.5	Very low	157 Å²	157	126.2 Å²	126.2	73%	0.734	75%	0.75	S	S	*	*			cis	-163	148.5	-9.8	-115.3	175.9	33.4	0	0	110.8
984	K	34.5	Very low	34.3	Very low	185 Å²	185	129.8 Å²	129.8	80%	0.804	76%	0.757	S	S	*	*			trans	45.1	148.2	140.1	-74.5	-178.2	177.6	-175.4	0	121.6
985	S	35	Very low	34.2	Very low	96 Å²	96	131.9 Å²	131.9	67%	0.671	76%	0.757	S	S	*	*			cis	-168.7	170.2	4.7	41.2	0	0	0	0	112.8
986	S	37.3	Very low	33.9	Very low	87 Å²	87	133.5 Å²	133.5	61%	0.608	76%	0.758	S	S	*	*			trans	55.7	106	148.8	56.3	0	0	0	0	118.7
987	E	35.4	Very low	33.9	Very low	180 Å²	180	137 Å²	137	84%	0.841	77%	0.768	S	S	*	*				82	123.6	76.1	-77.8	169.7	113.9	0	0	115.6
988	T	33	Very low	33.8	Very low	145 Å²	145	135 Å²	135	89%	0.89	76%	0.761	S	S	*	*				168.4	147.5	118.3	-65.4	0	0	0	0	110.1
989	A	32.5	Very low	34	Very low	87 Å²	87	136.2 Å²	136.2	72%	0.719	77%	0.768	S	S	*	*			trans	-99.9	159.2	-173.6	0	0	0	0	0	115.3
990	K	34.5	Very low	34	Very low	201 Å²	201	142.4 Å²	142.4	87%	0.874	78%	0.775	S	S	*	*			trans	-170.8	120.8	151.6	-97.1	147.5	-173.1	-179.7	0	106.4
991	S	34.6	Very low	34	Very low	113 Å²	113	141.1 Å²	141.1	79%	0.79	77%	0.766	S	S	*	*				79.4	120.1	63.7	-164	0	0	0	0	114.2
992	I	37	Very low	33.8	Very low	155 Å²	155	143.4 Å²	143.4	80%	0.795	77%	0.768	S	S	*	*			trans	-66	173.9	160.9	13.3	174.8	0	0	0	110.4
993	P	35.9	Very low	33.8	Very low	107 Å²	107	144.7 Å²	144.7	70%	0.695	77%	0.767	S	S	*	*			cis	-144.1	-165.3	30.3	44.7	-23.5	0	0	0	117.4
994	L	29.1	Very low	33.6	Very low	151 Å²	151	143.6 Å²	143.6	79%	0.791	77%	0.771	S	S	*	*			trans	5.8	153.1	146.6	-72.4	160.4	0	0	0	120.9
995	I	31.7	Very low	33.7	Very low	161 Å²	161	140.3 Å²	140.3	83%	0.826	77%	0.769	S	S	*	*				-164	158.4	114.2	-94.4	148.7	0	0	0	110.2
996	L	29	Very low	33.7	Very low	132 Å²	132	142 Å²	142	69%	0.691	78%	0.775	S	S	*	*			trans	-71	176.1	178.1	-55	95.6	0	0	0	113.1
997	L	33.6	Very low	33.7	Very low	171 Å²	171	146.3 Å²	146.3	90%	0.895	79%	0.786	S	S	*	*			trans	-146.6	109.7	144.8	-109.6	148.7	0	0	0	110.7
998	E	34	Very low	33.7	Very low	151 Å²	151	142.8 Å²	142.8	71%	0.706	78%	0.781	S	S	*	*			trans	-62.8	143.6	152.2	-97.2	100.6	135.6	0	0	109.8
999	D	36.4	Very low	34	Very low	165 Å²	165	139.7 Å²	139.7	88%	0.882	78%	0.778	S	S	*	*			trans	-103.1	108.7	176.4	-150.1	-19.8	0	0	0	110.7
1000	R	32.1	Very low	34.2	Very low	234 Å²	234	145.2 Å²	145.2	88%	0.883	79%	0.786	S	S	*	*			trans	-150.3	76.4	-179.3	-159.9	178.2	180	174.9	0.6	115.5
1001	S	32.6	Very low	34.4	Very low	91 Å²	91	147.8 Å²	147.8	64%	0.636	79%	0.79	S	S	*	*			trans	82.5	153.7	137.2	-147.2	0	0	0	0	121.3
1002	M	31.2	Very low	34.6	Very low	148 Å²	148	151.9 Å²	151.9	73%	0.729	79%	0.793	S	S	*	*			trans	86.1	104.7	160.3	-57.9	-58.2	174.7	0	0	122.5
1003	N	33.9	Very low	34.7	Very low	121 Å²	121	155.6 Å²	155.6	65%	0.647	80%	0.797	S	S	*	*				78.4	103.3	122	-59.8	-15.4	0	0	0	124.7
1004	T	31.5	Very low	34.9	Very low	134 Å²	134	154.7 Å²	154.7	82%	0.822	79%	0.794	S	S	*	*				66.6	174.1	129.7	68.5	0	0	0	0	119.4
1005	P	38.5	Very low	35.6	Very low	117 Å²	117	155.5 Å²	155.5	76%	0.76	79%	0.793	S	S	*	*			cis	-129.6	173.5	-7	30.3	-7.9	0	0	0	117.7
1006	T	33.9	Very low	36	Very low	131 Å²	131	152.4 Å²	152.4	80%	0.804	79%	0.786	S	S	*	*			trans	-28.4	141.7	162.7	-38.3	0	0	0	0	120.7
1007	E	37.4	Very low	36.5	Very low	178 Å²	178	150.7 Å²	150.7	83%	0.832	79%	0.785	S	S	*	*				-168.1	-177	125.5	-112.1	-106.9	64.8	0	0	114.2
1008	S	36.3	Very low	36.9	Very low	105 Å²	105	147.8 Å²	147.8	73%	0.734	77%	0.774	S	S	*	*			trans	-121.6	163	-156.3	70.2	0	0	0	0	116.4
1009	G	38	Very low	37.4	Very low	80 Å²	80	148 Å²	148	83%	0.825	78%	0.775	S	S	*	*			trans	174	92.3	172.9	0	0	0	0	0	119.4
1010	K	37.1	Very low	38	Very low	203 Å²	203	145.9 Å²	145.9	88%	0.883	76%	0.764	S	S	*	*			trans	-59.8	148	175.6	-59.6	156.7	178.4	163.9	0	114.9
1011	R	37.8	Very low	38.5	Very low	256 Å²	256	140.6 Å²	140.6	97%	0.966	75%	0.753	S	S	*	*				-170.1	167.4	123.8	-103.1	157.6	-168.5	-151.7	1.3	114.6
1012	K	40.7	Very low	39.1	Very low	198 Å²	198	142 Å²	142	86%	0.861	75%	0.753	S	S	*	*			trans	-117.2	153.5	-163.5	-60.1	-179.9	175	-174	0	114.6
1013	R	38.5	Very low	39.9	Very low	233 Å²	233	142 Å²	142	88%	0.879	76%	0.756	S	S	*	*				-169.5	126.2	127.9	-100.1	161.6	175.9	162.4	-1.8	107.5
1014	S	40.1	Very low	40.4	Very low	88 Å²	88	142.6 Å²	142.6	62%	0.615	76%	0.759	S	S	*	*				62.4	117.8	77.2	-51.9	0	0	0	0	110.6
1015	H	42.8	Very low	40.9	Very low	169 Å²	169	142.5 Å²	142.5	78%	0.782	75%	0.753	S	S	*	*			cis	-143.9	134.5	45.8	-83.8	-88.8	0	0	0	111.1
1016	S	39.9	Very low	41.4	Very low	95 Å²	95	143.4 Å²	143.4	66%	0.664	75%	0.751	S	S	*	*				65	134.1	77.2	82.2	0	0	0	0	114.2
1017	S	40.1	Very low	42	Very low	96 Å²	96	145.1 Å²	145.1	67%	0.671	75%	0.754	S	S	*	*			cis	-176.9	175.5	-1.3	38	0	0	0	0	111.3
1018	V	42.6	Very low	42.3	Very low	110 Å²	110	143.5 Å²	143.5	67%	0.667	75%	0.75	S	S	*	*			trans	95.8	99.7	163.2	-170	0	0	0	0	112.3
1019	E	44.9	Very low	42.6	Very low	155 Å²	155	145.5 Å²	145.5	72%	0.724	75%	0.751	S	S	*	*				71.4	144.6	62	-54.4	149.2	179.3	0	0	110.3
1020	D	47.6	Very low	42.8	Very low	122 Å²	122	149.2 Å²	149.2	65%	0.652	75%	0.747	S	S	*	*			cis	-159.6	174.1	15.1	-147.5	-9.6	0	0	0	113.4
1021	N	43.3	Very low	43.2	Very low	122 Å²	122	146 Å²	146	65%	0.652	74%	0.739	S	S	*	*			trans	77.5	113.4	169	-56.2	-63	0	0	0	117.5
1022	N	44.2	Very low	43.5	Very low	121 Å²	121	139.1 Å²	139.1	65%	0.647	73%	0.725	S	S	*	*				70.3	120	58.8	-53.4	-35.9	0	0	0	109.6
1023	D	48.5	Very low	43.7	Very low	148 Å²	148	135.2 Å²	135.2	79%	0.791	72%	0.716	S	S	*	*				-132.7	151.2	54.8	-64.2	-37.1	0	0	0	112.1
1024	D	45.2	Very low	44.1	Very low	134 Å²	134	128.2 Å²	128.2	72%	0.717	70%	0.704	S	S	*	*				61.1	126.4	65.1	-89.7	5.8	0	0	0	112.8
1025	L	42.3	Very low	44.4	Very low	132 Å²	132	131.3 Å²	131.3	69%	0.691	71%	0.711	S	S	*	*			cis	-150.6	163.4	12.3	-91.9	137.1	0	0	0	112.7
1026	D	47.3	Very low	44.5	Very low	135 Å²	135	128.2 Å²	128.2	72%	0.722	71%	0.705	S	S	*	*			trans	31.3	110.5	149	-59.1	-18.1	0	0	0	121.4
1027	I	48.4	Very low	44.9	Very low	168 Å²	168	131.2 Å²	131.2	86%	0.862	71%	0.709	S	S	*	*				-178.1	0	109.2	-89.2	155.2	0	0	0	111	T550 T551	T550-I1027 HydrophobicContact CG2-CD1 4.35Å; T551-I1027 HydrophobicContact CG2-CD1 3.62Å; T551-I1027 HydrophobicContact CG2-CG1 4.07Å

Retrieved 1,027 of 1,027 residues in 1043.9 ms (Link to these results)

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