A0A087Y868_POEFO Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A087Y868, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 897 aa.

						>A0A087Y868_POEFO|A0A087Y868
MMSQQLVQPPYLGKWEESCLAVDWGKKQGRAHRLFRLVFVCVCVATLSILETKEYRNYPPPVGGSLDMDMDVPDSPHEDMGLLKTFDSSEFGNWEKIGSGGFGQVYKVRHVKWKTWLAIKCPPCLHLDEKDRSELLEEARKMEAAKFRYILPVYGICNDPQGLVMEYMETGSLENLLANEPLPWELRFRIIHETAVGMNFLHCMNPPLLHLDLKPANILLDGHYHVKISDFGLARWNGLAQTDDISREGFCGTIAYLPPERIIEKDRVSDTKHDVYSFSIVIWGILTQKKPYQGENNILQIMVKVVKGIRPDLGLVPRSRPSTCAGFLSLMQRCWVNSPNARPTFQEITSEAEELCSKPQDEPRTPRLSTSSEPEPLSPNPVASDQSNASKPVRPKSAMLPEKDYSLSELLNQVDSGISRSFDRVKEDSIHSKENTCKRLSGISSADSAFSSQDSISLSFEKETTFDSAEVQKKKLCDAIRTKDTAKLMKILQPQDVDLPLEGGDSLLHFAIMLGNEEAVKFLLLNDANPNLPNIRGSTPLHLATEKHQKLLAELLLGWRRTNVNAKDEDQYTPLHWAAQNGDEAMTRLLLDRGATINETDGQGRTPAHVACQHGQENVIRVLLSRNADVQVKGKNNWTALHFAAWQGHLGIVKLLVKQAGVNVDSQTTDGRTALHLASQRGQYRVARILIELGADVRVKSSELNTALHVAAETGHTSTSRLLIKHQADVNIQNAQGLTPLHLASQRGHLATVKMLIAEGADPYMSDRTQRIPCHLAAENGHSEVLKELILHCPDSGGLSDQQGLSPLHLAVQGGHSNVITMLLPPQVCQNLTESAVQPVAEEPPAAEVKQLQRKIVILKLTEHKDKDCPESPSPESPSPESPSPESPSPQCASAPC
					

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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	29.3	Very low	25.9	Very low	227 Å²	227	152.3 Å²	152.3	100%	1.118	79%	0.793	S	S	*	*				0	108.1	0	-80.5	173.1	152.3	0	0	106.8
2	M	25.6	Very low	25.7	Very low	175 Å²	175	151.8 Å²	151.8	86%	0.862	79%	0.791	S	S	*	*				71.4	128.3	117.9	-72.9	179.8	167.8	0	0	112.3
3	S	25.2	Very low	25.5	Very low	99 Å²	99	145.8 Å²	145.8	69%	0.692	79%	0.788	S	S	*	*			cis	176.2	150.9	3	33.8	0	0	0	0	106.2
4	Q	29	Very low	25.3	Very low	163 Å²	163	146.9 Å²	146.9	76%	0.762	78%	0.782	S	S	*	*			trans	18.1	141.6	135	-70.6	178.9	-10.3	0	0	118
5	Q	28.1	Very low	25	Very low	145 Å²	145	149.5 Å²	149.5	68%	0.678	78%	0.777	S	S	*	*			cis	176.9	160.1	31.2	-123.1	172	-4.6	0	0	109.6
6	L	23.8	Very low	24.8	Very low	125 Å²	125	148.9 Å²	148.9	65%	0.654	77%	0.769	S	S	*	*			trans	56	120.2	140.6	-70.9	155.1	0	0	0	121.7
7	V	23.5	Very low	24.9	Very low	151 Å²	151	150 Å²	150	92%	0.915	77%	0.77	S	S	*	*				-148.8	137.5	119	179.7	0	0	0	0	109.5
8	Q	24.4	Very low	24.9	Very low	146 Å²	146	148.1 Å²	148.1	68%	0.682	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-80.3	167.4	-176.2	-54.5	-165.6	-21.3	0	0	114.6
9	P	24	Very low	24.8	Very low	110 Å²	110	147.2 Å²	147.2	71%	0.714	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-92.2	150.8	148.2	32.6	-23.1	0	0	0	111.5
10	P	29	Very low	24.9	Very low	129 Å²	129	147.8 Å²	147.8	84%	0.838	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-80.9	143.7	-163.7	32.7	-34	0	0	0	113.4
11	Y	23.7	Very low	24.9	Very low	205 Å²	205	144.6 Å²	144.6	80%	0.804	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-95	162.4	173.7	-108.9	-85.4	0	0	0	112.2
12	L	23.1	Very low	24.7	Very low	147 Å²	147	141 Å²	141	77%	0.77	77%	0.765	S	S	*	*			trans	93.1	100.3	142.2	-83.2	147.7	0	0	0	120.2
13	G	22.6	Very low	24.7	Very low	73 Å²	73	139.5 Å²	139.5	75%	0.753	76%	0.761	S	S	*	*				128.5	151.5	108.8	0	0	0	0	0	115.5
14	K	23.6	Very low	24.8	Very low	161 Å²	161	147.2 Å²	147.2	70%	0.7	78%	0.775	S	S	*	*			cis	-179.1	143	-16.2	-144.7	178.6	172	-174	0	105.5
15	W	20.6	Very low	24.7	Very low	187 Å²	187	142 Å²	142	71%	0.708	77%	0.765	S	S	*	*			trans	82.4	127.6	160.6	-55.6	97	0	0	0	122.8
16	E	22.4	Very low	25.2	Very low	140 Å²	140	145 Å²	145	65%	0.654	78%	0.776	S	S	*	*				91	116.6	128.5	-81.6	166.7	178.9	0	0	123.3
17	E	25.4	Very low	25.6	Very low	167 Å²	167	148.5 Å²	148.5	78%	0.78	79%	0.786	S	S	*	*			trans	62.9	118.7	131	-70	-177	171.8	0	0	121.3
18	S	24.5	Very low	26	Very low	116 Å²	116	149 Å²	149	81%	0.811	78%	0.778	S	S	*	*			trans	-155.7	71.7	133.1	-76.6	0	0	0	0	110.4
19	C	24.7	Very low	26.3	Very low	130 Å²	130	145 Å²	145	88%	0.878	78%	0.777	S	S	*	*			trans	-106.5	101.2	146.3	-81.1	0	0	0	0	105.8
20	L	25.9	Very low	27	Very low	160 Å²	160	149.6 Å²	149.6	84%	0.838	78%	0.779	S	S	*	*			trans	-104.7	106.8	167.1	-78.5	165	0	0	0	106.7
21	A	25.8	Very low	27.3	Very low	80 Å²	80	146 Å²	146	66%	0.661	76%	0.76	S	S	*	*				77.2	103.7	74.1	0	0	0	0	0	112.2
22	V	24.2	Very low	27.7	Very low	151 Å²	151	143.4 Å²	143.4	92%	0.915	76%	0.755	S	S	*	*			trans	-130.9	120.6	134.2	-179.9	0	0	0	0	107.7
23	D	26.6	Very low	28.5	Very low	145 Å²	145	145.9 Å²	145.9	78%	0.775	76%	0.755	S	S	*	*			trans	-50.7	134.1	175.8	-100.7	-47.6	0	0	0	113.9
24	W	25.7	Very low	29.3	Very low	261 Å²	261	147.7 Å²	147.7	99%	0.989	75%	0.746	S	S	*	*			trans	-131.3	107.9	139.9	-131.7	-60.6	0	0	0	108.8
25	G	27.1	Very low	29.8	Very low	53 Å²	53	147.9 Å²	147.9	55%	0.546	75%	0.747	S	S	.	*			trans	-65	152.2	-170.5	0	0	0	0	0	115	K27	G25-K27 PolarHBondContact O-N 3.1Å; G25-K27 VanDerWaalsContact O-N 3.16Å
26	K	38.7	Very low	30.5	Very low	209 Å²	209	148.2 Å²	148.2	91%	0.909	75%	0.748	S	S	*	*	S	Bend	trans	18.3	83.3	147.8	-71.3	178.2	177.4	172.4	0	116
27	K	32.8	Very low	31.2	Very low	197 Å²	197	147.1 Å²	147.1	86%	0.857	75%	0.746	S	S	*	*			trans	175.7	105.2	137.3	-100.3	168.9	-176	-179.6	0	108.3	G25	G25-K27 PolarHBondContact O-N 3.1Å; G25-K27 VanDerWaalsContact O-N 3.16Å
28	Q	31.2	Very low	31.8	Very low	162 Å²	162	142.9 Å²	142.9	76%	0.757	73%	0.732	S	S	*	*			trans	153.9	81.4	142.1	-84.3	178.4	8.4	0	0	111.6	R30	Q28-R30 PolarHBondContact O-N 2.9Å
29	G	32.1	Very low	32.2	Very low	63 Å²	63	144.1 Å²	144.1	65%	0.649	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.6	11.9	164.6	0	0	0	0	0	114.8
30	R	37.6	Very low	32.9	Very low	205 Å²	205	142 Å²	142	77%	0.774	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-30.1	176.8	-83.1	-176.3	176	175.2	-1.7	113.4	Q28 R33 L34	Q28-R30 PolarHBondContact O-N 2.9Å; R30-R33 PolarHBondContact O-N 2.8Å; R30-L34 PolarHBondContact O-N 3.37Å
31	A	34.6	Very low	33.3	Very low	53 Å²	53	137.9 Å²	137.9	44%	0.438	69%	0.69	S	S	.	*	H	α-helix	trans	-71.5	-36.7	-178	0	0	0	0	0	112.8	R33 L34 F35	A31-R33 VanDerWaalsContact C-N 3.35Å; A31-R33 PolarHBondContact O-N 3.17Å; A31-L34 PolarHBondContact O-N 3.3Å; A31-F35 PolarHBondContact O-N 3.22Å
32	H	33.6	Very low	33.7	Very low	151 Å²	151	137.9 Å²	137.9	70%	0.699	68%	0.681	S	S	*	*	H	α-helix	trans	-74	-24.7	178.5	-140.9	-86.3	0	0	0	113.3	R36	H32-R36 PolarHBondContact O-N 3.22Å
33	R	39.8	Very low	34.2	Very low	200 Å²	200	133.1 Å²	133.1	76%	0.755	65%	0.654	S	S	*	*	H	α-helix	trans	-76.9	-39.7	169.2	-72.6	-172.3	-159.5	-152.6	1.7	111.1	R30 A31 F35 R36 L37	R30-R33 PolarHBondContact O-N 2.8Å; A31-R33 VanDerWaalsContact C-N 3.35Å; A31-R33 PolarHBondContact O-N 3.17Å; R33-F35 VanDerWaalsContact C-N 3.34Å; R33-R36 PolarHBondContact O-N 3.34Å; R33-L37 WeakPolarHBondContact O-CB 3.32Å; R33-L37 PolarHBondContact O-N 3.09Å
34	L	38.5	Very low	34.8	Very low	110 Å²	110	130.1 Å²	130.1	58%	0.576	64%	0.641	S	S	*	*	H	α-helix	trans	-63.8	-38.3	172.5	-105.2	98.6	0	0	0	111.8	R30 A31 L37 V38	R30-L34 PolarHBondContact O-N 3.37Å; A31-L34 PolarHBondContact O-N 3.3Å; L34-L37 PolarHBondContact O-N 3Å; L34-V38 WeakPolarHBondContact O-CA 3.47Å; L34-V38 WeakPolarHBondContact O-CB 3.37Å; L34-V38 WeakPolarHBondContact O-CG2 3.32Å; L34-V38 PolarHBondContact O-N 3.33Å
35	F	33.8	Very low	35.1	Very low	165 Å²	165	119.9 Å²	119.9	72%	0.724	61%	0.612	S	S	*	*	H	α-helix	trans	-69.4	-37.3	178.5	-127.6	-91	0	0	0	112.6	A31 R33 F39	A31-F35 PolarHBondContact O-N 3.22Å; R33-F35 VanDerWaalsContact C-N 3.34Å; F35-F39 WeakPolarHBondContact O-CB 3.49Å; F35-F39 PolarHBondContact O-N 3.36Å
36	R	35.9	Very low	35.4	Very low	194 Å²	194	120.5 Å²	120.5	73%	0.732	61%	0.605	S	S	*	*	H	α-helix	trans	-72.1	-37.7	172.1	-106.2	-175.9	176.6	179.5	-1.1	112.9	H32 R33 V40	H32-R36 PolarHBondContact O-N 3.22Å; R33-R36 PolarHBondContact O-N 3.34Å; R36-V40 VanDerWaalsContact O-CB 3.3Å; R36-V40 WeakPolarHBondContact O-CB 3.21Å; R36-V40 WeakPolarHBondContact O-CG2 3.48Å; R36-V40 PolarHBondContact O-N 3.48Å
37	L	36.8	Very low	35.3	Very low	117 Å²	117	115 Å²	115	61%	0.613	59%	0.585	S	S	*	*	H	α-helix	trans	-71.2	-36.3	177.6	-156.9	79.2	0	0	0	110.8	R33 L34 C41	R33-L37 WeakPolarHBondContact O-CB 3.32Å; R33-L37 PolarHBondContact O-N 3.09Å; L34-L37 PolarHBondContact O-N 3Å; L37-C41 WeakPolarHBondContact O-CA 3.2Å; L37-C41 WeakPolarHBondContact O-CB 3.46Å; L37-C41 PolarHBondContact O-N 3.27Å; L37-C41 PolarHBondContact O-SG 2.64Å
38	V	37.7	Very low	35.2	Very low	79 Å²	79	108.7 Å²	108.7	48%	0.479	57%	0.566	S	S	.	*	H	α-helix	trans	-74.6	-36.8	173.8	174	0	0	0	0	110.8	L34 V42	L34-V38 WeakPolarHBondContact O-CA 3.47Å; L34-V38 WeakPolarHBondContact O-CB 3.37Å; L34-V38 WeakPolarHBondContact O-CG2 3.32Å; L34-V38 PolarHBondContact O-N 3.33Å; V38-V42 HydrophobicContact CG1-CG2 3.95Å; V38-V42 WeakPolarHBondContact O-CA 3.34Å; V38-V42 WeakPolarHBondContact O-CB 3.37Å; V38-V42 WeakPolarHBondContact O-CG2 3.2Å; V38-V42 PolarHBondContact O-N 3.16Å
39	F	32.9	Very low	35.2	Very low	141 Å²	141	106.3 Å²	106.3	62%	0.618	56%	0.557	S	S	*	*	H	α-helix	trans	-69.9	-36.7	175.1	-155.5	-95.3	0	0	0	112	F35 C43	F35-F39 WeakPolarHBondContact O-CB 3.49Å; F35-F39 PolarHBondContact O-N 3.36Å; F39-C43 VanDerWaalsContact O-CB 3.25Å; F39-C43 WeakPolarHBondContact O-CB 3.36Å; F39-C43 PolarHBondContact O-N 2.99Å; F39-C43 PolarHBondContact O-SG 3.03Å
40	V	39.3	Very low	35.2	Very low	85 Å²	85	108.3 Å²	108.3	52%	0.515	55%	0.552	S	S	.	*	H	α-helix	trans	-75.1	-39.2	173.8	174	0	0	0	0	111.5	R36 C43 V44	R36-V40 VanDerWaalsContact O-CB 3.3Å; R36-V40 WeakPolarHBondContact O-CB 3.21Å; R36-V40 WeakPolarHBondContact O-CG2 3.48Å; R36-V40 PolarHBondContact O-N 3.48Å; V40-C43 PolarHBondContact O-N 3.12Å; V40-V44 HydrophobicContact CG1-CG2 4.17Å; V40-V44 VanDerWaalsContact O-CB 3.26Å; V40-V44 WeakPolarHBondContact O-CB 3.33Å; V40-V44 WeakPolarHBondContact O-CG2 3.25Å; V40-V44 PolarHBondContact O-N 3.33Å
41	C	34.8	Very low	35.1	Very low	74 Å²	74	103.4 Å²	103.4	50%	0.5	54%	0.538	S	S	.	.	H	α-helix	trans	-70.8	-32.8	174.1	-75.3	0	0	0	0	112.5	L37 A45	L37-C41 WeakPolarHBondContact O-CA 3.2Å; L37-C41 WeakPolarHBondContact O-CB 3.46Å; L37-C41 PolarHBondContact O-N 3.27Å; L37-C41 PolarHBondContact O-SG 2.64Å; C41-A45 WeakPolarHBondContact O-CA 3.15Å; C41-A45 WeakPolarHBondContact O-CB 3.47Å; C41-A45 PolarHBondContact O-N 2.67Å
42	V	34.7	Very low	34.9	Very low	81 Å²	81	105.7 Å²	105.7	49%	0.491	55%	0.547	S	S	.	.	H	α-helix	trans	-71.2	-42.1	172.3	170.9	0	0	0	0	109.3	V38 A45 T46	V38-V42 HydrophobicContact CG1-CG2 3.95Å; V38-V42 WeakPolarHBondContact O-CA 3.34Å; V38-V42 WeakPolarHBondContact O-CB 3.37Å; V38-V42 WeakPolarHBondContact O-CG2 3.2Å; V38-V42 PolarHBondContact O-N 3.16Å; V42-A45 PolarHBondContact O-N 2.77Å; V42-T46 HydrophobicContact CG1-CG2 4.45Å; V42-T46 WeakPolarHBondContact O-CB 3.19Å; V42-T46 WeakPolarHBondContact O-CG2 3.28Å; V42-T46 PolarHBondContact O-N 3.43Å; V42-T46 PolarHBondContact O-OG1 3Å
43	C	34.1	Very low	34.7	Very low	51 Å²	51	105.9 Å²	105.9	35%	0.345	55%	0.546	S	S	.	.	H	α-helix	trans	-65.3	-40.7	174.8	-75.4	0	0	0	0	113.2	F39 V40 T46 L47	F39-C43 VanDerWaalsContact O-CB 3.25Å; F39-C43 WeakPolarHBondContact O-CB 3.36Å; F39-C43 PolarHBondContact O-N 2.99Å; F39-C43 PolarHBondContact O-SG 3.03Å; V40-C43 PolarHBondContact O-N 3.12Å; C43-T46 WeakPolarHBondContact CA-OG1 3.42Å; C43-T46 PolarHBondContact O-OG1 2.75Å; C43-T46 VanDerWaalsContact O-OG1 3.07Å; C43-L47 VanDerWaalsContact O-CB 3.27Å; C43-L47 WeakPolarHBondContact O-CB 3.17Å; C43-L47 WeakPolarHBondContact O-CD1 3.43Å; C43-L47 VanDerWaalsContact O-CG 3.25Å; C43-L47 WeakPolarHBondContact O-CG 3.13Å; C43-L47 PolarHBondContact O-N 3.18Å
44	V	38.6	Very low	34.3	Very low	81 Å²	81	103.3 Å²	103.3	49%	0.491	54%	0.543	S	S	.	.	H	α-helix	trans	-75.4	-34.1	177.8	173.9	0	0	0	0	111.5	V40 L47 S48	V40-V44 HydrophobicContact CG1-CG2 4.17Å; V40-V44 VanDerWaalsContact O-CB 3.26Å; V40-V44 WeakPolarHBondContact O-CB 3.33Å; V40-V44 WeakPolarHBondContact O-CG2 3.25Å; V40-V44 PolarHBondContact O-N 3.33Å; V44-L47 PolarHBondContact O-N 3.03Å; V44-S48 WeakPolarHBondContact O-CB 3.27Å; V44-S48 PolarHBondContact O-N 3.43Å; V44-S48 PolarHBondContact O-OG 3.33Å
45	A	32.1	Very low	33.8	Very low	47 Å²	47	107.4 Å²	107.4	39%	0.388	55%	0.552	S	S	.	*	H	α-helix	trans	-72.8	-36	171.4	0	0	0	0	0	111.8	C41 V42 S48 I49	C41-A45 WeakPolarHBondContact O-CA 3.15Å; C41-A45 WeakPolarHBondContact O-CB 3.47Å; C41-A45 PolarHBondContact O-N 2.67Å; V42-A45 PolarHBondContact O-N 2.77Å; A45-S48 PolarHBondContact O-N 3.45Å; A45-I49 WeakPolarHBondContact O-CB 3.33Å; A45-I49 WeakPolarHBondContact O-CD1 3.35Å; A45-I49 WeakPolarHBondContact O-CG1 3.44Å; A45-I49 PolarHBondContact O-N 2.97Å
46	T	33.7	Very low	33.5	Very low	65 Å²	65	110 Å²	110	40%	0.399	56%	0.557	S	S	.	*	H	α-helix	trans	-70.8	-31.7	171	46.5	0	0	0	0	111.9	V42 C43 L50	V42-T46 HydrophobicContact CG1-CG2 4.45Å; V42-T46 WeakPolarHBondContact O-CB 3.19Å; V42-T46 WeakPolarHBondContact O-CG2 3.28Å; V42-T46 PolarHBondContact O-N 3.43Å; V42-T46 PolarHBondContact O-OG1 3Å; C43-T46 WeakPolarHBondContact CA-OG1 3.42Å; C43-T46 PolarHBondContact O-OG1 2.75Å; C43-T46 VanDerWaalsContact O-OG1 3.07Å; T46-L50 WeakPolarHBondContact O-CA 3.41Å; T46-L50 WeakPolarHBondContact O-CB 2.85Å; T46-L50 VanDerWaalsContact O-CD1 3.28Å; T46-L50 WeakPolarHBondContact O-CD1 3.21Å; T46-L50 WeakPolarHBondContact O-CG 3.37Å; T46-L50 PolarHBondContact O-N 3.44Å
47	L	35.8	Very low	33.1	Very low	93 Å²	93	107.2 Å²	107.2	49%	0.487	56%	0.556	S	S	.	*	H	α-helix	trans	-69.5	-42.5	171.7	-80.6	159.5	0	0	0	110.8	C43 V44 I49 L50 E51	C43-L47 VanDerWaalsContact O-CB 3.27Å; C43-L47 WeakPolarHBondContact O-CB 3.17Å; C43-L47 WeakPolarHBondContact O-CD1 3.43Å; C43-L47 VanDerWaalsContact O-CG 3.25Å; C43-L47 WeakPolarHBondContact O-CG 3.13Å; C43-L47 PolarHBondContact O-N 3.18Å; V44-L47 PolarHBondContact O-N 3.03Å; L47-I49 PolarHBondContact O-N 2.86Å; L47-L50 PolarHBondContact O-N 3.31Å; L47-E51 WeakPolarHBondContact O-CB 3.15Å; L47-E51 VanDerWaalsContact O-CG 3.25Å; L47-E51 WeakPolarHBondContact O-CG 3.3Å; L47-E51 PolarHBondContact O-N 3.47Å
48	S	32.3	Very low	32.6	Very low	65 Å²	65	111.4 Å²	111.4	46%	0.455	57%	0.565	S	S	.	*	H	α-helix	trans	-69.7	-27.9	174.1	-66.7	0	0	0	0	114	V44 A45 T52	V44-S48 WeakPolarHBondContact O-CB 3.27Å; V44-S48 PolarHBondContact O-N 3.43Å; V44-S48 PolarHBondContact O-OG 3.33Å; A45-S48 PolarHBondContact O-N 3.45Å; S48-T52 WeakPolarHBondContact O-CB 3.25Å; S48-T52 WeakPolarHBondContact O-CG2 3.34Å; S48-T52 PolarHBondContact O-N 2.89Å; S48-T52 PolarHBondContact O-OG1 3.26Å
49	I	31.3	Very low	32.1	Very low	112 Å²	112	112.9 Å²	112.9	57%	0.574	58%	0.577	S	S	*	*	H	α-helix	trans	-87.2	-24	176.2	-66.6	167.2	0	0	0	112	A45 L47 T52	A45-I49 WeakPolarHBondContact O-CB 3.33Å; A45-I49 WeakPolarHBondContact O-CD1 3.35Å; A45-I49 WeakPolarHBondContact O-CG1 3.44Å; A45-I49 PolarHBondContact O-N 2.97Å; L47-I49 PolarHBondContact O-N 2.86Å; I49-T52 WeakPolarHBondContact CA-OG1 3.38Å; I49-T52 PolarHBondContact O-OG1 3.28Å
50	L	31	Very low	31.8	Very low	105 Å²	105	110.4 Å²	110.4	55%	0.55	57%	0.574	S	S	.	*	H	α-helix	trans	-82.1	-36.7	170.6	-74.5	161.5	0	0	0	111.4	T46 L47 K53 E54	T46-L50 WeakPolarHBondContact O-CA 3.41Å; T46-L50 WeakPolarHBondContact O-CB 2.85Å; T46-L50 VanDerWaalsContact O-CD1 3.28Å; T46-L50 WeakPolarHBondContact O-CD1 3.21Å; T46-L50 WeakPolarHBondContact O-CG 3.37Å; T46-L50 PolarHBondContact O-N 3.44Å; L47-L50 PolarHBondContact O-N 3.31Å; L50-K53 PolarHBondContact O-N 2.96Å; L50-K53 VanDerWaalsContact O-N 3.12Å; L50-E54 PolarHBondContact O-N 3.43Å; L50-E54 VanDerWaalsContact O-N 3.09Å
51	E	36.3	Very low	31.3	Very low	102 Å²	102	110.8 Å²	110.8	48%	0.477	58%	0.579	S	S	.	*	H	α-helix	trans	-76.9	-22.5	178.8	-73.2	178.1	164	0	0	113	L47 K53 E54 Y55	L47-E51 WeakPolarHBondContact O-CB 3.15Å; L47-E51 VanDerWaalsContact O-CG 3.25Å; L47-E51 WeakPolarHBondContact O-CG 3.3Å; L47-E51 PolarHBondContact O-N 3.47Å; E51-K53 VanDerWaalsContact C-N 3.25Å; E51-K53 PolarHBondContact O-N 3.34Å; E51-E54 PolarHBondContact O-N 2.85Å; E51-Y55 PolarHBondContact O-N 2.96Å
52	T	29.9	Very low	31	Very low	101 Å²	101	113.8 Å²	113.8	62%	0.62	60%	0.595	S	S	*	*	H	α-helix	trans	-75.3	-12.1	167.1	42.3	0	0	0	0	113.4	S48 I49	S48-T52 WeakPolarHBondContact O-CB 3.25Å; S48-T52 WeakPolarHBondContact O-CG2 3.34Å; S48-T52 PolarHBondContact O-N 2.89Å; S48-T52 PolarHBondContact O-OG1 3.26Å; I49-T52 WeakPolarHBondContact CA-OG1 3.38Å; I49-T52 PolarHBondContact O-OG1 3.28Å
53	K	29.1	Very low	30.7	Very low	156 Å²	156	113 Å²	113	68%	0.678	60%	0.603	S	S	*	*	H	α-helix	trans	-94.9	-23.1	167.7	-83.1	-176.1	174.9	179.5	0	113.4	L50 E51	L50-K53 PolarHBondContact O-N 2.96Å; L50-K53 VanDerWaalsContact O-N 3.12Å; E51-K53 VanDerWaalsContact C-N 3.25Å; E51-K53 PolarHBondContact O-N 3.34Å
54	E	31.4	Very low	30.4	Very low	146 Å²	146	114.1 Å²	114.1	68%	0.682	62%	0.623	S	S	*	*	H	α-helix	trans	-80.1	-16.7	177.5	-77.5	-174.2	155.8	0	0	114.4	L50 E51	L50-E54 PolarHBondContact O-N 3.43Å; L50-E54 VanDerWaalsContact O-N 3.09Å; E51-E54 PolarHBondContact O-N 2.85Å
55	Y	27.8	Very low	29.8	Very low	196 Å²	196	115 Å²	115	77%	0.769	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	2.7	171.3	-89.8	-87.1	0	0	0	115.1	E51	E51-Y55 PolarHBondContact O-N 2.96Å
56	R	27.4	Very low	29.6	Very low	220 Å²	220	120.9 Å²	120.9	83%	0.83	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-1.5	175.4	-106.2	-176.4	-177.4	176.3	1.9	115
57	N	27.6	Very low	29.3	Very low	134 Å²	134	124.6 Å²	124.6	72%	0.717	67%	0.674	S	S	*	*			trans	-119.3	65.5	-176.3	-74.6	-22.4	0	0	0	112.4
58	Y	26.3	Very low	28.9	Very low	206 Å²	206	129 Å²	129	81%	0.808	70%	0.695	S	S	*	*			trans	-118.6	108.7	146.3	-81.8	-82.8	0	0	0	106.8
59	P	27.1	Very low	28.7	Very low	110 Å²	110	133.6 Å²	133.6	71%	0.714	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-67.6	142.2	167.1	28.3	-30.2	0	0	0	108.6
60	P	28.1	Very low	28.5	Very low	88 Å²	88	137.1 Å²	137.1	57%	0.571	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-61.8	152.5	164.2	28.6	-31.9	0	0	0	108.9	V62	P60-V62 PolarHBondContact O-N 3.22Å; P60-V62 VanDerWaalsContact O-N 3.09Å
61	P	28.2	Very low	28.5	Very low	94 Å²	94	140.3 Å²	140.3	61%	0.61	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-60	118.3	169.1	25.1	-30.5	0	0	0	108.3	G63	P61-G63 PolarHBondContact O-N 3.24Å; P61-G63 VanDerWaalsContact O-N 3.11Å
62	V	28.7	Very low	28.2	Very low	137 Å²	137	141.6 Å²	141.6	83%	0.83	76%	0.762	S	S	*	*			trans	-65.4	106.9	170.8	-179.9	0	0	0	0	106.9	P60	P60-V62 PolarHBondContact O-N 3.22Å; P60-V62 VanDerWaalsContact O-N 3.09Å
63	G	27.7	Very low	28.4	Very low	65 Å²	65	142.8 Å²	142.8	67%	0.67	77%	0.772	S	S	*	*			trans	-67.5	125.9	157.7	0	0	0	0	0	107.7	P61 S65	P61-G63 PolarHBondContact O-N 3.24Å; P61-G63 VanDerWaalsContact O-N 3.11Å; G63-S65 PolarHBondContact O-N 3.38Å
64	G	27.9	Very low	28.5	Very low	74 Å²	74	143.5 Å²	143.5	76%	0.763	78%	0.783	S	S	*	*			trans	-70.1	115.2	164.7	0	0	0	0	0	108.2	L66	G64-L66 PolarHBondContact O-N 3.2Å
65	S	25.6	Very low	28.4	Very low	99 Å²	99	140.7 Å²	140.7	69%	0.692	78%	0.779	S	S	*	*			trans	-69.1	110.4	159.2	43.7	0	0	0	0	108	G63	G63-S65 PolarHBondContact O-N 3.38Å
66	L	29.1	Very low	28.7	Very low	170 Å²	170	137.4 Å²	137.4	89%	0.89	78%	0.782	S	S	*	*			trans	-94	100.1	150.1	-81.8	165	0	0	0	104.9	G64 M68	G64-L66 PolarHBondContact O-N 3.2Å; L66-M68 PolarHBondContact O-N 3.48Å
67	D	26.2	Very low	29.2	Very low	144 Å²	144	135.2 Å²	135.2	77%	0.77	78%	0.781	S	S	*	*			trans	-68.7	108.4	168	-69.8	-32.6	0	0	0	108
68	M	28	Very low	30.1	Very low	186 Å²	186	135.7 Å²	135.7	92%	0.916	78%	0.779	S	S	*	*			trans	-114.2	114.4	147.2	-78.5	-168.3	-174.6	0	0	106.3	L66 M70	L66-M68 PolarHBondContact O-N 3.48Å; M68-M70 PolarHBondContact O-N 2.91Å
69	D	28.2	Very low	30.8	Very low	161 Å²	161	132.5 Å²	132.5	86%	0.861	78%	0.776	S	S	*	*			trans	-53.4	124.5	175.7	-68	-51	0	0	0	111.7
70	M	27.9	Very low	32	Very low	186 Å²	186	129.5 Å²	129.5	92%	0.916	75%	0.753	S	S	*	*			trans	-146.9	115.3	147.6	-101.3	-161.4	180	0	0	109.4	M68 V72	M68-M70 PolarHBondContact O-N 2.91Å; M70-V72 PolarHBondContact O-N 2.98Å
71	D	30.1	Very low	33.3	Very low	171 Å²	171	127.9 Å²	127.9	91%	0.914	75%	0.752	S	S	*	*			trans	-52.1	124.8	176.5	-69.9	-59.3	0	0	0	113.3
72	V	30.8	Very low	34.9	Very low	130 Å²	130	130.4 Å²	130.4	79%	0.788	76%	0.76	S	S	*	*			trans	-140.6	131	158	-175.9	0	0	0	0	108.2	M70	M70-V72 PolarHBondContact O-N 2.98Å
73	P	32.8	Very low	37.1	Very low	126 Å²	126	124.7 Å²	124.7	82%	0.818	72%	0.724	S	S	*	*			trans	-78.2	149.8	-165.1	30.2	-34.1	0	0	0	114.4
74	D	31.6	Very low	39.7	Very low	170 Å²	170	125 Å²	125	91%	0.909	71%	0.707	S	S	*	*			trans	-47.8	142.3	-176.2	-71.9	-47.7	0	0	0	116.7
75	S	29.2	Very low	42.4	Very low	87 Å²	87	125.2 Å²	125.2	61%	0.608	69%	0.694	S	S	*	*			trans	-131.8	152.5	155.1	74.5	0	0	0	0	109.8	H77	S75-H77 PolarHBondContact O-N 3.29Å
76	P	34.6	Very low	45.3	Very low	127 Å²	127	120.7 Å²	120.7	83%	0.825	66%	0.662	S	S	*	*			trans	-80.9	97.2	-158.1	32.4	-32.3	0	0	0	111	E78	P76-E78 PolarHBondContact O-N 3.46Å
77	H	37.2	Very low	48	Very low	174 Å²	174	116.6 Å²	116.6	81%	0.806	64%	0.641	S	S	*	*			trans	-78.6	105.8	169.1	-84.9	-71.5	0	0	0	110.2	S75	S75-H77 PolarHBondContact O-N 3.29Å
78	E	46.7	Very low	50.7	Low	145 Å²	145	111.7 Å²	111.7	68%	0.678	62%	0.618	S	S	*	*			trans	-61.8	136.7	163.5	-70.3	179.9	145.2	0	0	110.1	P76 M80	P76-E78 PolarHBondContact O-N 3.46Å; E78-M80 WeakPolarHBondContact O-CG 3.33Å; E78-M80 PolarHBondContact O-N 2.87Å
79	D	41.6	Very low	53.4	Low	139 Å²	139	107.7 Å²	107.7	74%	0.743	61%	0.608	S	S	*	*			trans	-65.4	109.3	-172.1	-162.7	5.5	0	0	0	112.5	R140	D79-R140 PolarHBondContact O-NH2 2.79Å
80	M	52.2	Low	56.2	Low	47 Å²	47	101.7 Å²	101.7	23%	0.232	58%	0.575	C	S	.	*			trans	-91.6	12.3	-170.5	-76.3	-71.9	-81	0	0	115	E78 L136 I156	E78-M80 WeakPolarHBondContact O-CG 3.33Å; E78-M80 PolarHBondContact O-N 2.87Å; M80-L136 HydrophobicContact CE-CD2 3.86Å; M80-L136 HydrophobicContact CE-CG 3.72Å; M80-L136 HydrophobicContact SD-CD2 3.4Å; M80-L136 WeakPolarHBondContact SD-CD2 3.41Å; M80-L136 HydrophobicContact SD-CG 3.85Å; M80-I156 HydrophobicContact CE-CD1 3.54Å; M80-I156 HydrophobicContact CE-CG1 4.34Å
81	G	55.7	Low	59.2	Low	54 Å²	54	93.3 Å²	93.3	56%	0.557	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	-142.1	-179.6	0	0	0	0	0	113.2
82	L	60.5	Low	61.8	Low	146 Å²	146	86.1 Å²	86.1	76%	0.764	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	1.8	177.5	-58.6	162.2	0	0	0	112.8	E143	L82-E143 WeakPolarHBondContact CA-OE1 3.45Å; L82-E143 WeakPolarHBondContact CB-OE1 3.34Å; L82-E143 PolarHBondContact N-OE1 3.47Å
83	L	74.8	Confident	64.3	Low	17 Å²	17	85.1 Å²	85.1	9%	0.089	49%	0.49	C	S	.	.	P	Polyproline II helix	trans	-68.8	131.4	177.7	-71.2	169.3	0	0	0	110.3	A139 E143 V153	L83-A139 HydrophobicContact CD1-CB 3.71Å; L83-E143 HydrophobicContact CD1-CB 4.07Å; L83-E143 HydrophobicContact CD2-CB 4.08Å; L83-E143 HydrophobicContact CD2-CG 4.08Å; L83-E143 HydrophobicContact CG-CB 4.04Å; L83-E143 HydrophobicContact CG-CG 3.98Å; L83-V153 HydrophobicContact CD2-CG1 4.41Å
84	K	82.3	Confident	66.9	Low	72 Å²	72	83.1 Å²	83.1	31%	0.313	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	142.4	177.5	-68.4	-177.7	179	179.8	0	110.8	F86 W113 Y154 G155 I156	K84-F86 HydrophobicContact CB-CD2 4.39Å; K84-F86 HydrophobicContact CB-CE2 3.84Å; K84-F86 HydrophobicContact CB-CZ 3.91Å; K84-F86 HydrophobicContact CD-CZ 4.44Å; K84-W113 HydrophobicContact CD-CZ2 4.37Å; K84-Y154 PolarHBondContact N-O 2.78Å; K84-G155 CarbonylContact O-C 3.58Å; K84-G155 WeakPolarHBondContact O-CA 3.42Å; K84-I156 PolarHBondContact O-N 3.34Å
85	T	85.8	Confident	69.6	Low	79 Å²	79	80 Å²	80	49%	0.485	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	139.1	160.3	46.2	0	0	0	0	108.7	I156	T85-I156 CarbonylContact C-O 3.54Å; T85-I156 VanDerWaalsContact CA-O 3.32Å; T85-I156 WeakPolarHBondContact CA-O 3.42Å
86	F	86.5	Confident	72.2	Confident	4 Å²	4	80.8 Å²	80.8	2%	0.018	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	146.3	178.2	-61.2	-92	0	0	0	110.5	K84 F91 H110 W113 I156 C157 N158 V164	K84-F86 HydrophobicContact CB-CD2 4.39Å; K84-F86 HydrophobicContact CB-CE2 3.84Å; K84-F86 HydrophobicContact CB-CZ 3.91Å; K84-F86 HydrophobicContact CD-CZ 4.44Å; F86-F91 HydrophobicContact CB-CE2 3.41Å; F86-F91 VanDerWaalsContact CB-CE2 3.41Å; F86-F91 HydrophobicContact CB-CZ 3.43Å; F86-F91 VanDerWaalsContact CB-CZ 3.43Å; F86-F91 HydrophobicContact CD1-CE1 4.34Å; F86-F91 HydrophobicContact CD1-CE2 4.44Å; F86-F91 AromaticContact CD1-CZ 3.67Å; F86-F91 HydrophobicContact CD1-CZ 3.67Å; F86-F91 HydrophobicContact CD2-CZ 4.26Å; F86-F91 HydrophobicContact CE1-CZ 4.44Å; F86-F91 HydrophobicContact CG-CE2 4.09Å; F86-F91 AromaticContact CG-CZ 3.55Å; F86-F91 HydrophobicContact CG-CZ 3.55Å; F86-H110 AromaticContact CD1-NE2 3.9Å; F86-H110 AromaticContact CE1-CD2 3.92Å; F86-H110 AromaticContact CE1-NE2 3.59Å; F86-W113 AromaticContact CE1-CH2 3.7Å; F86-W113 HydrophobicContact CE1-CH2 3.7Å; F86-W113 AromaticContact CE1-CZ2 3.96Å; F86-W113 HydrophobicContact CE1-CZ2 3.96Å; F86-W113 HydrophobicContact CE1-CZ3 4.28Å; F86-W113 AromaticContact CZ-CH2 3.59Å; F86-W113 HydrophobicContact CZ-CH2 3.59Å; F86-W113 HydrophobicContact CZ-CZ2 4.25Å; F86-W113 HydrophobicContact CZ-CZ3 4.16Å; F86-I156 PolarHBondContact N-O 3.32Å; F86-C157 CarbonylContact O-C 3.5Å; F86-C157 VanDerWaalsContact O-CA 3.3Å; F86-C157 WeakPolarHBondContact O-CA 3.47Å; F86-N158 PolarHBondContact O-N 3.46Å; F86-V164 HydrophobicContact CD2-CB 4.17Å; F86-V164 HydrophobicContact CD2-CG1 4.41Å; F86-V164 HydrophobicContact CD2-CG2 3.71Å; F86-V164 HydrophobicContact CE2-CB 4.09Å; F86-V164 HydrophobicContact CE2-CG1 4.15Å; F86-V164 HydrophobicContact CE2-CG2 4.16Å; F86-V164 HydrophobicContact CG-CG2 4.39Å
87	D	85.7	Confident	74.3	Confident	83 Å²	83	78.4 Å²	78.4	44%	0.444	42%	0.418	S	S	.	.			trans	-101.3	154.3	173	-64.3	-33.3	0	0	0	111.6	S89 E90 F91	D87-S89 PolarHBondContact O-N 3.2Å; D87-S89 VanDerWaalsContact O-N 3.11Å; D87-E90 WeakPolarHBondContact O-CB 3.31Å; D87-E90 PolarHBondContact O-N 3.01Å; D87-F91 WeakPolarHBondContact O-CD2 3.39Å
88	S	83	Confident	75.7	Confident	42 Å²	42	71.4 Å²	71.4	29%	0.294	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-51.6	-38	179.1	-139.1	0	0	0	0	113.3	E90 F91 D159	S88-E90 PolarHBondContact O-N 2.83Å; S88-F91 PolarHBondContact O-N 3.12Å; S88-F91 VanDerWaalsContact O-O 3.09Å; S88-D159 VanDerWaalsContact CA-O 3.31Å; S88-D159 WeakPolarHBondContact CA-O 3.44Å; S88-D159 WeakPolarHBondContact CB-O 3.4Å; S88-D159 PolarHBondContact N-O 3.1Å; S88-D159 PolarHBondContact OG-O 3.47Å
89	S	84.9	Confident	76.5	Confident	101 Å²	101	68.6 Å²	68.6	71%	0.706	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-64.8	-19.5	-177.5	62.1	0	0	0	0	113.2	D87 F91	D87-S89 PolarHBondContact O-N 3.2Å; D87-S89 VanDerWaalsContact O-N 3.11Å; S89-F91 PolarHBondContact O-N 3.43Å
90	E	86.8	Confident	77.2	Confident	36 Å²	36	64.5 Å²	64.5	17%	0.168	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	-79.7	-7.8	176.3	-58.4	-157.7	-104	0	0	113.2	D87 S88 H110 V111 K112	D87-E90 WeakPolarHBondContact O-CB 3.31Å; D87-E90 PolarHBondContact O-N 3.01Å; S88-E90 PolarHBondContact O-N 2.83Å; E90-H110 CarbonylContact O-C 3.33Å; E90-H110 WeakPolarHBondContact O-CA 3.49Å; E90-H110 PolarHBondContact O-ND1 2.87Å; E90-H110 VanDerWaalsContact O-ND1 3.1Å; E90-H110 IonicContact OE2-CE1 2.58Å; E90-V111 WeakPolarHBondContact O-CG2 3.43Å; E90-V111 PolarHBondContact O-N 3.42Å; E90-K112 IonicContact OE2-NZ 3.16Å; E90-K112 PolarHBondContact OE2-NZ 2.73Å
91	F	89.7	Confident	77.2	Confident	9 Å²	9	65.9 Å²	65.9	4%	0.039	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.9	-178	-56.1	-64.3	0	0	0	111.7	F86 D87 S88 S89 W94 V108 R109 H110 L117 I119 C157 V164	F86-F91 HydrophobicContact CB-CE2 3.41Å; F86-F91 VanDerWaalsContact CB-CE2 3.41Å; F86-F91 HydrophobicContact CB-CZ 3.43Å; F86-F91 VanDerWaalsContact CB-CZ 3.43Å; F86-F91 HydrophobicContact CD1-CE1 4.34Å; F86-F91 HydrophobicContact CD1-CE2 4.44Å; F86-F91 AromaticContact CD1-CZ 3.67Å; F86-F91 HydrophobicContact CD1-CZ 3.67Å; F86-F91 HydrophobicContact CD2-CZ 4.26Å; F86-F91 HydrophobicContact CE1-CZ 4.44Å; F86-F91 HydrophobicContact CG-CE2 4.09Å; F86-F91 AromaticContact CG-CZ 3.55Å; F86-F91 HydrophobicContact CG-CZ 3.55Å; D87-F91 WeakPolarHBondContact O-CD2 3.39Å; S88-F91 PolarHBondContact O-N 3.12Å; S88-F91 VanDerWaalsContact O-O 3.09Å; S89-F91 PolarHBondContact O-N 3.43Å; F91-W94 HydrophobicContact CB-CZ2 3.95Å; F91-W94 HydrophobicContact CD2-CZ2 4.16Å; F91-W94 HydrophobicContact CG-CZ2 4.41Å; F91-W94 PolarHBondContact O-NE1 3.19Å; F91-V108 HydrophobicContact CB-CB 4.15Å; F91-V108 HydrophobicContact CB-CG2 4.34Å; F91-V108 HydrophobicContact CD1-CB 4.41Å; F91-V108 HydrophobicContact CD1-CG2 3.72Å; F91-V108 HydrophobicContact CE1-CG2 4.32Å; F91-V108 HydrophobicContact CG-CB 4.49Å; F91-V108 HydrophobicContact CG-CG2 4.15Å; F91-R109 WeakPolarHBondContact CA-O 3.28Å; F91-H110 HydrophobicContact CD1-CB 4.25Å; F91-H110 HydrophobicContact CE1-CB 4.29Å; F91-L117 HydrophobicContact CE1-CD1 4.04Å; F91-I119 HydrophobicContact CD1-CD1 4.28Å; F91-I119 HydrophobicContact CD2-CD1 3.74Å; F91-I119 HydrophobicContact CE1-CD1 4.3Å; F91-I119 HydrophobicContact CE2-CD1 3.72Å; F91-I119 HydrophobicContact CG-CD1 4.01Å; F91-I119 HydrophobicContact CZ-CD1 4.01Å; F91-C157 HydrophobicContact CE2-CB 4.26Å; F91-V164 HydrophobicContact CE1-CG1 4.43Å; F91-V164 HydrophobicContact CZ-CG1 4.23Å; F91-V164 HydrophobicContact CZ-CG2 4.08Å
92	G	84.8	Confident	77	Confident	20 Å²	20	68.7 Å²	68.7	21%	0.206	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	170.1	167.9	0	0	0	0	0	111.7	R109	G92-R109 PolarHBondContact N-O 3.35Å; G92-R109 PolarHBondContact O-N 2.79Å
93	N	83.5	Confident	77.2	Confident	110 Å²	110	62 Å²	62	59%	0.588	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	57.5	54.1	168.5	-60.9	58.4	0	0	0	113.9	E95 R109 W116	N93-E95 PolarHBondContact O-N 3.1Å; N93-E95 VanDerWaalsContact O-N 3.13Å; N93-R109 HydrophobicContact CB-CB 4.33Å; N93-W116 HydrophobicContact CB-CH2 4.04Å; N93-W116 HydrophobicContact CB-CZ3 4.1Å
94	W	88.8	Confident	77.4	Confident	83 Å²	83	64.1 Å²	64.1	31%	0.314	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	106.8	175	-69.8	75.8	0	0	0	111	F91 Y106 V108 I119 P160	F91-W94 HydrophobicContact CB-CZ2 3.95Å; F91-W94 HydrophobicContact CD2-CZ2 4.16Å; F91-W94 HydrophobicContact CG-CZ2 4.41Å; F91-W94 PolarHBondContact O-NE1 3.19Å; W94-Y106 AromaticContact CE3-CD1 3.98Å; W94-Y106 HydrophobicContact CE3-CD1 3.98Å; W94-Y106 HydrophobicContact CE3-CD2 4.28Å; W94-Y106 AromaticContact CE3-CG 3.74Å; W94-Y106 HydrophobicContact CE3-CG 3.74Å; W94-Y106 HydrophobicContact CZ3-CD2 4.2Å; W94-Y106 HydrophobicContact CZ3-CG 4.08Å; W94-V108 HydrophobicContact CD2-CG1 3.54Å; W94-V108 HydrophobicContact CE3-CG1 3.62Å; W94-V108 HydrophobicContact CG-CG1 3.99Å; W94-V108 HydrophobicContact CH2-CG1 4.29Å; W94-V108 HydrophobicContact CZ2-CG1 4.25Å; W94-V108 HydrophobicContact CZ3-CG1 4Å; W94-I119 HydrophobicContact CH2-CD1 3.56Å; W94-I119 HydrophobicContact CH2-CG2 4.45Å; W94-I119 HydrophobicContact CZ2-CD1 4.06Å; W94-I119 HydrophobicContact CZ3-CB 4.41Å; W94-I119 HydrophobicContact CZ3-CD1 4.15Å; W94-I119 HydrophobicContact CZ3-CG2 4.46Å; W94-P160 VanDerWaalsContact CH2-CD 3.41Å; W94-P160 HydrophobicContact CH2-CG 3.51Å; W94-P160 HydrophobicContact CZ2-CG 4.47Å; W94-P160 HydrophobicContact CZ3-CG 3.6Å
95	E	86.9	Confident	77.4	Confident	106 Å²	106	62.6 Å²	62.6	50%	0.495	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	118.5	177.4	-178	-178	-174.9	0	0	109	N93 I97 Y106 K107	N93-E95 PolarHBondContact O-N 3.1Å; N93-E95 VanDerWaalsContact O-N 3.13Å; E95-I97 HydrophobicContact CG-CG2 4.46Å; E95-I97 PolarHBondContact O-N 3.35Å; E95-Y106 CarbonylContact O-C 3.48Å; E95-Y106 WeakPolarHBondContact O-CA 3.31Å; E95-K107 HydrophobicContact CB-CB 4.32Å; E95-K107 PolarHBondContact N-O 2.98Å; E95-K107 PolarHBondContact O-N 3.27Å; E95-K107 IonicContact OE2-NZ 3.83Å
96	K	85.3	Confident	77.4	Confident	103 Å²	103	61.2 Å²	61.2	45%	0.448	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	112.3	178	-175	176.6	175.8	177.7	0	109.8	Y106	K96-Y106 HydrophobicContact CB-CD1 4.04Å; K96-Y106 HydrophobicContact CB-CE1 3.87Å; K96-Y106 HydrophobicContact CG-CE1 4.2Å
97	I	78	Confident	77.7	Confident	76 Å²	76	62.8 Å²	62.8	39%	0.39	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-17.4	-177.4	58.3	170.7	0	0	0	113.3	E95 V105 K107 Y167	E95-I97 HydrophobicContact CG-CG2 4.46Å; E95-I97 PolarHBondContact O-N 3.35Å; I97-V105 HydrophobicContact CD1-CG1 3.81Å; I97-V105 HydrophobicContact CG1-CB 4.09Å; I97-V105 HydrophobicContact CG1-CG1 3.9Å; I97-V105 VanDerWaalsContact CG1-O 3.29Å; I97-V105 WeakPolarHBondContact CG1-O 3.22Å; I97-V105 PolarHBondContact N-O 3.18Å; I97-K107 HydrophobicContact CD1-CB 4.24Å; I97-K107 HydrophobicContact CG1-CB 4.5Å; I97-K107 HydrophobicContact CG2-CB 3.52Å; I97-K107 HydrophobicContact CG2-CD 4.32Å; I97-Y167 HydrophobicContact CD1-CD2 4.19Å; I97-Y167 HydrophobicContact CD1-CE2 3.78Å
98	G	66.8	Low	78	Confident	27 Å²	27	58.8 Å²	58.8	28%	0.278	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.6	150.8	179.9	0	0	0	0	0	112.9	V105	G98-V105 PolarHBondContact N-O 3.25Å; G98-V105 PolarHBondContact O-N 2.94Å
99	S	63.7	Low	78.4	Confident	87 Å²	87	61.8 Å²	61.8	61%	0.608	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-142.7	130.7	168.3	49.1	0	0	0	0	109.5
100	G	56.2	Low	78.7	Confident	52 Å²	52	57.1 Å²	57.1	54%	0.536	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	-172.7	178.1	0	0	0	0	0	112.1	F102 G103	G100-F102 PolarHBondContact O-N 2.84Å; G100-G103 PolarHBondContact N-O 2.72Å; G100-G103 PolarHBondContact O-N 3.43Å; G100-G103 VanDerWaalsContact O-N 3.13Å
101	G	50.8	Low	78.7	Confident	77 Å²	77	59.6 Å²	59.6	79%	0.794	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-8.7	179.8	0	0	0	0	0	115.2
102	F	51.3	Low	78.5	Confident	112 Å²	112	66.3 Å²	66.3	49%	0.491	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	8.1	-180	-58	-80	0	0	0	113.2	G100	G100-F102 PolarHBondContact O-N 2.84Å
103	G	65.6	Low	78.4	Confident	5 Å²	5	69.7 Å²	69.7	5%	0.052	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	118.4	-166.4	177.7	0	0	0	0	0	114.8	G100 C121	G100-G103 PolarHBondContact N-O 2.72Å; G100-G103 PolarHBondContact O-N 3.43Å; G100-G103 VanDerWaalsContact O-N 3.13Å; G103-C121 CarbonylContact C-O 3.59Å; G103-C121 WeakPolarHBondContact CA-O 3.37Å
104	Q	78.8	Confident	78.5	Confident	63 Å²	63	71.6 Å²	71.6	29%	0.294	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.3	-176.3	-61.4	-179.9	-5.3	0	0	109.2	Y106 C121	Q104-Y106 HydrophobicContact CB-CD2 4.42Å; Q104-Y106 HydrophobicContact CB-CE2 3.64Å; Q104-Y106 PolarHBondContact OE1-OH 3.35Å; Q104-C121 PolarHBondContact N-O 3.34Å; Q104-C121 PolarHBondContact O-N 2.95Å
105	V	82.7	Confident	78.4	Confident	39 Å²	39	70.7 Å²	70.7	24%	0.236	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126.6	178.4	-169.9	0	0	0	0	108.9	I97 G98 A118 I119 K120	I97-V105 HydrophobicContact CD1-CG1 3.81Å; I97-V105 HydrophobicContact CG1-CB 4.09Å; I97-V105 HydrophobicContact CG1-CG1 3.9Å; I97-V105 VanDerWaalsContact CG1-O 3.29Å; I97-V105 WeakPolarHBondContact CG1-O 3.22Å; I97-V105 PolarHBondContact N-O 3.18Å; G98-V105 PolarHBondContact N-O 3.25Å; G98-V105 PolarHBondContact O-N 2.94Å; V105-A118 HydrophobicContact CG1-CB 4.28Å; V105-I119 CarbonylContact C-O 3.58Å; V105-I119 WeakPolarHBondContact CA-O 3.08Å; V105-K120 HydrophobicContact CG2-CB 4.33Å; V105-K120 HydrophobicContact CG2-CG 4.19Å
106	Y	86.2	Confident	78.5	Confident	50 Å²	50	70.5 Å²	70.5	20%	0.196	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	131.3	179.5	-65.1	-87.8	0	0	0	109.7	W94 E95 K96 Q104 A118 I119 C121	W94-Y106 AromaticContact CE3-CD1 3.98Å; W94-Y106 HydrophobicContact CE3-CD1 3.98Å; W94-Y106 HydrophobicContact CE3-CD2 4.28Å; W94-Y106 AromaticContact CE3-CG 3.74Å; W94-Y106 HydrophobicContact CE3-CG 3.74Å; W94-Y106 HydrophobicContact CZ3-CD2 4.2Å; W94-Y106 HydrophobicContact CZ3-CG 4.08Å; E95-Y106 CarbonylContact O-C 3.48Å; E95-Y106 WeakPolarHBondContact O-CA 3.31Å; K96-Y106 HydrophobicContact CB-CD1 4.04Å; K96-Y106 HydrophobicContact CB-CE1 3.87Å; K96-Y106 HydrophobicContact CG-CE1 4.2Å; Q104-Y106 HydrophobicContact CB-CD2 4.42Å; Q104-Y106 HydrophobicContact CB-CE2 3.64Å; Q104-Y106 PolarHBondContact OE1-OH 3.35Å; Y106-A118 CarbonylContact O-C 3.54Å; Y106-A118 WeakPolarHBondContact O-CA 3.47Å; Y106-I119 PolarHBondContact N-O 3.45Å; Y106-I119 PolarHBondContact O-N 2.82Å; Y106-C121 HydrophobicContact CE2-CB 4.29Å
107	K	91.4	Very high	78.8	Confident	37 Å²	37	65.8 Å²	65.8	16%	0.161	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	126.4	161.4	176	-175.7	179.4	-174.2	0	107.3	E95 I97 W116 L117 Y167	E95-K107 HydrophobicContact CB-CB 4.32Å; E95-K107 PolarHBondContact N-O 2.98Å; E95-K107 PolarHBondContact O-N 3.27Å; E95-K107 IonicContact OE2-NZ 3.83Å; I97-K107 HydrophobicContact CD1-CB 4.24Å; I97-K107 HydrophobicContact CG1-CB 4.5Å; I97-K107 HydrophobicContact CG2-CB 3.52Å; I97-K107 HydrophobicContact CG2-CD 4.32Å; K107-W116 HydrophobicContact CD-CE3 4.07Å; K107-W116 HydrophobicContact CD-CZ3 4.26Å; K107-W116 VanDerWaalsContact CE-CE3 3.48Å; K107-W116 HydrophobicContact CG-CD2 4.44Å; K107-W116 HydrophobicContact CG-CE3 3.59Å; K107-W116 HydrophobicContact CG-CZ3 3.96Å; K107-L117 WeakPolarHBondContact CA-O 3.38Å; K107-Y167 HydrophobicContact CB-CD2 4.35Å; K107-Y167 HydrophobicContact CB-CE2 4.09Å; K107-Y167 HydrophobicContact CD-CD2 4.48Å; K107-Y167 HydrophobicContact CD-CE1 4.19Å; K107-Y167 HydrophobicContact CD-CE2 3.84Å; K107-Y167 HydrophobicContact CG-CD2 4.1Å; K107-Y167 HydrophobicContact CG-CE2 3.91Å
108	V	91.9	Very high	79.4	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	153.8	-178.7	-57.7	0	0	0	0	109.8	F91 W94 W116 L117 I119	F91-V108 HydrophobicContact CB-CB 4.15Å; F91-V108 HydrophobicContact CB-CG2 4.34Å; F91-V108 HydrophobicContact CD1-CB 4.41Å; F91-V108 HydrophobicContact CD1-CG2 3.72Å; F91-V108 HydrophobicContact CE1-CG2 4.32Å; F91-V108 HydrophobicContact CG-CB 4.49Å; F91-V108 HydrophobicContact CG-CG2 4.15Å; W94-V108 HydrophobicContact CD2-CG1 3.54Å; W94-V108 HydrophobicContact CE3-CG1 3.62Å; W94-V108 HydrophobicContact CG-CG1 3.99Å; W94-V108 HydrophobicContact CH2-CG1 4.29Å; W94-V108 HydrophobicContact CZ2-CG1 4.25Å; W94-V108 HydrophobicContact CZ3-CG1 4Å; V108-W116 WeakPolarHBondContact O-CA 3.42Å; V108-L117 HydrophobicContact CG2-CB 3.99Å; V108-L117 PolarHBondContact N-O 3.31Å; V108-L117 PolarHBondContact O-N 3.05Å; V108-I119 HydrophobicContact CB-CD1 4.41Å; V108-I119 HydrophobicContact CG1-CD1 4.02Å; V108-I119 HydrophobicContact CG1-CG1 4.23Å; V108-I119 HydrophobicContact CG2-CD1 3.66Å; V108-I119 HydrophobicContact CG2-CG1 3.67Å
109	R	91.4	Very high	80.4	Confident	105 Å²	105	61.2 Å²	61.2	40%	0.396	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	117.7	173.6	-169	177.3	-176	-168.8	1.7	109.2	F91 G92 N93 V111 T115 W116	F91-R109 WeakPolarHBondContact CA-O 3.28Å; G92-R109 PolarHBondContact N-O 3.35Å; G92-R109 PolarHBondContact O-N 2.79Å; N93-R109 HydrophobicContact CB-CB 4.33Å; R109-V111 PolarHBondContact O-N 3.32Å; R109-T115 WeakPolarHBondContact CA-O 3.34Å; R109-W116 HydrophobicContact CB-CD2 4.36Å; R109-W116 HydrophobicContact CB-CE3 3.89Å; R109-W116 HydrophobicContact CB-CH2 4.14Å; R109-W116 HydrophobicContact CB-CZ3 3.78Å
110	H	91.4	Very high	81.4	Confident	2 Å²	2	58.1 Å²	58.1	1%	0.009	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	123.1	174.1	-168.4	-23.1	0	0	0	109.5	F86 E90 F91 K112 W113 K114 T115 L117	F86-H110 AromaticContact CD1-NE2 3.9Å; F86-H110 AromaticContact CE1-CD2 3.92Å; F86-H110 AromaticContact CE1-NE2 3.59Å; E90-H110 CarbonylContact O-C 3.33Å; E90-H110 WeakPolarHBondContact O-CA 3.49Å; E90-H110 PolarHBondContact O-ND1 2.87Å; E90-H110 VanDerWaalsContact O-ND1 3.1Å; E90-H110 IonicContact OE2-CE1 2.58Å; F91-H110 HydrophobicContact CD1-CB 4.25Å; F91-H110 HydrophobicContact CE1-CB 4.29Å; H110-K112 PolarHBondContact ND1-N 2.95Å; H110-K112 PolarHBondContact O-N 3.3Å; H110-W113 HydrophobicContact CB-CB 4.14Å; H110-W113 AromaticContact CD2-CD2 3.29Å; H110-W113 AromaticContact CD2-CE2 3.7Å; H110-W113 AromaticContact CD2-CE3 3.41Å; H110-W113 VanDerWaalsContact CD2-CE3 3.41Å; H110-W113 AromaticContact CD2-CG 3.68Å; H110-W113 AromaticContact CD2-CZ3 3.93Å; H110-W113 AromaticContact CG-CG 3.93Å; H110-W113 AromaticContact NE2-CD1 3.99Å; H110-W113 AromaticContact NE2-CD2 3.58Å; H110-W113 AromaticContact NE2-CE2 3.46Å; H110-W113 AromaticContact NE2-CG 3.91Å; H110-W113 AromaticContact NE2-CZ2 3.88Å; H110-W113 AromaticContact NE2-NE1 3.69Å; H110-K114 VanDerWaalsContact O-CA 3.26Å; H110-K114 WeakPolarHBondContact O-CA 3.39Å; H110-K114 PolarHBondContact O-N 3.12Å; H110-T115 PolarHBondContact N-O 3.33Å; H110-L117 HydrophobicContact CB-CD1 3.94Å
111	V	87.2	Confident	82.6	Confident	88 Å²	88	56 Å²	56	53%	0.533	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-46.6	-174.1	177	0	0	0	0	112	E90 R109	E90-V111 WeakPolarHBondContact O-CG2 3.43Å; E90-V111 PolarHBondContact O-N 3.42Å; R109-V111 PolarHBondContact O-N 3.32Å
112	K	84.9	Confident	83.5	Confident	150 Å²	150	53.7 Å²	53.7	65%	0.652	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-46.5	-178.5	-65.4	173.8	-173.7	153.3	0	112.3	E90 H110 K114	E90-K112 IonicContact OE2-NZ 3.16Å; E90-K112 PolarHBondContact OE2-NZ 2.73Å; H110-K112 PolarHBondContact ND1-N 2.95Å; H110-K112 PolarHBondContact O-N 3.3Å; K112-K114 VanDerWaalsContact C-N 3.32Å
113	W	84.5	Confident	83.9	Confident	92 Å²	92	53 Å²	53	35%	0.348	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-19.1	-175.2	-57.8	-6.8	0	0	0	112.8	K84 F86 H110 T115 L117	K84-W113 HydrophobicContact CD-CZ2 4.37Å; F86-W113 AromaticContact CE1-CH2 3.7Å; F86-W113 HydrophobicContact CE1-CH2 3.7Å; F86-W113 AromaticContact CE1-CZ2 3.96Å; F86-W113 HydrophobicContact CE1-CZ2 3.96Å; F86-W113 HydrophobicContact CE1-CZ3 4.28Å; F86-W113 AromaticContact CZ-CH2 3.59Å; F86-W113 HydrophobicContact CZ-CH2 3.59Å; F86-W113 HydrophobicContact CZ-CZ2 4.25Å; F86-W113 HydrophobicContact CZ-CZ3 4.16Å; H110-W113 HydrophobicContact CB-CB 4.14Å; H110-W113 AromaticContact CD2-CD2 3.29Å; H110-W113 AromaticContact CD2-CE2 3.7Å; H110-W113 AromaticContact CD2-CE3 3.41Å; H110-W113 VanDerWaalsContact CD2-CE3 3.41Å; H110-W113 AromaticContact CD2-CG 3.68Å; H110-W113 AromaticContact CD2-CZ3 3.93Å; H110-W113 AromaticContact CG-CG 3.93Å; H110-W113 AromaticContact NE2-CD1 3.99Å; H110-W113 AromaticContact NE2-CD2 3.58Å; H110-W113 AromaticContact NE2-CE2 3.46Å; H110-W113 AromaticContact NE2-CG 3.91Å; H110-W113 AromaticContact NE2-CZ2 3.88Å; H110-W113 AromaticContact NE2-NE1 3.69Å; W113-T115 HydrophobicContact CB-CG2 4.47Å; W113-T115 WeakPolarHBondContact CB-OG1 3.43Å; W113-T115 PolarHBondContact O-N 3.31Å; W113-T115 VanDerWaalsContact O-N 3.14Å; W113-L117 HydrophobicContact CE3-CD1 4.28Å; W113-L117 HydrophobicContact CZ3-CD1 4.32Å
114	K	83.7	Confident	83.4	Confident	149 Å²	149	55.8 Å²	55.8	65%	0.648	27%	0.273	S	S	*	.			trans	58.4	17.6	-176	-55	-176	179.6	-176.9	0	113.7	H110 K112	H110-K114 VanDerWaalsContact O-CA 3.26Å; H110-K114 WeakPolarHBondContact O-CA 3.39Å; H110-K114 PolarHBondContact O-N 3.12Å; K112-K114 VanDerWaalsContact C-N 3.32Å
115	T	87.1	Confident	82.2	Confident	65 Å²	65	60.3 Å²	60.3	40%	0.399	30%	0.298	S	S	.	.			trans	-98.2	152.5	178.2	51.8	0	0	0	0	111.4	R109 H110 W113	R109-T115 WeakPolarHBondContact CA-O 3.34Å; H110-T115 PolarHBondContact N-O 3.33Å; W113-T115 HydrophobicContact CB-CG2 4.47Å; W113-T115 WeakPolarHBondContact CB-OG1 3.43Å; W113-T115 PolarHBondContact O-N 3.31Å; W113-T115 VanDerWaalsContact O-N 3.14Å
116	W	89.3	Confident	80.9	Confident	101 Å²	101	66.1 Å²	66.1	38%	0.383	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	132.4	170.8	-68.5	106.1	0	0	0	109.8	N93 K107 V108 R109 Y167	N93-W116 HydrophobicContact CB-CH2 4.04Å; N93-W116 HydrophobicContact CB-CZ3 4.1Å; K107-W116 HydrophobicContact CD-CE3 4.07Å; K107-W116 HydrophobicContact CD-CZ3 4.26Å; K107-W116 VanDerWaalsContact CE-CE3 3.48Å; K107-W116 HydrophobicContact CG-CD2 4.44Å; K107-W116 HydrophobicContact CG-CE3 3.59Å; K107-W116 HydrophobicContact CG-CZ3 3.96Å; V108-W116 WeakPolarHBondContact O-CA 3.42Å; R109-W116 HydrophobicContact CB-CD2 4.36Å; R109-W116 HydrophobicContact CB-CE3 3.89Å; R109-W116 HydrophobicContact CB-CH2 4.14Å; R109-W116 HydrophobicContact CB-CZ3 3.78Å; W116-Y167 HydrophobicContact CB-CD1 4.05Å; W116-Y167 HydrophobicContact CB-CG 4.35Å
117	L	91.8	Very high	79.6	Confident	4 Å²	4	65.5 Å²	65.5	2%	0.021	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	160	178.9	-61.1	177.1	0	0	0	109.2	F91 K107 V108 H110 W113 Y154 V164	F91-L117 HydrophobicContact CE1-CD1 4.04Å; K107-L117 WeakPolarHBondContact CA-O 3.38Å; V108-L117 HydrophobicContact CG2-CB 3.99Å; V108-L117 PolarHBondContact N-O 3.31Å; V108-L117 PolarHBondContact O-N 3.05Å; H110-L117 HydrophobicContact CB-CD1 3.94Å; W113-L117 HydrophobicContact CE3-CD1 4.28Å; W113-L117 HydrophobicContact CZ3-CD1 4.32Å; L117-Y154 HydrophobicContact CD2-CD2 3.63Å; L117-Y154 HydrophobicContact CD2-CE2 3.38Å; L117-V164 HydrophobicContact CB-CG1 4.36Å; L117-V164 HydrophobicContact CD1-CG1 3.82Å
118	A	89.9	Confident	78.4	Confident	7 Å²	7	69.4 Å²	69.4	6%	0.058	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	130.5	170.6	0	0	0	0	0	109.2	V105 Y106 M165 Y167	V105-A118 HydrophobicContact CG1-CB 4.28Å; Y106-A118 CarbonylContact O-C 3.54Å; Y106-A118 WeakPolarHBondContact O-CA 3.47Å; A118-M165 PolarHBondContact N-O 3.21Å; A118-M165 PolarHBondContact O-N 3.4Å; A118-Y167 HydrophobicContact CB-CD2 4.43Å
119	I	88.6	Confident	77.2	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	117.7	170.4	-58.5	-175.3	0	0	0	108.1	F91 W94 V105 Y106 V108 C157 L163 V164	F91-I119 HydrophobicContact CD1-CD1 4.28Å; F91-I119 HydrophobicContact CD2-CD1 3.74Å; F91-I119 HydrophobicContact CE1-CD1 4.3Å; F91-I119 HydrophobicContact CE2-CD1 3.72Å; F91-I119 HydrophobicContact CG-CD1 4.01Å; F91-I119 HydrophobicContact CZ-CD1 4.01Å; W94-I119 HydrophobicContact CH2-CD1 3.56Å; W94-I119 HydrophobicContact CH2-CG2 4.45Å; W94-I119 HydrophobicContact CZ2-CD1 4.06Å; W94-I119 HydrophobicContact CZ3-CB 4.41Å; W94-I119 HydrophobicContact CZ3-CD1 4.15Å; W94-I119 HydrophobicContact CZ3-CG2 4.46Å; V105-I119 CarbonylContact C-O 3.58Å; V105-I119 WeakPolarHBondContact CA-O 3.08Å; Y106-I119 PolarHBondContact N-O 3.45Å; Y106-I119 PolarHBondContact O-N 2.82Å; V108-I119 HydrophobicContact CB-CD1 4.41Å; V108-I119 HydrophobicContact CG1-CD1 4.02Å; V108-I119 HydrophobicContact CG1-CG1 4.23Å; V108-I119 HydrophobicContact CG2-CD1 3.66Å; V108-I119 HydrophobicContact CG2-CG1 3.67Å; I119-C157 HydrophobicContact CD1-CB 4.26Å; I119-C157 HydrophobicContact CG2-CB 4.37Å; I119-L163 WeakPolarHBondContact CA-O 3.47Å; I119-V164 HydrophobicContact CD1-CG2 4.29Å; I119-V164 HydrophobicContact CG1-CG2 4.17Å
120	K	84.8	Confident	76	Confident	23 Å²	23	77.1 Å²	77.1	10%	0.1	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	105	173	-180	-177.9	176.7	-167.4	0	108.8	V105 E138 G162 L163 M165 D230	V105-K120 HydrophobicContact CG2-CB 4.33Å; V105-K120 HydrophobicContact CG2-CG 4.19Å; K120-E138 IonicContact NZ-OE1 3.42Å; K120-G162 CarbonylContact O-C 3.52Å; K120-G162 WeakPolarHBondContact O-CA 3.47Å; K120-L163 PolarHBondContact N-O 2.87Å; K120-L163 PolarHBondContact O-N 3.48Å; K120-M165 HydrophobicContact CB-CE 3.57Å; K120-M165 HydrophobicContact CD-CE 4.28Å; K120-D230 IonicContact NZ-OD1 2.69Å; K120-D230 PolarHBondContact NZ-OD1 2.81Å; K120-D230 IonicContact NZ-OD2 3.84Å
121	C	80.4	Confident	74.8	Confident	8 Å²	8	80 Å²	80	5%	0.054	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	139.9	174.6	-60.4	0	0	0	0	109.5	G103 Q104 Y106	G103-C121 CarbonylContact C-O 3.59Å; G103-C121 WeakPolarHBondContact CA-O 3.37Å; Q104-C121 PolarHBondContact N-O 3.34Å; Q104-C121 PolarHBondContact O-N 2.95Å; Y106-C121 HydrophobicContact CE2-CB 4.29Å
122	P	69.6	Low	73.9	Confident	28 Å²	28	79.8 Å²	79.8	18%	0.182	39%	0.389	C	S	.	.			trans	-63.7	164	173.1	21.8	-22.3	0	0	0	111.7	C124 L127 Q161	P122-C124 PolarHBondContact O-N 3.07Å; P122-C124 VanDerWaalsContact O-N 3.16Å; P122-L127 HydrophobicContact CB-CD1 4.47Å; P122-L127 HydrophobicContact CB-CD2 3.62Å; P122-L127 HydrophobicContact CG-CD1 3.33Å; P122-L127 HydrophobicContact CG-CD2 3.29Å; P122-L127 HydrophobicContact CG-CG 3.72Å; P122-Q161 WeakPolarHBondContact CD-O 3.31Å
123	P	60.2	Low	73.1	Confident	96 Å²	96	75.5 Å²	75.5	62%	0.623	38%	0.378	S	S	*	.	S	Bend	trans	-69	-11.1	-172.8	24.4	-31.9	0	0	0	114.9
124	C	56.5	Low	72.4	Confident	65 Å²	65	73.6 Å²	73.6	44%	0.439	37%	0.373	S	S	.	.			trans	-116.3	133	179	-175	0	0	0	0	110.4	P122 H126	P122-C124 PolarHBondContact O-N 3.07Å; P122-C124 VanDerWaalsContact O-N 3.16Å; C124-H126 PolarHBondContact O-N 3.17Å; C124-H126 PolarHBondContact SG-N 3.36Å; C124-H126 VanDerWaalsContact SG-N 3.39Å; C124-H126 PolarHBondContact SG-O 3.01Å
125	L	52	Low	71.9	Confident	158 Å²	158	67.4 Å²	67.4	83%	0.827	35%	0.347	S	S	*	.	S	Bend	trans	-72.9	-15	175.5	-71.6	166.2	0	0	0	113
126	H	56.3	Low	71.3	Confident	160 Å²	160	65.6 Å²	65.6	74%	0.741	33%	0.334	S	S	*	.	S	Bend	trans	-114.3	102.2	172.6	-73.8	-65.6	0	0	0	109.4	C124	C124-H126 PolarHBondContact O-N 3.17Å; C124-H126 PolarHBondContact SG-N 3.36Å; C124-H126 VanDerWaalsContact SG-N 3.39Å; C124-H126 PolarHBondContact SG-O 3.01Å
127	L	59.3	Low	70.5	Confident	37 Å²	37	63.5 Å²	63.5	19%	0.194	33%	0.329	C	S	.	.			trans	-85.5	131.1	174.4	-66.2	171.1	0	0	0	109.6	P122 D131 Q161	P122-L127 HydrophobicContact CB-CD1 4.47Å; P122-L127 HydrophobicContact CB-CD2 3.62Å; P122-L127 HydrophobicContact CG-CD1 3.33Å; P122-L127 HydrophobicContact CG-CD2 3.29Å; P122-L127 HydrophobicContact CG-CG 3.72Å; L127-D131 HydrophobicContact CB-CB 4.06Å; L127-D131 HydrophobicContact CD2-CB 3.63Å; L127-D131 HydrophobicContact CG-CB 4.35Å; L127-Q161 HydrophobicContact CD1-CB 3.81Å; L127-Q161 HydrophobicContact CD1-CG 3.71Å
128	D	65.2	Low	69.8	Low	119 Å²	119	64.4 Å²	64.4	64%	0.636	33%	0.333	S	S	*	.			trans	-67.7	158.7	166	-67.8	-28.7	0	0	0	109	K130 D131 R132	D128-K130 PolarHBondContact O-N 3.29Å; D128-D131 PolarHBondContact O-N 3.35Å; D128-R132 PolarHBondContact O-N 3.02Å; D128-R132 VanDerWaalsContact O-N 3.08Å
129	E	66.9	Low	69.2	Low	149 Å²	149	64 Å²	64	70%	0.696	33%	0.33	S	S	*	.	H	α-helix	trans	-56.3	-28.2	-178.4	-170.5	160.4	-149	0	0	113	R132 S133	E129-R132 IonicContact OE1-NH2 3.52Å; E129-S133 PolarHBondContact O-N 2.97Å
130	K	66	Low	68.6	Low	118 Å²	118	69.9 Å²	69.9	51%	0.513	35%	0.352	S	S	.	.	H	α-helix	trans	-66.3	-50.8	172.8	-173	179.8	176.9	-176.3	0	112.9	D128 R132 S133 E134	D128-K130 PolarHBondContact O-N 3.29Å; K130-R132 PolarHBondContact O-N 2.82Å; K130-S133 WeakPolarHBondContact O-CB 3.34Å; K130-S133 PolarHBondContact O-N 3.4Å; K130-S133 VanDerWaalsContact O-N 3.07Å; K130-S133 PolarHBondContact O-OG 2.94Å; K130-E134 WeakPolarHBondContact CE-OE1 3.41Å; K130-E134 WeakPolarHBondContact O-CG 3.21Å; K130-E134 PolarHBondContact O-N 3.14Å
131	D	66.1	Low	68	Low	64 Å²	64	70.9 Å²	70.9	34%	0.342	36%	0.357	S	S	.	.	H	α-helix	trans	-63.2	-35.3	179.2	-66.1	-22	0	0	0	111.1	L127 D128 E134 L135	L127-D131 HydrophobicContact CB-CB 4.06Å; L127-D131 HydrophobicContact CD2-CB 3.63Å; L127-D131 HydrophobicContact CG-CB 4.35Å; D128-D131 PolarHBondContact O-N 3.35Å; D131-E134 PolarHBondContact O-N 3.44Å; D131-L135 PolarHBondContact O-N 3.45Å
132	R	69.5	Low	67.8	Low	82 Å²	82	71 Å²	71	31%	0.309	36%	0.357	S	S	.	.	H	α-helix	trans	-60.5	-48.6	171.3	179.2	177.2	79.5	75.6	2	111.2	D128 E129 K130 E134 L135 L136	D128-R132 PolarHBondContact O-N 3.02Å; D128-R132 VanDerWaalsContact O-N 3.08Å; E129-R132 IonicContact OE1-NH2 3.52Å; K130-R132 PolarHBondContact O-N 2.82Å; R132-E134 VanDerWaalsContact C-N 3.29Å; R132-E134 PolarHBondContact O-N 3.14Å; R132-L135 PolarHBondContact O-N 3.24Å; R132-L136 HydrophobicContact CG-CD1 3.82Å; R132-L136 WeakPolarHBondContact O-CD1 3.5Å; R132-L136 PolarHBondContact O-N 3.46Å
133	S	67.8	Low	68.2	Low	61 Å²	61	71.1 Å²	71.1	43%	0.427	36%	0.355	S	S	.	.	H	α-helix	trans	-61.6	-36.4	178.6	78.4	0	0	0	0	112.8	E129 K130 L136 E137	E129-S133 PolarHBondContact O-N 2.97Å; K130-S133 WeakPolarHBondContact O-CB 3.34Å; K130-S133 PolarHBondContact O-N 3.4Å; K130-S133 VanDerWaalsContact O-N 3.07Å; K130-S133 PolarHBondContact O-OG 2.94Å; S133-L136 PolarHBondContact O-N 3.19Å; S133-E137 WeakPolarHBondContact O-CB 3.28Å; S133-E137 PolarHBondContact O-N 3.35Å
134	E	70.3	Confident	68.9	Low	52 Å²	52	70.3 Å²	70.3	24%	0.243	36%	0.356	C	S	.	.	H	α-helix	trans	-67.8	-42.2	177.9	-71.9	-179.5	-167.5	0	0	111.3	K130 D131 R132 E137 E138 A234	K130-E134 WeakPolarHBondContact CE-OE1 3.41Å; K130-E134 WeakPolarHBondContact O-CG 3.21Å; K130-E134 PolarHBondContact O-N 3.14Å; D131-E134 PolarHBondContact O-N 3.44Å; R132-E134 VanDerWaalsContact C-N 3.29Å; R132-E134 PolarHBondContact O-N 3.14Å; E134-E137 PolarHBondContact O-N 3.09Å; E134-E138 WeakPolarHBondContact O-CB 3.42Å; E134-E138 PolarHBondContact O-N 2.96Å; E134-A234 HydrophobicContact CB-CB 4.28Å
135	L	73	Confident	69.9	Low	19 Å²	19	67.2 Å²	67.2	10%	0.099	34%	0.335	C	S	.	.	H	α-helix	trans	-62.8	-42.2	175.2	-167.2	73.7	0	0	0	111.9	D131 R132 E138 A139 I156 Q161 L163	D131-L135 PolarHBondContact O-N 3.45Å; R132-L135 PolarHBondContact O-N 3.24Å; L135-E138 PolarHBondContact O-N 3.02Å; L135-A139 WeakPolarHBondContact O-CB 3.47Å; L135-A139 PolarHBondContact O-N 3Å; L135-I156 HydrophobicContact CD2-CG2 4.32Å; L135-Q161 HydrophobicContact CD2-CG 3.85Å; L135-L163 HydrophobicContact CD1-CD1 3.8Å; L135-L163 HydrophobicContact CD1-CD2 4.34Å; L135-L163 HydrophobicContact CD1-CG 3.63Å; L135-L163 HydrophobicContact CG-CD2 4.34Å; L135-L163 HydrophobicContact CG-CG 4.11Å
136	L	73.8	Confident	71.3	Confident	26 Å²	26	66.2 Å²	66.2	14%	0.136	32%	0.324	C	S	.	.	H	α-helix	trans	-64.1	-42.8	176.9	-93.8	75.4	0	0	0	111.6	M80 R132 S133 A139 R140 I156	M80-L136 HydrophobicContact CE-CD2 3.86Å; M80-L136 HydrophobicContact CE-CG 3.72Å; M80-L136 HydrophobicContact SD-CD2 3.4Å; M80-L136 WeakPolarHBondContact SD-CD2 3.41Å; M80-L136 HydrophobicContact SD-CG 3.85Å; R132-L136 HydrophobicContact CG-CD1 3.82Å; R132-L136 WeakPolarHBondContact O-CD1 3.5Å; R132-L136 PolarHBondContact O-N 3.46Å; S133-L136 PolarHBondContact O-N 3.19Å; L136-A139 WeakPolarHBondContact O-CB 3.27Å; L136-A139 PolarHBondContact O-N 3.34Å; L136-R140 PolarHBondContact O-N 2.93Å; L136-I156 HydrophobicContact CD1-CD1 3.79Å; L136-I156 HydrophobicContact CG-CD1 3.81Å
137	E	73	Confident	72.9	Confident	57 Å²	57	61.9 Å²	61.9	27%	0.266	30%	0.303	S	S	.	.	H	α-helix	trans	-67.9	-37.3	178.9	-176	61.6	-169.3	0	0	112	S133 E134 R140 K141	S133-E137 WeakPolarHBondContact O-CB 3.28Å; S133-E137 PolarHBondContact O-N 3.35Å; E134-E137 PolarHBondContact O-N 3.09Å; E137-R140 PolarHBondContact O-N 3.07Å; E137-R140 IonicContact OE2-NH1 3.11Å; E137-K141 HydrophobicContact CG-CD 4.45Å; E137-K141 WeakPolarHBondContact O-CG 3.46Å; E137-K141 PolarHBondContact O-N 3.23Å; E137-K141 VanDerWaalsContact O-N 3.08Å; E137-K141 WeakPolarHBondContact OE1-CE 3.21Å; E137-K141 IonicContact OE1-NZ 3.02Å; E137-K141 PolarHBondContact OE1-NZ 3.44Å
138	E	75.8	Confident	74.3	Confident	23 Å²	23	66.9 Å²	66.9	11%	0.107	32%	0.319	C	S	.	.	H	α-helix	trans	-61.1	-47.4	170.1	-173.5	174.7	161.4	0	0	110.7	K120 E134 L135 R140 K141 M142 L163	K120-E138 IonicContact NZ-OE1 3.42Å; E134-E138 WeakPolarHBondContact O-CB 3.42Å; E134-E138 PolarHBondContact O-N 2.96Å; L135-E138 PolarHBondContact O-N 3.02Å; E138-R140 PolarHBondContact O-N 2.78Å; E138-K141 PolarHBondContact O-N 3.45Å; E138-M142 WeakPolarHBondContact O-CB 3.29Å; E138-M142 WeakPolarHBondContact O-CG 3.21Å; E138-M142 PolarHBondContact O-N 3.23Å; E138-L163 HydrophobicContact CG-CD1 4.12Å
139	A	77.6	Confident	75.6	Confident	0 Å²	0	63 Å²	63	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-57.4	-47.1	177.3	0	0	0	0	0	112.1	L83 L135 L136 K141 M142 E143 I156 L163	L83-A139 HydrophobicContact CD1-CB 3.71Å; L135-A139 WeakPolarHBondContact O-CB 3.47Å; L135-A139 PolarHBondContact O-N 3Å; L136-A139 WeakPolarHBondContact O-CB 3.27Å; L136-A139 PolarHBondContact O-N 3.34Å; A139-K141 PolarHBondContact O-N 3.06Å; A139-M142 WeakPolarHBondContact O-CB 3.49Å; A139-M142 PolarHBondContact O-N 3.05Å; A139-E143 PolarHBondContact O-N 3.3Å; A139-I156 HydrophobicContact CB-CD1 3.8Å; A139-I156 HydrophobicContact CB-CG1 4.02Å; A139-L163 HydrophobicContact CB-CD2 3.51Å
140	R	75.9	Confident	76.7	Confident	123 Å²	123	56 Å²	56	46%	0.464	26%	0.264	S	S	.	.	H	α-helix	trans	-62.9	-42.9	-179.3	-177.4	-177.3	-95.3	141.1	-5.8	112	D79 L136 E137 E138 M142 E143 A144	D79-R140 PolarHBondContact O-NH2 2.79Å; L136-R140 PolarHBondContact O-N 2.93Å; E137-R140 PolarHBondContact O-N 3.07Å; E137-R140 IonicContact OE2-NH1 3.11Å; E138-R140 PolarHBondContact O-N 2.78Å; R140-M142 VanDerWaalsContact C-N 3.35Å; R140-E143 WeakPolarHBondContact O-CB 3.39Å; R140-E143 PolarHBondContact O-N 3.37Å; R140-A144 PolarHBondContact O-N 2.88Å; R140-A144 VanDerWaalsContact O-N 3.08Å
141	K	73.8	Confident	77.8	Confident	44 Å²	44	50.7 Å²	50.7	19%	0.191	24%	0.241	C	C	.	.	H	α-helix	trans	-65.2	-39.8	176.4	-74	171.6	179.4	152.9	0	111.8	E137 E138 A139 E143 A144 A145 L208 L233	E137-K141 HydrophobicContact CG-CD 4.45Å; E137-K141 WeakPolarHBondContact O-CG 3.46Å; E137-K141 PolarHBondContact O-N 3.23Å; E137-K141 VanDerWaalsContact O-N 3.08Å; E137-K141 WeakPolarHBondContact OE1-CE 3.21Å; E137-K141 IonicContact OE1-NZ 3.02Å; E137-K141 PolarHBondContact OE1-NZ 3.44Å; E138-K141 PolarHBondContact O-N 3.45Å; A139-K141 PolarHBondContact O-N 3.06Å; K141-E143 VanDerWaalsContact C-N 3.34Å; K141-A144 PolarHBondContact O-N 3.18Å; K141-A145 WeakPolarHBondContact O-CB 3.12Å; K141-A145 PolarHBondContact O-N 3.36Å; K141-A145 VanDerWaalsContact O-N 3.07Å; K141-L208 HydrophobicContact CD-CD1 4.39Å; K141-L233 HydrophobicContact CB-CD1 3.87Å; K141-L233 HydrophobicContact CD-CB 4.28Å; K141-L233 HydrophobicContact CD-CD1 3.95Å; K141-L233 HydrophobicContact CD-CD2 4.19Å; K141-L233 HydrophobicContact CD-CG 4.35Å
142	M	75.7	Confident	78.9	Confident	11 Å²	11	49.6 Å²	49.6	5%	0.054	24%	0.237	C	C	.	.	H	α-helix	trans	-64.9	-37.6	175	-71.2	-62.4	-69.7	0	0	112.6	E138 A139 R140 A144 A145 I150 L151 V153 F231	E138-M142 WeakPolarHBondContact O-CB 3.29Å; E138-M142 WeakPolarHBondContact O-CG 3.21Å; E138-M142 PolarHBondContact O-N 3.23Å; A139-M142 WeakPolarHBondContact O-CB 3.49Å; A139-M142 PolarHBondContact O-N 3.05Å; R140-M142 VanDerWaalsContact C-N 3.35Å; M142-A144 VanDerWaalsContact C-N 3.31Å; M142-A144 PolarHBondContact O-N 3.5Å; M142-A145 PolarHBondContact O-N 2.92Å; M142-I150 HydrophobicContact CE-CG2 4.16Å; M142-L151 WeakPolarHBondContact CE-O 3.29Å; M142-V153 HydrophobicContact CB-CB 4Å; M142-V153 HydrophobicContact CB-CG2 3.5Å; M142-V153 HydrophobicContact CE-CG2 3.59Å; M142-V153 HydrophobicContact CG-CG2 3.82Å; M142-F231 HydrophobicContact CE-CD2 4.21Å; M142-F231 HydrophobicContact CE-CE2 3.72Å; M142-F231 HydrophobicContact SD-CD2 3.2Å; M142-F231 WeakPolarHBondContact SD-CD2 3.19Å; M142-F231 HydrophobicContact SD-CE2 3.22Å; M142-F231 WeakPolarHBondContact SD-CE2 3.46Å
143	E	78.3	Confident	79.7	Confident	30 Å²	30	46.3 Å²	46.3	14%	0.14	23%	0.226	C	C	.	.	H	α-helix	trans	-63.1	-39	173.8	-166.5	-165.9	-178.5	0	0	111.9	L82 L83 A139 R140 K141 A145 K146	L82-E143 WeakPolarHBondContact CA-OE1 3.45Å; L82-E143 WeakPolarHBondContact CB-OE1 3.34Å; L82-E143 PolarHBondContact N-OE1 3.47Å; L83-E143 HydrophobicContact CD1-CB 4.07Å; L83-E143 HydrophobicContact CD2-CB 4.08Å; L83-E143 HydrophobicContact CD2-CG 4.08Å; L83-E143 HydrophobicContact CG-CB 4.04Å; L83-E143 HydrophobicContact CG-CG 3.98Å; A139-E143 PolarHBondContact O-N 3.3Å; R140-E143 WeakPolarHBondContact O-CB 3.39Å; R140-E143 PolarHBondContact O-N 3.37Å; K141-E143 VanDerWaalsContact C-N 3.34Å; E143-A145 VanDerWaalsContact C-N 3.31Å; E143-K146 WeakPolarHBondContact O-CD 3.49Å; E143-K146 WeakPolarHBondContact O-CE 3.49Å; E143-K146 WeakPolarHBondContact O-CG 3.37Å; E143-K146 IonicContact OE1-NZ 2.79Å
144	A	74.7	Confident	80.7	Confident	78 Å²	78	47.3 Å²	47.3	65%	0.645	22%	0.221	S	C	*	.	H	α-helix	trans	-69.5	-28.5	176.3	0	0	0	0	0	112.6	R140 K141 M142 K146	R140-A144 PolarHBondContact O-N 2.88Å; R140-A144 VanDerWaalsContact O-N 3.08Å; K141-A144 PolarHBondContact O-N 3.18Å; M142-A144 VanDerWaalsContact C-N 3.31Å; M142-A144 PolarHBondContact O-N 3.5Å; A144-K146 PolarHBondContact O-N 3.09Å
145	A	77.1	Confident	81.5	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.008	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.1	41.4	-176.8	0	0	0	0	0	114.1	K141 M142 E143 F147 I150 F200 L201 M204	K141-A145 WeakPolarHBondContact O-CB 3.12Å; K141-A145 PolarHBondContact O-N 3.36Å; K141-A145 VanDerWaalsContact O-N 3.07Å; M142-A145 PolarHBondContact O-N 2.92Å; E143-A145 VanDerWaalsContact C-N 3.31Å; A145-F147 PolarHBondContact O-N 2.83Å; A145-I150 WeakPolarHBondContact O-CG2 3.32Å; A145-F200 HydrophobicContact CB-CE1 4.36Å; A145-L201 HydrophobicContact CB-CD2 4.33Å; A145-M204 HydrophobicContact CB-CE 3.88Å; A145-M204 HydrophobicContact CB-SD 4.18Å
146	K	82.1	Confident	82.2	Confident	136 Å²	136	44.1 Å²	44.1	59%	0.591	21%	0.206	S	C	*	.			trans	-70.5	98.5	178.1	-77.3	169.3	-172.2	170.6	0	111.7	E143 A144	E143-K146 WeakPolarHBondContact O-CD 3.49Å; E143-K146 WeakPolarHBondContact O-CE 3.49Å; E143-K146 WeakPolarHBondContact O-CG 3.37Å; E143-K146 IonicContact OE1-NZ 2.79Å; A144-K146 PolarHBondContact O-N 3.09Å
147	F	88.3	Confident	82.8	Confident	70 Å²	70	42.9 Å²	42.9	31%	0.307	20%	0.2	S	C	.	.			trans	-144.4	153.5	176.5	-176.6	-117.5	0	0	0	111.7	A145 Y149 I150 V196 F200	A145-F147 PolarHBondContact O-N 2.83Å; F147-Y149 HydrophobicContact CD1-CD2 4.33Å; F147-Y149 AromaticContact CE1-CD2 3.59Å; F147-Y149 HydrophobicContact CE1-CD2 3.59Å; F147-Y149 HydrophobicContact CE1-CE2 4.39Å; F147-Y149 HydrophobicContact CE1-CG 4.42Å; F147-Y149 HydrophobicContact CZ-CD2 4.11Å; F147-Y149 HydrophobicContact CZ-CE2 4.49Å; F147-Y149 PolarHBondContact O-N 3.05Å; F147-Y149 VanDerWaalsContact O-N 3.11Å; F147-I150 HydrophobicContact CB-CG1 3.95Å; F147-I150 HydrophobicContact CD1-CG1 4.31Å; F147-I150 PolarHBondContact O-N 3.44Å; F147-V196 HydrophobicContact CE1-CG1 4.02Å; F147-V196 HydrophobicContact CZ-CG1 3.93Å; F147-F200 HydrophobicContact CB-CD1 3.52Å; F147-F200 HydrophobicContact CB-CD2 4.1Å; F147-F200 HydrophobicContact CB-CE1 3.43Å; F147-F200 VanDerWaalsContact CB-CE1 3.43Å; F147-F200 HydrophobicContact CB-CE2 4.02Å; F147-F200 HydrophobicContact CB-CG 3.86Å; F147-F200 HydrophobicContact CB-CZ 3.7Å; F147-F200 HydrophobicContact CD1-CB 3.64Å; F147-F200 AromaticContact CD1-CD1 3.85Å; F147-F200 HydrophobicContact CD1-CD1 3.85Å; F147-F200 HydrophobicContact CD1-CD2 4.21Å; F147-F200 AromaticContact CD1-CG 3.62Å; F147-F200 HydrophobicContact CD1-CG 3.62Å; F147-F200 AromaticContact CD2-CD2 3.86Å; F147-F200 HydrophobicContact CD2-CD2 3.86Å; F147-F200 HydrophobicContact CD2-CE2 4.15Å; F147-F200 HydrophobicContact CD2-CG 4.12Å; F147-F200 HydrophobicContact CE1-CB 3.69Å; F147-F200 HydrophobicContact CE1-CG 4.11Å; F147-F200 HydrophobicContact CE2-CD2 4.31Å; F147-F200 HydrophobicContact CG-CB 4.14Å; F147-F200 AromaticContact CG-CD1 3.78Å; F147-F200 HydrophobicContact CG-CD1 3.78Å; F147-F200 AromaticContact CG-CD2 3.82Å; F147-F200 HydrophobicContact CG-CD2 3.82Å; F147-F200 HydrophobicContact CG-CE1 4.14Å; F147-F200 HydrophobicContact CG-CE2 4.16Å; F147-F200 AromaticContact CG-CG 3.61Å; F147-F200 HydrophobicContact CG-CG 3.61Å; F147-F200 HydrophobicContact CG-CZ 4.33Å; F147-F200 HydrophobicContact CZ-CB 4.28Å
148	R	89	Confident	83.2	Confident	141 Å²	141	43.8 Å²	43.8	53%	0.532	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-36.3	-170.6	-179.6	174.2	175.2	152.7	-1.2	113.5	K227	R148-K227 VanDerWaalsContact O-CD 3.24Å; R148-K227 WeakPolarHBondContact O-CD 3.44Å; R148-K227 VanDerWaalsContact O-CE 3.26Å; R148-K227 WeakPolarHBondContact O-CE 3.45Å; R148-K227 PolarHBondContact O-NZ 3.28Å
149	Y	92.7	Very high	83.3	Confident	37 Å²	37	48 Å²	48	15%	0.145	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.6	12.5	-178.5	-54.6	-61.8	0	0	0	113.9	F147 E193 V196 V226 K227 I228	F147-Y149 HydrophobicContact CD1-CD2 4.33Å; F147-Y149 AromaticContact CE1-CD2 3.59Å; F147-Y149 HydrophobicContact CE1-CD2 3.59Å; F147-Y149 HydrophobicContact CE1-CE2 4.39Å; F147-Y149 HydrophobicContact CE1-CG 4.42Å; F147-Y149 HydrophobicContact CZ-CD2 4.11Å; F147-Y149 HydrophobicContact CZ-CE2 4.49Å; F147-Y149 PolarHBondContact O-N 3.05Å; F147-Y149 VanDerWaalsContact O-N 3.11Å; Y149-E193 HydrophobicContact CD1-CB 4Å; Y149-E193 HydrophobicContact CD1-CG 4.34Å; Y149-E193 HydrophobicContact CE1-CB 3.82Å; Y149-E193 HydrophobicContact CE1-CG 3.65Å; Y149-V196 HydrophobicContact CD2-CB 3.93Å; Y149-V196 HydrophobicContact CD2-CG1 3.75Å; Y149-V196 HydrophobicContact CE2-CB 3.88Å; Y149-V196 HydrophobicContact CE2-CG1 3.61Å; Y149-V226 WeakPolarHBondContact CA-O 3.47Å; Y149-V226 WeakPolarHBondContact CD1-O 3.45Å; Y149-K227 CarbonylContact O-C 3.47Å; Y149-K227 WeakPolarHBondContact O-CA 3.4Å; Y149-I228 PolarHBondContact O-N 2.91Å
150	I	90.4	Very high	83.3	Confident	3 Å²	3	49.4 Å²	49.4	2%	0.015	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-110.6	137.7	175.1	-54.9	-56.8	0	0	0	108.2	M142 A145 F147 P152 F200 L201 I228 F231	M142-I150 HydrophobicContact CE-CG2 4.16Å; A145-I150 WeakPolarHBondContact O-CG2 3.32Å; F147-I150 HydrophobicContact CB-CG1 3.95Å; F147-I150 HydrophobicContact CD1-CG1 4.31Å; F147-I150 PolarHBondContact O-N 3.44Å; I150-P152 VanDerWaalsContact O-CD 3.25Å; I150-P152 WeakPolarHBondContact O-CD 3.33Å; I150-F200 HydrophobicContact CG1-CD1 4.2Å; I150-L201 HydrophobicContact CD1-CD1 3.94Å; I150-L201 HydrophobicContact CD1-CD2 3.72Å; I150-L201 HydrophobicContact CD1-CG 3.85Å; I150-L201 HydrophobicContact CG1-CD2 4.2Å; I150-I228 HydrophobicContact CD1-CB 4.1Å; I150-I228 HydrophobicContact CD1-CD1 4.27Å; I150-F231 HydrophobicContact CD1-CZ 3.95Å; I150-F231 HydrophobicContact CG2-CE2 3.87Å; I150-F231 HydrophobicContact CG2-CZ 3.83Å
151	L	89.3	Confident	83.5	Confident	6 Å²	6	45.9 Å²	45.9	3%	0.031	23%	0.227	C	C	.	.			trans	-63.3	120.7	-179.7	-174.6	68.9	0	0	0	110.4	M142 M165 E166 M168 L219 K227 I228	M142-L151 WeakPolarHBondContact CE-O 3.29Å; L151-M165 HydrophobicContact CD2-CB 4.24Å; L151-M165 HydrophobicContact CD2-CE 4.36Å; L151-M165 HydrophobicContact CD2-SD 3.81Å; L151-E166 HydrophobicContact CD1-CB 4.22Å; L151-M168 HydrophobicContact CD1-CG 3.58Å; L151-M168 HydrophobicContact CD1-SD 3.43Å; L151-M168 WeakPolarHBondContact CD1-SD 3.35Å; L151-L219 HydrophobicContact CD1-CD1 4.28Å; L151-L219 HydrophobicContact CD2-CD1 3.95Å; L151-K227 HydrophobicContact CB-CB 4.37Å; L151-K227 HydrophobicContact CD1-CB 4.24Å; L151-I228 WeakPolarHBondContact CB-O 3.49Å; L151-I228 PolarHBondContact N-O 3.45Å
152	P	88.1	Confident	84	Confident	41 Å²	41	43.8 Å²	43.8	27%	0.266	22%	0.218	S	C	.	.			trans	-69.2	133.7	178.5	-21.6	35.3	0	0	0	112.6	I150 Y154 M165 E166	I150-P152 VanDerWaalsContact O-CD 3.25Å; I150-P152 WeakPolarHBondContact O-CD 3.33Å; P152-Y154 HydrophobicContact CB-CE1 4.49Å; P152-M165 WeakPolarHBondContact O-CA 3.37Å; P152-E166 HydrophobicContact CB-CB 4.39Å; P152-E166 WeakPolarHBondContact CD-OE2 3.34Å; P152-E166 HydrophobicContact CG-CB 4.34Å; P152-E166 VanDerWaalsContact CG-OE2 3.23Å; P152-E166 WeakPolarHBondContact CG-OE2 3.5Å; P152-E166 PolarHBondContact O-N 3.36Å
153	V	87.9	Confident	84.5	Confident	13 Å²	13	43.3 Å²	43.3	8%	0.079	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	128	170.1	-178.6	0	0	0	0	108.5	L83 M142 L163 M165	L83-V153 HydrophobicContact CD2-CG1 4.41Å; M142-V153 HydrophobicContact CB-CB 4Å; M142-V153 HydrophobicContact CB-CG2 3.5Å; M142-V153 HydrophobicContact CE-CG2 3.59Å; M142-V153 HydrophobicContact CG-CG2 3.82Å; V153-L163 HydrophobicContact CG1-CD2 4.22Å; V153-M165 HydrophobicContact CG2-CG 4.02Å; V153-M165 HydrophobicContact CG2-SD 4.32Å
154	Y	87	Confident	85	Confident	83 Å²	83	41.9 Å²	41.9	33%	0.325	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	-24.6	-178.5	-60.7	-59	0	0	0	113.1	K84 L117 P152 V164 E166	K84-Y154 PolarHBondContact N-O 2.78Å; L117-Y154 HydrophobicContact CD2-CD2 3.63Å; L117-Y154 HydrophobicContact CD2-CE2 3.38Å; P152-Y154 HydrophobicContact CB-CE1 4.49Å; Y154-V164 PolarHBondContact N-O 3.44Å; Y154-E166 HydrophobicContact CE2-CB 4.11Å
155	G	87.9	Confident	85.8	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.7	-161.3	-177.5	0	0	0	0	0	114	K84 V164	K84-G155 CarbonylContact O-C 3.58Å; K84-G155 WeakPolarHBondContact O-CA 3.42Å; G155-V164 PolarHBondContact N-O 2.82Å; G155-V164 PolarHBondContact O-N 2.86Å
156	I	86.9	Confident	86.3	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	130.2	-178.3	-55.1	-175.5	0	0	0	108.8	M80 K84 T85 F86 L135 L136 A139 G162 L163	M80-I156 HydrophobicContact CE-CD1 3.54Å; M80-I156 HydrophobicContact CE-CG1 4.34Å; K84-I156 PolarHBondContact O-N 3.34Å; T85-I156 CarbonylContact C-O 3.54Å; T85-I156 VanDerWaalsContact CA-O 3.32Å; T85-I156 WeakPolarHBondContact CA-O 3.42Å; F86-I156 PolarHBondContact N-O 3.32Å; L135-I156 HydrophobicContact CD2-CG2 4.32Å; L136-I156 HydrophobicContact CD1-CD1 3.79Å; L136-I156 HydrophobicContact CG-CD1 3.81Å; A139-I156 HydrophobicContact CB-CD1 3.8Å; A139-I156 HydrophobicContact CB-CG1 4.02Å; I156-G162 CarbonylContact C-O 3.5Å; I156-G162 WeakPolarHBondContact CA-O 3.38Å; I156-L163 HydrophobicContact CG1-CD2 4.28Å
157	C	86.8	Confident	86.7	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	136.4	168.3	-175.7	0	0	0	0	108.6	F86 F91 I119 P160 Q161 G162 V164	F86-C157 CarbonylContact O-C 3.5Å; F86-C157 VanDerWaalsContact O-CA 3.3Å; F86-C157 WeakPolarHBondContact O-CA 3.47Å; F91-C157 HydrophobicContact CE2-CB 4.26Å; I119-C157 HydrophobicContact CD1-CB 4.26Å; I119-C157 HydrophobicContact CG2-CB 4.37Å; C157-P160 PolarHBondContact SG-O 3.5Å; C157-Q161 WeakPolarHBondContact O-CA 3.5Å; C157-G162 PolarHBondContact N-O 3.05Å; C157-G162 PolarHBondContact O-N 3.46Å; C157-G162 VanDerWaalsContact O-N 3.08Å; C157-V164 HydrophobicContact CB-CG2 3.88Å
158	N	81.6	Confident	86.7	Confident	76 Å²	76	34.9 Å²	34.9	41%	0.406	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	-34.5	-179.7	-71	-31.3	0	0	0	112.6	F86 Q161	F86-N158 PolarHBondContact O-N 3.46Å; N158-Q161 PolarHBondContact O-N 3.3Å
159	D	78.1	Confident	86.4	Confident	112 Å²	112	34.8 Å²	34.8	60%	0.599	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-145.8	109.8	-177.1	-173.2	16.4	0	0	0	111.4	S88	S88-D159 VanDerWaalsContact CA-O 3.31Å; S88-D159 WeakPolarHBondContact CA-O 3.44Å; S88-D159 WeakPolarHBondContact CB-O 3.4Å; S88-D159 PolarHBondContact N-O 3.1Å; S88-D159 PolarHBondContact OG-O 3.47Å
160	P	77.4	Confident	85.9	Confident	29 Å²	29	35.3 Å²	35.3	19%	0.188	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	cis	-64.7	147.8	-11.4	28.9	-36.1	0	0	0	111.4	W94 C157 G162	W94-P160 VanDerWaalsContact CH2-CD 3.41Å; W94-P160 HydrophobicContact CH2-CG 3.51Å; W94-P160 HydrophobicContact CZ2-CG 4.47Å; W94-P160 HydrophobicContact CZ3-CG 3.6Å; C157-P160 PolarHBondContact SG-O 3.5Å; P160-G162 PolarHBondContact O-N 3.43Å
161	Q	80.4	Confident	85.7	Confident	48 Å²	48	36.2 Å²	36.2	22%	0.224	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	124.6	-179.6	-168.5	155.9	31.3	0	0	111.2	P122 L127 L135 C157 N158	P122-Q161 WeakPolarHBondContact CD-O 3.31Å; L127-Q161 HydrophobicContact CD1-CB 3.81Å; L127-Q161 HydrophobicContact CD1-CG 3.71Å; L135-Q161 HydrophobicContact CD2-CG 3.85Å; C157-Q161 WeakPolarHBondContact O-CA 3.5Å; N158-Q161 PolarHBondContact O-N 3.3Å
162	G	83.3	Confident	85.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.4	160.5	-176.4	0	0	0	0	0	115.4	K120 I156 C157 P160	K120-G162 CarbonylContact O-C 3.52Å; K120-G162 WeakPolarHBondContact O-CA 3.47Å; I156-G162 CarbonylContact C-O 3.5Å; I156-G162 WeakPolarHBondContact CA-O 3.38Å; C157-G162 PolarHBondContact N-O 3.05Å; C157-G162 PolarHBondContact O-N 3.46Å; C157-G162 VanDerWaalsContact O-N 3.08Å; P160-G162 PolarHBondContact O-N 3.43Å
163	L	86.6	Confident	85.7	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	124.4	177.7	-70.6	166.6	0	0	0	110.5	I119 K120 L135 E138 A139 V153 I156 M165	I119-L163 WeakPolarHBondContact CA-O 3.47Å; K120-L163 PolarHBondContact N-O 2.87Å; K120-L163 PolarHBondContact O-N 3.48Å; L135-L163 HydrophobicContact CD1-CD1 3.8Å; L135-L163 HydrophobicContact CD1-CD2 4.34Å; L135-L163 HydrophobicContact CD1-CG 3.63Å; L135-L163 HydrophobicContact CG-CD2 4.34Å; L135-L163 HydrophobicContact CG-CG 4.11Å; E138-L163 HydrophobicContact CG-CD1 4.12Å; A139-L163 HydrophobicContact CB-CD2 3.51Å; V153-L163 HydrophobicContact CG1-CD2 4.22Å; I156-L163 HydrophobicContact CG1-CD2 4.28Å; L163-M165 HydrophobicContact CB-CG 4.24Å; L163-M165 HydrophobicContact CB-SD 4.33Å
164	V	89.3	Confident	85.7	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	120.6	176.5	-173.6	0	0	0	0	109.1	F86 F91 L117 I119 Y154 G155 C157	F86-V164 HydrophobicContact CD2-CB 4.17Å; F86-V164 HydrophobicContact CD2-CG1 4.41Å; F86-V164 HydrophobicContact CD2-CG2 3.71Å; F86-V164 HydrophobicContact CE2-CB 4.09Å; F86-V164 HydrophobicContact CE2-CG1 4.15Å; F86-V164 HydrophobicContact CE2-CG2 4.16Å; F86-V164 HydrophobicContact CG-CG2 4.39Å; F91-V164 HydrophobicContact CE1-CG1 4.43Å; F91-V164 HydrophobicContact CZ-CG1 4.23Å; F91-V164 HydrophobicContact CZ-CG2 4.08Å; L117-V164 HydrophobicContact CB-CG1 4.36Å; L117-V164 HydrophobicContact CD1-CG1 3.82Å; I119-V164 HydrophobicContact CD1-CG2 4.29Å; I119-V164 HydrophobicContact CG1-CG2 4.17Å; Y154-V164 PolarHBondContact N-O 3.44Å; G155-V164 PolarHBondContact N-O 2.82Å; G155-V164 PolarHBondContact O-N 2.86Å; C157-V164 HydrophobicContact CB-CG2 3.88Å
165	M	90.6	Very high	85.6	Confident	15 Å²	15	37.7 Å²	37.7	7%	0.074	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	166	-169.3	-50.4	-177.3	-70.5	0	0	111.8	A118 K120 L151 P152 V153 L163 Y167	A118-M165 PolarHBondContact N-O 3.21Å; A118-M165 PolarHBondContact O-N 3.4Å; K120-M165 HydrophobicContact CB-CE 3.57Å; K120-M165 HydrophobicContact CD-CE 4.28Å; L151-M165 HydrophobicContact CD2-CB 4.24Å; L151-M165 HydrophobicContact CD2-CE 4.36Å; L151-M165 HydrophobicContact CD2-SD 3.81Å; P152-M165 WeakPolarHBondContact O-CA 3.37Å; V153-M165 HydrophobicContact CG2-CG 4.02Å; V153-M165 HydrophobicContact CG2-SD 4.32Å; L163-M165 HydrophobicContact CB-CG 4.24Å; L163-M165 HydrophobicContact CB-SD 4.33Å; M165-Y167 PolarHBondContact O-N 3.46Å
166	E	89.6	Confident	85.5	Confident	58 Å²	58	38.5 Å²	38.5	27%	0.271	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	134.1	169.3	-172.6	171.4	-152.9	0	0	110.8	L151 P152 Y154 M168 K227	L151-E166 HydrophobicContact CD1-CB 4.22Å; P152-E166 HydrophobicContact CB-CB 4.39Å; P152-E166 WeakPolarHBondContact CD-OE2 3.34Å; P152-E166 HydrophobicContact CG-CB 4.34Å; P152-E166 VanDerWaalsContact CG-OE2 3.23Å; P152-E166 WeakPolarHBondContact CG-OE2 3.5Å; P152-E166 PolarHBondContact O-N 3.36Å; Y154-E166 HydrophobicContact CE2-CB 4.11Å; E166-M168 HydrophobicContact CG-SD 4.28Å; E166-K227 IonicContact OE2-NZ 2.69Å
167	Y	89.8	Confident	85.4	Confident	53 Å²	53	39.4 Å²	39.4	21%	0.208	21%	0.206	C	C	.	.			trans	-82.8	122.7	174.4	176.3	-108.6	0	0	0	110.5	I97 K107 W116 A118 M165 E169	I97-Y167 HydrophobicContact CD1-CD2 4.19Å; I97-Y167 HydrophobicContact CD1-CE2 3.78Å; K107-Y167 HydrophobicContact CB-CD2 4.35Å; K107-Y167 HydrophobicContact CB-CE2 4.09Å; K107-Y167 HydrophobicContact CD-CD2 4.48Å; K107-Y167 HydrophobicContact CD-CE1 4.19Å; K107-Y167 HydrophobicContact CD-CE2 3.84Å; K107-Y167 HydrophobicContact CG-CD2 4.1Å; K107-Y167 HydrophobicContact CG-CE2 3.91Å; W116-Y167 HydrophobicContact CB-CD1 4.05Å; W116-Y167 HydrophobicContact CB-CG 4.35Å; A118-Y167 HydrophobicContact CB-CD2 4.43Å; M165-Y167 PolarHBondContact O-N 3.46Å; Y167-E169 HydrophobicContact CD1-CG 4.22Å; Y167-E169 HydrophobicContact CE1-CG 4.13Å
168	M	88.1	Confident	85.2	Confident	13 Å²	13	42.8 Å²	42.8	6%	0.064	23%	0.234	C	C	.	.			trans	-94	101.7	-178.5	-57.4	-56	-57.9	0	0	110.3	L151 E166 T170 G171 L219 L220 D221 K227	L151-M168 HydrophobicContact CD1-CG 3.58Å; L151-M168 HydrophobicContact CD1-SD 3.43Å; L151-M168 WeakPolarHBondContact CD1-SD 3.35Å; E166-M168 HydrophobicContact CG-SD 4.28Å; M168-T170 VanDerWaalsContact C-N 3.31Å; M168-T170 PolarHBondContact O-N 3.39Å; M168-G171 PolarHBondContact O-N 3.01Å; M168-G171 VanDerWaalsContact O-N 3.09Å; M168-L219 HydrophobicContact CB-CB 4.05Å; M168-L219 HydrophobicContact CB-CD1 4.3Å; M168-L219 HydrophobicContact CE-CB 4.26Å; M168-L219 HydrophobicContact CG-CB 3.73Å; M168-L219 HydrophobicContact CG-CD1 3.67Å; M168-L219 HydrophobicContact CG-CG 4.35Å; M168-L220 WeakPolarHBondContact CE-O 3.34Å; M168-D221 HydrophobicContact CE-CB 3.72Å; M168-K227 HydrophobicContact CE-CB 3.77Å; M168-K227 HydrophobicContact CE-CG 3.31Å; M168-K227 HydrophobicContact SD-CB 4.2Å; M168-K227 HydrophobicContact SD-CG 3.83Å
169	E	81.6	Confident	85	Confident	139 Å²	139	45.3 Å²	45.3	65%	0.65	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-36.6	-170.8	-65.7	-177.2	167.6	0	0	114.4	Y167	Y167-E169 HydrophobicContact CD1-CG 4.22Å; Y167-E169 HydrophobicContact CE1-CG 4.13Å
170	T	83.5	Confident	84.9	Confident	47 Å²	47	45.6 Å²	45.6	29%	0.288	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-7.8	-178.7	69.4	0	0	0	0	113.3	M168 L220 D221 Y224	M168-T170 VanDerWaalsContact C-N 3.31Å; M168-T170 PolarHBondContact O-N 3.39Å; T170-L220 PolarHBondContact N-O 3.08Å; T170-L220 WeakPolarHBondContact OG1-CB 3.3Å; T170-L220 PolarHBondContact OG1-O 3.17Å; T170-D221 WeakPolarHBondContact CG2-O 3.45Å; T170-D221 PolarHBondContact OG1-O 2.91Å; T170-Y224 HydrophobicContact CG2-CE1 4.46Å
171	G	85.8	Confident	85.1	Confident	23 Å²	23	49.6 Å²	49.6	24%	0.237	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	77.3	-150.8	177.4	0	0	0	0	0	114.2	M168 L219 L220	M168-G171 PolarHBondContact O-N 3.01Å; M168-G171 VanDerWaalsContact O-N 3.09Å; G171-L219 WeakPolarHBondContact O-CA 3.41Å; G171-L220 PolarHBondContact O-N 3.31Å
172	S	89.4	Confident	85.4	Confident	16 Å²	16	47.7 Å²	47.7	11%	0.112	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	150.1	-177	69.8	0	0	0	0	112.9	E174 N175 L176 A216	S172-E174 PolarHBondContact O-N 3.33Å; S172-N175 PolarHBondContact O-N 3.22Å; S172-N175 VanDerWaalsContact O-N 3.14Å; S172-N175 PolarHBondContact OG-N 3.46Å; S172-L176 PolarHBondContact O-N 3.02Å; S172-A216 WeakPolarHBondContact CB-O 3.37Å
173	L	88.1	Confident	85.7	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-60.6	-30	174.4	177.6	65.4	0	0	0	111.6	N175 L176 L177 I190 P215 I218 L220 I285	L173-N175 PolarHBondContact O-N 3.24Å; L173-L176 HydrophobicContact CD1-CD2 4.44Å; L173-L176 PolarHBondContact O-N 3.19Å; L173-L177 HydrophobicContact CD1-CD1 4.25Å; L173-L177 HydrophobicContact CD1-CD2 4.33Å; L173-L177 HydrophobicContact CD1-CG 3.95Å; L173-L177 HydrophobicContact CD2-CD1 4.45Å; L173-L177 HydrophobicContact CG-CD1 3.9Å; L173-L177 HydrophobicContact CG-CG 4.09Å; L173-L177 WeakPolarHBondContact O-CB 3.4Å; L173-L177 VanDerWaalsContact O-CG 3.22Å; L173-L177 WeakPolarHBondContact O-CG 3.39Å; L173-L177 PolarHBondContact O-N 3.11Å; L173-I190 HydrophobicContact CD1-CD1 4.06Å; L173-I190 HydrophobicContact CD1-CG2 4.28Å; L173-I190 HydrophobicContact CD2-CG2 3.92Å; L173-P215 HydrophobicContact CB-CB 4.35Å; L173-P215 WeakPolarHBondContact CB-O 3.42Å; L173-P215 HydrophobicContact CD2-CB 4.33Å; L173-P215 HydrophobicContact CG-CB 4.23Å; L173-P215 PolarHBondContact N-O 2.83Å; L173-I218 HydrophobicContact CB-CB 4.09Å; L173-I218 HydrophobicContact CB-CG2 4.1Å; L173-I218 VanDerWaalsContact CB-O 3.28Å; L173-I218 WeakPolarHBondContact CB-O 3.27Å; L173-I218 HydrophobicContact CD2-CB 4.15Å; L173-I218 HydrophobicContact CD2-CD1 4.18Å; L173-I218 HydrophobicContact CD2-CG2 3.9Å; L173-I218 PolarHBondContact N-O 3.5Å; L173-L220 HydrophobicContact CD1-CD1 4.15Å; L173-I285 HydrophobicContact CD2-CD1 3.95Å; L173-I285 HydrophobicContact CD2-CG1 3.93Å
174	E	87.1	Confident	85.7	Confident	67 Å²	67	53.7 Å²	53.7	31%	0.313	30%	0.296	S	S	.	.	H	α-helix	trans	-59	-45.9	173.6	-175.4	172	-155.5	0	0	112.2	S172 L176 A178 P215 A216 K290	S172-E174 PolarHBondContact O-N 3.33Å; E174-L176 VanDerWaalsContact C-N 3.33Å; E174-A178 WeakPolarHBondContact O-CB 3.43Å; E174-A178 PolarHBondContact O-N 2.99Å; E174-A178 VanDerWaalsContact O-N 3.16Å; E174-P215 HydrophobicContact CB-CB 4.04Å; E174-P215 PolarHBondContact N-O 3.5Å; E174-A216 HydrophobicContact CB-CB 4.35Å; E174-A216 WeakPolarHBondContact OE2-CB 3.39Å; E174-K290 IonicContact OE1-NZ 3.42Å; E174-K290 PolarHBondContact OE1-NZ 3.03Å
175	N	85.5	Confident	85.7	Confident	90 Å²	90	61 Å²	61	48%	0.481	33%	0.33	S	S	.	.	H	α-helix	trans	-66	-40.4	178.2	-69.7	-10.4	0	0	0	110.8	S172 L173 A178 N179	S172-N175 PolarHBondContact O-N 3.22Å; S172-N175 VanDerWaalsContact O-N 3.14Å; S172-N175 PolarHBondContact OG-N 3.46Å; L173-N175 PolarHBondContact O-N 3.24Å; N175-A178 PolarHBondContact O-N 3.47Å; N175-N179 WeakPolarHBondContact O-CB 3.49Å; N175-N179 VanDerWaalsContact O-CG 3.23Å; N175-N179 PolarHBondContact O-N 3.1Å; N175-N179 VanDerWaalsContact O-N 3.08Å; N175-N179 PolarHBondContact O-ND2 3.03Å
176	L	85.7	Confident	85.7	Confident	17 Å²	17	61.5 Å²	61.5	9%	0.089	33%	0.333	C	S	.	.	H	α-helix	trans	-64.6	-44.7	179.4	-172.6	65.3	0	0	0	112.1	S172 L173 E174 A178 N179 E180 L182 L220 Y224	S172-L176 PolarHBondContact O-N 3.02Å; L173-L176 HydrophobicContact CD1-CD2 4.44Å; L173-L176 PolarHBondContact O-N 3.19Å; E174-L176 VanDerWaalsContact C-N 3.33Å; L176-A178 PolarHBondContact O-N 3.09Å; L176-N179 PolarHBondContact O-N 2.95Å; L176-E180 PolarHBondContact O-N 2.81Å; L176-L182 HydrophobicContact CD1-CD2 3.93Å; L176-L182 HydrophobicContact CD2-CD1 3.9Å; L176-L182 HydrophobicContact CD2-CD2 3.63Å; L176-L182 HydrophobicContact CD2-CG 4.37Å; L176-L182 HydrophobicContact CG-CD1 4.07Å; L176-L182 HydrophobicContact CG-CD2 3.64Å; L176-L182 HydrophobicContact CG-CG 4.29Å; L176-L220 HydrophobicContact CD2-CD1 3.32Å; L176-Y224 HydrophobicContact CD1-CE1 4.22Å; L176-Y224 HydrophobicContact CD2-CD1 4.11Å; L176-Y224 HydrophobicContact CD2-CE1 4.16Å
177	L	84.8	Confident	85.8	Confident	24 Å²	24	59.3 Å²	59.3	13%	0.126	32%	0.322	C	S	.	.	H	α-helix	trans	-65.9	-24.8	176.7	-68.8	173.7	0	0	0	113	L173 L182 P215 I285 Q288	L173-L177 HydrophobicContact CD1-CD1 4.25Å; L173-L177 HydrophobicContact CD1-CD2 4.33Å; L173-L177 HydrophobicContact CD1-CG 3.95Å; L173-L177 HydrophobicContact CD2-CD1 4.45Å; L173-L177 HydrophobicContact CG-CD1 3.9Å; L173-L177 HydrophobicContact CG-CG 4.09Å; L173-L177 WeakPolarHBondContact O-CB 3.4Å; L173-L177 VanDerWaalsContact O-CG 3.22Å; L173-L177 WeakPolarHBondContact O-CG 3.39Å; L173-L177 PolarHBondContact O-N 3.11Å; L177-L182 HydrophobicContact CD2-CD1 3.85Å; L177-P215 HydrophobicContact CD1-CB 4.2Å; L177-P215 HydrophobicContact CD1-CG 4.39Å; L177-I285 HydrophobicContact CD1-CG1 4.5Å; L177-Q288 HydrophobicContact CD2-CB 4.47Å; L177-Q288 HydrophobicContact CD2-CG 3.95Å
178	A	82	Confident	85.9	Confident	70 Å²	70	57.6 Å²	57.6	58%	0.579	32%	0.316	S	S	*	.	H	α-helix	trans	-83	-33.4	178.7	0	0	0	0	0	113.2	E174 N175 L176	E174-A178 WeakPolarHBondContact O-CB 3.43Å; E174-A178 PolarHBondContact O-N 2.99Å; E174-A178 VanDerWaalsContact O-N 3.16Å; N175-A178 PolarHBondContact O-N 3.47Å; L176-A178 PolarHBondContact O-N 3.09Å
179	N	78.9	Confident	86.2	Confident	130 Å²	130	62.4 Å²	62.4	70%	0.695	33%	0.333	S	S	*	.	H	α-helix	trans	-94.7	-37.8	-168.5	-67.9	-20.8	0	0	0	113.9	N175 L176	N175-N179 WeakPolarHBondContact O-CB 3.49Å; N175-N179 VanDerWaalsContact O-CG 3.23Å; N175-N179 PolarHBondContact O-N 3.1Å; N175-N179 VanDerWaalsContact O-N 3.08Å; N175-N179 PolarHBondContact O-ND2 3.03Å; L176-N179 PolarHBondContact O-N 2.95Å
180	E	75.9	Confident	86.8	Confident	117 Å²	117	55.8 Å²	55.8	55%	0.547	30%	0.302	S	S	.	.	S	Bend	trans	-139.6	143.1	-170.3	-64.2	-170.9	170.4	0	0	113.5	L176 L182 Q288	L176-E180 PolarHBondContact O-N 2.81Å; E180-L182 PolarHBondContact O-N 3.34Å; E180-Q288 PolarHBondContact O-OE1 3.2Å
181	P	82	Confident	87.3	Confident	113 Å²	113	53.5 Å²	53.5	73%	0.734	29%	0.289	S	S	*	.			trans	-75.7	111.4	174.3	30.4	-32.7	0	0	0	111.7
182	L	87	Confident	87.8	Confident	8 Å²	8	54.3 Å²	54.3	4%	0.042	29%	0.286	C	S	.	.			trans	-74.6	140.5	-177.8	-60.9	174.3	0	0	0	113.4	L176 L177 E180 L186 R187 I190	L176-L182 HydrophobicContact CD1-CD2 3.93Å; L176-L182 HydrophobicContact CD2-CD1 3.9Å; L176-L182 HydrophobicContact CD2-CD2 3.63Å; L176-L182 HydrophobicContact CD2-CG 4.37Å; L176-L182 HydrophobicContact CG-CD1 4.07Å; L176-L182 HydrophobicContact CG-CD2 3.64Å; L176-L182 HydrophobicContact CG-CG 4.29Å; L177-L182 HydrophobicContact CD2-CD1 3.85Å; E180-L182 PolarHBondContact O-N 3.34Å; L182-L186 HydrophobicContact CD2-CD2 3.92Å; L182-R187 HydrophobicContact CB-CG 4.04Å; L182-R187 VanDerWaalsContact O-CZ 3.26Å; L182-R187 PolarHBondContact O-NE 3.19Å; L182-R187 PolarHBondContact O-NH2 3.24Å; L182-I190 HydrophobicContact CD1-CD1 4.35Å
183	P	88.8	Confident	88.1	Confident	84 Å²	84	53.9 Å²	53.9	55%	0.545	28%	0.282	S	S	.	.			trans	-58.4	147.6	169.2	-22.9	33.2	0	0	0	112.5	E185 L186 R187	P183-E185 VanDerWaalsContact C-N 3.32Å; P183-E185 PolarHBondContact O-N 3.08Å; P183-L186 HydrophobicContact CB-CB 4.5Å; P183-L186 PolarHBondContact O-N 3.5Å; P183-R187 WeakPolarHBondContact O-CG 3.49Å; P183-R187 PolarHBondContact O-N 3.41Å; P183-R187 VanDerWaalsContact O-N 3.1Å
184	W	87.3	Confident	88.4	Confident	43 Å²	43	53.9 Å²	53.9	16%	0.163	28%	0.282	C	S	.	.	H	α-helix	trans	-59.6	-39.5	-179.1	-79.2	111.5	0	0	0	113.4	L186 R187 F188 L286 V316 S319 R320 P321 C324	W184-L186 VanDerWaalsContact C-N 3.3Å; W184-L186 PolarHBondContact O-N 3.38Å; W184-R187 WeakPolarHBondContact O-CB 3.47Å; W184-R187 PolarHBondContact O-N 2.89Å; W184-F188 HydrophobicContact CB-CE2 4.03Å; W184-F188 HydrophobicContact CB-CZ 4.3Å; W184-F188 HydrophobicContact CD2-CZ 4.32Å; W184-F188 AromaticContact CE3-CE1 3.81Å; W184-F188 HydrophobicContact CE3-CE1 3.81Å; W184-F188 HydrophobicContact CE3-CE2 4.46Å; W184-F188 AromaticContact CE3-CZ 3.62Å; W184-F188 HydrophobicContact CE3-CZ 3.62Å; W184-F188 HydrophobicContact CZ3-CE1 4.24Å; W184-F188 HydrophobicContact CZ3-CZ 4.34Å; W184-F188 WeakPolarHBondContact O-CD2 3.35Å; W184-F188 VanDerWaalsContact O-CG 3.27Å; W184-F188 WeakPolarHBondContact O-CG 3.44Å; W184-F188 PolarHBondContact O-N 3.11Å; W184-L286 HydrophobicContact CZ3-CD2 3.85Å; W184-V316 HydrophobicContact CH2-CG1 4.01Å; W184-S319 PolarHBondContact NE1-O 2.91Å; W184-R320 HydrophobicContact CH2-CB 4.1Å; W184-R320 HydrophobicContact CZ2-CB 3.65Å; W184-P321 HydrophobicContact CB-CG 3.9Å; W184-P321 VanDerWaalsContact CD1-CD 3.49Å; W184-P321 HydrophobicContact CD2-CG 4.31Å; W184-P321 HydrophobicContact CG-CG 3.78Å; W184-C324 HydrophobicContact CZ3-CB 4.3Å
185	E	88.4	Confident	88.8	Confident	153 Å²	153	50.7 Å²	50.7	72%	0.715	27%	0.267	S	S	*	.	H	α-helix	trans	-61	-40.6	177.7	-64.4	-176.8	178.9	0	0	112.1	P183 F188 R189	P183-E185 VanDerWaalsContact C-N 3.32Å; P183-E185 PolarHBondContact O-N 3.08Å; E185-F188 PolarHBondContact O-N 3.01Å; E185-R189 WeakPolarHBondContact O-CB 3.45Å; E185-R189 PolarHBondContact O-N 3.43Å
186	L	90.4	Very high	89.2	Confident	26 Å²	26	47.7 Å²	47.7	14%	0.136	25%	0.252	C	S	.	.	H	α-helix	trans	-67.6	-40.9	177.6	-176.3	57.7	0	0	0	111	L182 P183 W184 F188 R189 I190 Y224	L182-L186 HydrophobicContact CD2-CD2 3.92Å; P183-L186 HydrophobicContact CB-CB 4.5Å; P183-L186 PolarHBondContact O-N 3.5Å; W184-L186 VanDerWaalsContact C-N 3.3Å; W184-L186 PolarHBondContact O-N 3.38Å; L186-F188 PolarHBondContact O-N 3.28Å; L186-R189 PolarHBondContact O-N 3.44Å; L186-I190 HydrophobicContact CD1-CD1 4.16Å; L186-I190 HydrophobicContact CD1-CG1 4.25Å; L186-I190 HydrophobicContact CG-CD1 3.89Å; L186-I190 HydrophobicContact CG-CG1 4.44Å; L186-I190 VanDerWaalsContact O-CG1 3.24Å; L186-I190 WeakPolarHBondContact O-CG1 3.32Å; L186-I190 PolarHBondContact O-N 3.05Å; L186-Y224 HydrophobicContact CD1-CG 4.48Å; L186-Y224 HydrophobicContact CD2-CD1 4.1Å; L186-Y224 HydrophobicContact CD2-CG 4.3Å
187	R	91.6	Very high	89.6	Confident	13 Å²	13	46.9 Å²	46.9	5%	0.049	25%	0.248	C	C	.	.	H	α-helix	trans	-57.5	-48.2	174.2	-67.2	178.2	-160.2	-175	15.1	112.1	L182 P183 W184 R189 I190 I191 I285 L286	L182-R187 HydrophobicContact CB-CG 4.04Å; L182-R187 VanDerWaalsContact O-CZ 3.26Å; L182-R187 PolarHBondContact O-NE 3.19Å; L182-R187 PolarHBondContact O-NH2 3.24Å; P183-R187 WeakPolarHBondContact O-CG 3.49Å; P183-R187 PolarHBondContact O-N 3.41Å; P183-R187 VanDerWaalsContact O-N 3.1Å; W184-R187 WeakPolarHBondContact O-CB 3.47Å; W184-R187 PolarHBondContact O-N 2.89Å; R187-R189 VanDerWaalsContact C-N 3.35Å; R187-I190 PolarHBondContact O-N 2.99Å; R187-I191 WeakPolarHBondContact O-CD1 3.48Å; R187-I191 VanDerWaalsContact O-CG1 3.29Å; R187-I191 WeakPolarHBondContact O-CG1 3.17Å; R187-I191 PolarHBondContact O-N 3.47Å; R187-I191 VanDerWaalsContact O-N 3.07Å; R187-I285 HydrophobicContact CB-CG2 3.62Å; R187-I285 WeakPolarHBondContact CD-O 3.21Å; R187-I285 HydrophobicContact CG-CG2 3.89Å; R187-L286 PolarHBondContact NH1-O 2.93Å
188	F	93.1	Very high	90	Very high	16 Å²	16	45.7 Å²	45.7	7%	0.07	24%	0.242	C	C	.	.	H	α-helix	trans	-65.8	-39	179.7	-58.1	-35.3	0	0	0	111.9	W184 E185 L186 I191 H192 L286 P321 T323 C324 F327	W184-F188 HydrophobicContact CB-CE2 4.03Å; W184-F188 HydrophobicContact CB-CZ 4.3Å; W184-F188 HydrophobicContact CD2-CZ 4.32Å; W184-F188 AromaticContact CE3-CE1 3.81Å; W184-F188 HydrophobicContact CE3-CE1 3.81Å; W184-F188 HydrophobicContact CE3-CE2 4.46Å; W184-F188 AromaticContact CE3-CZ 3.62Å; W184-F188 HydrophobicContact CE3-CZ 3.62Å; W184-F188 HydrophobicContact CZ3-CE1 4.24Å; W184-F188 HydrophobicContact CZ3-CZ 4.34Å; W184-F188 WeakPolarHBondContact O-CD2 3.35Å; W184-F188 VanDerWaalsContact O-CG 3.27Å; W184-F188 WeakPolarHBondContact O-CG 3.44Å; W184-F188 PolarHBondContact O-N 3.11Å; E185-F188 PolarHBondContact O-N 3.01Å; L186-F188 PolarHBondContact O-N 3.28Å; F188-I191 PolarHBondContact O-N 3.24Å; F188-H192 WeakPolarHBondContact O-CB 3.39Å; F188-H192 PolarHBondContact O-N 2.97Å; F188-L286 HydrophobicContact CD1-CD2 4.37Å; F188-L286 HydrophobicContact CE1-CD2 3.95Å; F188-P321 HydrophobicContact CE2-CB 4.4Å; F188-P321 HydrophobicContact CE2-CG 4.28Å; F188-P321 HydrophobicContact CZ-CG 4.45Å; F188-T323 HydrophobicContact CD2-CG2 4.43Å; F188-T323 HydrophobicContact CE2-CG2 4.33Å; F188-C324 HydrophobicContact CE1-CB 4.37Å; F188-C324 HydrophobicContact CZ-CB 4.12Å; F188-F327 HydrophobicContact CB-CE2 3.77Å; F188-F327 HydrophobicContact CB-CZ 4.14Å; F188-F327 AromaticContact CD1-CD2 3.35Å; F188-F327 HydrophobicContact CD1-CD2 3.35Å; F188-F327 AromaticContact CD1-CE2 3.44Å; F188-F327 HydrophobicContact CD1-CE2 3.44Å; F188-F327 VanDerWaalsContact CD1-CE2 3.44Å; F188-F327 HydrophobicContact CD1-CG 4.2Å; F188-F327 HydrophobicContact CD1-CZ 4.35Å; F188-F327 AromaticContact CE1-CD2 3.67Å; F188-F327 HydrophobicContact CE1-CD2 3.67Å; F188-F327 HydrophobicContact CE1-CE2 4.17Å; F188-F327 HydrophobicContact CE1-CG 4.49Å; F188-F327 HydrophobicContact CG-CD2 4.04Å; F188-F327 AromaticContact CG-CE2 3.66Å; F188-F327 HydrophobicContact CG-CE2 3.66Å; F188-F327 HydrophobicContact CG-CZ 4.49Å
189	R	93.4	Very high	90.5	Very high	114 Å²	114	44 Å²	44	43%	0.43	22%	0.223	S	C	.	.	H	α-helix	trans	-61.9	-48.2	174.3	-173.3	-176.8	-59.1	173.7	2.5	111.8	E185 L186 R187 I191 H192 E193	E185-R189 WeakPolarHBondContact O-CB 3.45Å; E185-R189 PolarHBondContact O-N 3.43Å; L186-R189 PolarHBondContact O-N 3.44Å; R187-R189 VanDerWaalsContact C-N 3.35Å; R189-I191 VanDerWaalsContact C-N 3.29Å; R189-I191 PolarHBondContact O-N 3.06Å; R189-H192 PolarHBondContact O-N 3.34Å; R189-H192 VanDerWaalsContact O-N 3.14Å; R189-E193 WeakPolarHBondContact CD-OE1 3.49Å; R189-E193 HydrophobicContact CG-CG 4.11Å; R189-E193 WeakPolarHBondContact CG-OE1 3.32Å; R189-E193 WeakPolarHBondContact O-CG 3.38Å; R189-E193 PolarHBondContact O-N 3.32Å
190	I	94.1	Very high	91.1	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-58.3	-43.8	178.3	-68.7	165.3	0	0	0	110.3	L173 L182 L186 R187 T194 L220 V226 I285	L173-I190 HydrophobicContact CD1-CD1 4.06Å; L173-I190 HydrophobicContact CD1-CG2 4.28Å; L173-I190 HydrophobicContact CD2-CG2 3.92Å; L182-I190 HydrophobicContact CD1-CD1 4.35Å; L186-I190 HydrophobicContact CD1-CD1 4.16Å; L186-I190 HydrophobicContact CD1-CG1 4.25Å; L186-I190 HydrophobicContact CG-CD1 3.89Å; L186-I190 HydrophobicContact CG-CG1 4.44Å; L186-I190 VanDerWaalsContact O-CG1 3.24Å; L186-I190 WeakPolarHBondContact O-CG1 3.32Å; L186-I190 PolarHBondContact O-N 3.05Å; R187-I190 PolarHBondContact O-N 2.99Å; I190-T194 VanDerWaalsContact O-CB 3.29Å; I190-T194 WeakPolarHBondContact O-CB 3.31Å; I190-T194 PolarHBondContact O-N 2.97Å; I190-T194 PolarHBondContact O-OG1 2.87Å; I190-L220 HydrophobicContact CD1-CD1 4.4Å; I190-L220 HydrophobicContact CD1-CD2 4.46Å; I190-L220 HydrophobicContact CG1-CD2 4.24Å; I190-V226 HydrophobicContact CB-CG2 4.26Å; I190-V226 HydrophobicContact CG1-CG2 4.31Å; I190-V226 HydrophobicContact CG2-CG2 3.91Å; I190-I285 HydrophobicContact CG2-CD1 3.81Å
191	I	94.9	Very high	91.7	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.3	-50.3	175.7	-67.2	162.6	0	0	0	110.5	R187 F188 R189 A195 F278 I282 I285 L286 F327	R187-I191 WeakPolarHBondContact O-CD1 3.48Å; R187-I191 VanDerWaalsContact O-CG1 3.29Å; R187-I191 WeakPolarHBondContact O-CG1 3.17Å; R187-I191 PolarHBondContact O-N 3.47Å; R187-I191 VanDerWaalsContact O-N 3.07Å; F188-I191 PolarHBondContact O-N 3.24Å; R189-I191 VanDerWaalsContact C-N 3.29Å; R189-I191 PolarHBondContact O-N 3.06Å; I191-A195 WeakPolarHBondContact O-CB 3.46Å; I191-A195 PolarHBondContact O-N 3.3Å; I191-F278 HydrophobicContact CG2-CZ 4.01Å; I191-F278 WeakPolarHBondContact O-CZ 3.42Å; I191-I282 HydrophobicContact CD1-CG2 4.02Å; I191-I282 HydrophobicContact CG1-CG1 4.33Å; I191-I282 HydrophobicContact CG2-CD1 4.27Å; I191-I282 HydrophobicContact CG2-CG1 3.94Å; I191-I285 HydrophobicContact CD1-CB 4.44Å; I191-I285 HydrophobicContact CD1-CG2 4.02Å; I191-I285 HydrophobicContact CG1-CB 4.34Å; I191-I285 HydrophobicContact CG1-CD1 3.79Å; I191-I285 HydrophobicContact CG1-CG2 4.02Å; I191-L286 HydrophobicContact CD1-CD2 3.9Å; I191-L286 HydrophobicContact CD1-CG 4.21Å; I191-F327 HydrophobicContact CB-CE1 4.17Å; I191-F327 HydrophobicContact CD1-CD1 4.2Å; I191-F327 HydrophobicContact CD1-CG 4.48Å; I191-F327 HydrophobicContact CG2-CD1 3.77Å; I191-F327 HydrophobicContact CG2-CE1 3.55Å
192	H	94.6	Very high	92	Very high	39 Å²	39	31 Å²	31	18%	0.181	15%	0.147	C	C	.	.	H	α-helix	trans	-61.1	-51	-179.6	174.6	-104.5	0	0	0	112.3	F188 R189 T194 A195 V196 A352	F188-H192 WeakPolarHBondContact O-CB 3.39Å; F188-H192 PolarHBondContact O-N 2.97Å; R189-H192 PolarHBondContact O-N 3.34Å; R189-H192 VanDerWaalsContact O-N 3.14Å; H192-T194 VanDerWaalsContact C-N 3.34Å; H192-T194 PolarHBondContact O-N 3.2Å; H192-A195 WeakPolarHBondContact O-CB 3.48Å; H192-A195 PolarHBondContact O-N 3.36Å; H192-A195 VanDerWaalsContact O-N 3.12Å; H192-V196 WeakPolarHBondContact O-CG2 3.13Å; H192-V196 PolarHBondContact O-N 3.45Å; H192-A352 HydrophobicContact CB-CB 4.37Å
193	E	95.7	Very high	92	Very high	7 Å²	7	34.8 Å²	34.8	3%	0.033	17%	0.174	C	C	.	.	H	α-helix	trans	-63	-39.5	-179.2	-68.4	-176.9	-178.1	0	0	112.3	Y149 R189 A195 V196 G197 H225 V226	Y149-E193 HydrophobicContact CD1-CB 4Å; Y149-E193 HydrophobicContact CD1-CG 4.34Å; Y149-E193 HydrophobicContact CE1-CB 3.82Å; Y149-E193 HydrophobicContact CE1-CG 3.65Å; R189-E193 WeakPolarHBondContact CD-OE1 3.49Å; R189-E193 HydrophobicContact CG-CG 4.11Å; R189-E193 WeakPolarHBondContact CG-OE1 3.32Å; R189-E193 WeakPolarHBondContact O-CG 3.38Å; R189-E193 PolarHBondContact O-N 3.32Å; E193-A195 VanDerWaalsContact C-N 3.33Å; E193-A195 PolarHBondContact O-N 3.21Å; E193-V196 PolarHBondContact O-N 3.14Å; E193-G197 PolarHBondContact O-N 3.08Å; E193-H225 IonicContact OE1-CE1 3.63Å; E193-H225 PolarHBondContact OE1-CE1 2.83Å; E193-H225 IonicContact OE1-ND1 3.72Å; E193-H225 PolarHBondContact OE1-ND1 2.95Å; E193-H225 WeakPolarHBondContact OE2-CA 3.47Å; E193-H225 IonicContact OE2-ND1 2.85Å; E193-H225 PolarHBondContact OE2-ND1 3.3Å; E193-V226 HydrophobicContact CB-CB 3.9Å; E193-V226 HydrophobicContact CB-CG2 3.97Å; E193-V226 PolarHBondContact OE2-N 3.23Å
194	T	95.5	Very high	91.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.6	-40.9	174	-53.1	0	0	0	0	111.1	I190 H192 G197 M198 I218 I228 F278	I190-T194 VanDerWaalsContact O-CB 3.29Å; I190-T194 WeakPolarHBondContact O-CB 3.31Å; I190-T194 PolarHBondContact O-N 2.97Å; I190-T194 PolarHBondContact O-OG1 2.87Å; H192-T194 VanDerWaalsContact C-N 3.34Å; H192-T194 PolarHBondContact O-N 3.2Å; T194-G197 PolarHBondContact O-N 3.06Å; T194-M198 WeakPolarHBondContact O-CG 3.35Å; T194-M198 PolarHBondContact O-N 2.99Å; T194-I218 HydrophobicContact CG2-CD1 3.87Å; T194-I218 HydrophobicContact CG2-CG1 4.4Å; T194-I228 HydrophobicContact CG2-CD1 4.38Å; T194-F278 HydrophobicContact CG2-CD2 3.94Å; T194-F278 HydrophobicContact CG2-CE2 3.5Å; T194-F278 HydrophobicContact CG2-CZ 4.49Å
195	A	95.4	Very high	91	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-63.5	-42.2	176.5	0	0	0	0	0	111.9	I191 H192 E193 M198 N199 F278 I348 T349	I191-A195 WeakPolarHBondContact O-CB 3.46Å; I191-A195 PolarHBondContact O-N 3.3Å; H192-A195 WeakPolarHBondContact O-CB 3.48Å; H192-A195 PolarHBondContact O-N 3.36Å; H192-A195 VanDerWaalsContact O-N 3.12Å; E193-A195 VanDerWaalsContact C-N 3.33Å; E193-A195 PolarHBondContact O-N 3.21Å; A195-M198 PolarHBondContact O-N 2.84Å; A195-N199 WeakPolarHBondContact O-CB 3.49Å; A195-N199 PolarHBondContact O-N 2.92Å; A195-F278 HydrophobicContact CB-CE1 4Å; A195-F278 HydrophobicContact CB-CZ 3.89Å; A195-I348 HydrophobicContact CB-CG2 3.95Å; A195-T349 PolarHBondContact O-OG1 3.09Å
196	V	94.6	Very high	90.4	Very high	27 Å²	27	36.2 Å²	36.2	16%	0.164	19%	0.19	C	C	.	.	H	α-helix	trans	-62.4	-44.6	176.3	-178.7	0	0	0	0	111	F147 Y149 H192 E193 N199 F200 T349	F147-V196 HydrophobicContact CE1-CG1 4.02Å; F147-V196 HydrophobicContact CZ-CG1 3.93Å; Y149-V196 HydrophobicContact CD2-CB 3.93Å; Y149-V196 HydrophobicContact CD2-CG1 3.75Å; Y149-V196 HydrophobicContact CE2-CB 3.88Å; Y149-V196 HydrophobicContact CE2-CG1 3.61Å; H192-V196 WeakPolarHBondContact O-CG2 3.13Å; H192-V196 PolarHBondContact O-N 3.45Å; E193-V196 PolarHBondContact O-N 3.14Å; V196-N199 PolarHBondContact O-N 3.22Å; V196-F200 PolarHBondContact O-N 3.16Å; V196-F200 VanDerWaalsContact O-N 3.09Å; V196-T349 HydrophobicContact CB-CG2 4.46Å; V196-T349 HydrophobicContact CG2-CG2 3.6Å
197	G	92.7	Very high	89.9	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-59.9	-47.8	176.5	0	0	0	0	0	112.6	E193 T194 N199 F200 L201	E193-G197 PolarHBondContact O-N 3.08Å; T194-G197 PolarHBondContact O-N 3.06Å; G197-N199 PolarHBondContact O-N 3.38Å; G197-F200 WeakPolarHBondContact O-CB 3.35Å; G197-F200 PolarHBondContact O-N 3.36Å; G197-L201 WeakPolarHBondContact O-CG 3.47Å; G197-L201 PolarHBondContact O-N 3.26Å
198	M	92.8	Very high	89.4	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66.6	-35.9	177.3	-72.3	-56	-56.6	0	0	113.1	T194 A195 F200 L201 H202 H210 L213 I228 D274 F345	T194-M198 WeakPolarHBondContact O-CG 3.35Å; T194-M198 PolarHBondContact O-N 2.99Å; A195-M198 PolarHBondContact O-N 2.84Å; M198-F200 VanDerWaalsContact C-N 3.32Å; M198-F200 PolarHBondContact O-N 2.91Å; M198-L201 HydrophobicContact CE-CD1 4.36Å; M198-L201 PolarHBondContact O-N 3.06Å; M198-L201 HydrophobicContact SD-CD1 3.85Å; M198-H202 PolarHBondContact O-N 3.24Å; M198-H202 VanDerWaalsContact O-N 3.12Å; M198-H210 HydrophobicContact CE-CB 3.8Å; M198-H210 HydrophobicContact SD-CB 4.21Å; M198-L213 HydrophobicContact CG-CD2 4.07Å; M198-L213 HydrophobicContact SD-CD1 4.17Å; M198-L213 HydrophobicContact SD-CD2 4.14Å; M198-I228 HydrophobicContact CG-CD1 3.84Å; M198-I228 HydrophobicContact SD-CD1 3.86Å; M198-I228 HydrophobicContact SD-CG2 4.49Å; M198-D274 HydrophobicContact CE-CB 3.75Å; M198-D274 WeakPolarHBondContact CE-OD2 3.48Å; M198-F345 HydrophobicContact CB-CD1 3.49Å; M198-F345 VanDerWaalsContact CB-CD1 3.49Å; M198-F345 HydrophobicContact CB-CD2 4.18Å; M198-F345 HydrophobicContact CB-CE1 3.3Å; M198-F345 HydrophobicContact CB-CE2 4Å; M198-F345 HydrophobicContact CB-CG 3.93Å; M198-F345 HydrophobicContact CB-CZ 3.56Å; M198-F345 HydrophobicContact CE-CE2 4.24Å; M198-F345 HydrophobicContact CE-CZ 4.24Å; M198-F345 HydrophobicContact CG-CD1 4.49Å; M198-F345 HydrophobicContact CG-CE1 3.83Å; M198-F345 HydrophobicContact CG-CZ 3.86Å
199	N	93.8	Very high	88.9	Confident	35 Å²	35	39 Å²	39	19%	0.187	21%	0.21	C	C	.	.	H	α-helix	trans	-60.1	-43.4	174	-173.8	59.9	0	0	0	111.5	A195 V196 G197 L201 H202 C203 F345 Q346	A195-N199 WeakPolarHBondContact O-CB 3.49Å; A195-N199 PolarHBondContact O-N 2.92Å; V196-N199 PolarHBondContact O-N 3.22Å; G197-N199 PolarHBondContact O-N 3.38Å; N199-L201 PolarHBondContact O-N 3.41Å; N199-H202 PolarHBondContact O-N 3.11Å; N199-C203 WeakPolarHBondContact O-CB 3.2Å; N199-C203 PolarHBondContact O-N 3.4Å; N199-C203 PolarHBondContact O-SG 3.16Å; N199-F345 HydrophobicContact CB-CB 3.9Å; N199-Q346 VanDerWaalsContact OD1-CA 3.25Å; N199-Q346 WeakPolarHBondContact OD1-CA 3.32Å; N199-Q346 PolarHBondContact OD1-N 3.02Å
200	F	91.9	Very high	88.4	Confident	56 Å²	56	33.6 Å²	33.6	25%	0.246	19%	0.19	C	C	.	.	H	α-helix	trans	-57.4	-47.4	175.9	170.4	-97.7	0	0	0	111.9	A145 F147 I150 V196 G197 M198 H202 C203 M204	A145-F200 HydrophobicContact CB-CE1 4.36Å; F147-F200 HydrophobicContact CB-CD1 3.52Å; F147-F200 HydrophobicContact CB-CD2 4.1Å; F147-F200 HydrophobicContact CB-CE1 3.43Å; F147-F200 VanDerWaalsContact CB-CE1 3.43Å; F147-F200 HydrophobicContact CB-CE2 4.02Å; F147-F200 HydrophobicContact CB-CG 3.86Å; F147-F200 HydrophobicContact CB-CZ 3.7Å; F147-F200 HydrophobicContact CD1-CB 3.64Å; F147-F200 AromaticContact CD1-CD1 3.85Å; F147-F200 HydrophobicContact CD1-CD1 3.85Å; F147-F200 HydrophobicContact CD1-CD2 4.21Å; F147-F200 AromaticContact CD1-CG 3.62Å; F147-F200 HydrophobicContact CD1-CG 3.62Å; F147-F200 AromaticContact CD2-CD2 3.86Å; F147-F200 HydrophobicContact CD2-CD2 3.86Å; F147-F200 HydrophobicContact CD2-CE2 4.15Å; F147-F200 HydrophobicContact CD2-CG 4.12Å; F147-F200 HydrophobicContact CE1-CB 3.69Å; F147-F200 HydrophobicContact CE1-CG 4.11Å; F147-F200 HydrophobicContact CE2-CD2 4.31Å; F147-F200 HydrophobicContact CG-CB 4.14Å; F147-F200 AromaticContact CG-CD1 3.78Å; F147-F200 HydrophobicContact CG-CD1 3.78Å; F147-F200 AromaticContact CG-CD2 3.82Å; F147-F200 HydrophobicContact CG-CD2 3.82Å; F147-F200 HydrophobicContact CG-CE1 4.14Å; F147-F200 HydrophobicContact CG-CE2 4.16Å; F147-F200 AromaticContact CG-CG 3.61Å; F147-F200 HydrophobicContact CG-CG 3.61Å; F147-F200 HydrophobicContact CG-CZ 4.33Å; F147-F200 HydrophobicContact CZ-CB 4.28Å; I150-F200 HydrophobicContact CG1-CD1 4.2Å; V196-F200 PolarHBondContact O-N 3.16Å; V196-F200 VanDerWaalsContact O-N 3.09Å; G197-F200 WeakPolarHBondContact O-CB 3.35Å; G197-F200 PolarHBondContact O-N 3.36Å; M198-F200 VanDerWaalsContact C-N 3.32Å; M198-F200 PolarHBondContact O-N 2.91Å; F200-H202 VanDerWaalsContact C-N 3.31Å; F200-H202 PolarHBondContact O-N 3.46Å; F200-C203 PolarHBondContact O-N 2.67Å; F200-C203 VanDerWaalsContact O-N 3.15Å; F200-M204 HydrophobicContact CE1-SD 4.11Å; F200-M204 HydrophobicContact CZ-SD 4.28Å; F200-M204 PolarHBondContact O-N 2.74Å
201	L	87	Confident	87.7	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.8	-40.2	179.6	-61.3	174.7	0	0	0	112.5	A145 I150 G197 M198 N199 C203 M204 L208 F231	A145-L201 HydrophobicContact CB-CD2 4.33Å; I150-L201 HydrophobicContact CD1-CD1 3.94Å; I150-L201 HydrophobicContact CD1-CD2 3.72Å; I150-L201 HydrophobicContact CD1-CG 3.85Å; I150-L201 HydrophobicContact CG1-CD2 4.2Å; G197-L201 WeakPolarHBondContact O-CG 3.47Å; G197-L201 PolarHBondContact O-N 3.26Å; M198-L201 HydrophobicContact CE-CD1 4.36Å; M198-L201 PolarHBondContact O-N 3.06Å; M198-L201 HydrophobicContact SD-CD1 3.85Å; N199-L201 PolarHBondContact O-N 3.41Å; L201-C203 VanDerWaalsContact C-N 3.32Å; L201-M204 HydrophobicContact CB-CE 4.42Å; L201-M204 HydrophobicContact CD2-CE 3.67Å; L201-M204 PolarHBondContact O-N 2.62Å; L201-L208 HydrophobicContact CB-CB 4.44Å; L201-L208 WeakPolarHBondContact CB-O 3.37Å; L201-L208 HydrophobicContact CD2-CD2 4.18Å; L201-L208 PolarHBondContact O-N 2.87Å; L201-F231 HydrophobicContact CD1-CD1 3.87Å; L201-F231 HydrophobicContact CD1-CE1 3.21Å; L201-F231 HydrophobicContact CD1-CZ 3.95Å; L201-F231 HydrophobicContact CD2-CE1 4.27Å; L201-F231 HydrophobicContact CD2-CZ 4.35Å; L201-F231 HydrophobicContact CG-CE1 4.37Å
202	H	89	Confident	87	Confident	29 Å²	29	34.9 Å²	34.9	13%	0.134	20%	0.196	C	C	.	.	H	α-helix	trans	-76.7	-17.7	179.2	-71.7	-165.3	0	0	0	113.6	M198 N199 F200 P207 T271 D274 F345	M198-H202 PolarHBondContact O-N 3.24Å; M198-H202 VanDerWaalsContact O-N 3.12Å; N199-H202 PolarHBondContact O-N 3.11Å; F200-H202 VanDerWaalsContact C-N 3.31Å; F200-H202 PolarHBondContact O-N 3.46Å; H202-P207 WeakPolarHBondContact O-CB 3.29Å; H202-T271 HydrophobicContact CB-CG2 4.18Å; H202-T271 VanDerWaalsContact CE1-CB 3.48Å; H202-T271 WeakPolarHBondContact CE1-CB 3.32Å; H202-T271 PolarHBondContact CE1-O 3.21Å; H202-T271 VanDerWaalsContact CE1-O 3.29Å; H202-T271 VanDerWaalsContact ND1-CB 3.35Å; H202-T271 WeakPolarHBondContact ND1-CB 3.47Å; H202-T271 WeakPolarHBondContact ND1-CG2 3.19Å; H202-D274 IonicContact CD2-OD2 3.05Å; H202-D274 IonicContact CE1-OD2 3.82Å; H202-D274 IonicContact NE2-OD2 2.75Å; H202-D274 PolarHBondContact NE2-OD2 2.66Å; H202-F345 AromaticContact CE1-CD2 3.37Å; H202-F345 WeakPolarHBondContact CE1-CD2 3.44Å; H202-F345 AromaticContact CE1-CE2 3.46Å; H202-F345 VanDerWaalsContact CE1-CE2 3.46Å; H202-F345 WeakPolarHBondContact CE1-CE2 3.38Å; H202-F345 AromaticContact ND1-CD2 3.3Å; H202-F345 VanDerWaalsContact ND1-CD2 3.3Å; H202-F345 WeakPolarHBondContact ND1-CD2 3.24Å; H202-F345 AromaticContact ND1-CE2 3.91Å
203	C	87.2	Confident	86.6	Confident	88 Å²	88	33 Å²	33	60%	0.595	19%	0.188	S	C	*	.	H	α-helix	trans	-85.9	-9.5	173.4	-72.6	0	0	0	0	113.5	N199 F200 L201	N199-C203 WeakPolarHBondContact O-CB 3.2Å; N199-C203 PolarHBondContact O-N 3.4Å; N199-C203 PolarHBondContact O-SG 3.16Å; F200-C203 PolarHBondContact O-N 2.67Å; F200-C203 VanDerWaalsContact O-N 3.15Å; L201-C203 VanDerWaalsContact C-N 3.32Å
204	M	81.6	Confident	86.2	Confident	42 Å²	42	34 Å²	34	21%	0.207	19%	0.192	C	C	.	.	S	Bend	trans	-65	157.7	173.4	-65.1	-159.9	-77.1	0	0	111.3	A145 F200 L201 P206 P207 L208	A145-M204 HydrophobicContact CB-CE 3.88Å; A145-M204 HydrophobicContact CB-SD 4.18Å; F200-M204 HydrophobicContact CE1-SD 4.11Å; F200-M204 HydrophobicContact CZ-SD 4.28Å; F200-M204 PolarHBondContact O-N 2.74Å; L201-M204 HydrophobicContact CB-CE 4.42Å; L201-M204 HydrophobicContact CD2-CE 3.67Å; L201-M204 PolarHBondContact O-N 2.62Å; M204-P206 VanDerWaalsContact C-C 3.44Å; M204-P206 CarbonylContact C-O 3.27Å; M204-P206 VanDerWaalsContact C-O 3.27Å; M204-P206 CarbonylContact O-C 3.59Å; M204-P207 VanDerWaalsContact O-CA 3.22Å; M204-P207 WeakPolarHBondContact O-CA 3.38Å; M204-L208 HydrophobicContact CE-CB 3.29Å; M204-L208 HydrophobicContact CE-CD2 3.6Å; M204-L208 HydrophobicContact CE-CG 4.04Å
205	N	72.8	Confident	85.8	Confident	162 Å²	162	34.3 Å²	34.3	87%	0.866	19%	0.194	S	C	*	.	S	Bend	trans	-123.1	105.6	179.9	-171.6	34.7	0	0	0	110.6
206	P	76	Confident	85.3	Confident	107 Å²	107	35.6 Å²	35.6	70%	0.695	20%	0.204	S	C	*	.	S	Bend	cis	-70.4	159.5	-2.6	30.7	-35.5	0	0	0	113.2	M204 L208	M204-P206 VanDerWaalsContact C-C 3.44Å; M204-P206 CarbonylContact C-O 3.27Å; M204-P206 VanDerWaalsContact C-O 3.27Å; M204-P206 CarbonylContact O-C 3.59Å; P206-L208 PolarHBondContact O-N 3.45Å
207	P	80.8	Confident	85	Confident	63 Å²	63	34.6 Å²	34.6	41%	0.409	20%	0.198	S	C	.	.			trans	-64.4	133.8	-179.5	25.4	-34.6	0	0	0	111.1	H202 M204 T271	H202-P207 WeakPolarHBondContact O-CB 3.29Å; M204-P207 VanDerWaalsContact O-CA 3.22Å; M204-P207 WeakPolarHBondContact O-CA 3.38Å; P207-T271 HydrophobicContact CB-CG2 4.38Å
208	L	81.6	Confident	84.9	Confident	24 Å²	24	34.6 Å²	34.6	13%	0.126	20%	0.198	C	C	.	.			trans	-90.1	114.8	178	-162.6	71.1	0	0	0	109.6	K141 L201 M204 P206 L233	K141-L208 HydrophobicContact CD-CD1 4.39Å; L201-L208 HydrophobicContact CB-CB 4.44Å; L201-L208 WeakPolarHBondContact CB-O 3.37Å; L201-L208 HydrophobicContact CD2-CD2 4.18Å; L201-L208 PolarHBondContact O-N 2.87Å; M204-L208 HydrophobicContact CE-CB 3.29Å; M204-L208 HydrophobicContact CE-CD2 3.6Å; M204-L208 HydrophobicContact CE-CG 4.04Å; P206-L208 PolarHBondContact O-N 3.45Å; L208-L233 HydrophobicContact CD1-CD1 4.41Å; L208-L233 HydrophobicContact CD1-CD2 3.5Å; L208-L233 HydrophobicContact CD2-CD1 4.22Å; L208-L233 HydrophobicContact CD2-CD2 4.43Å; L208-L233 HydrophobicContact CG-CD2 3.99Å
209	L	82.1	Confident	84.8	Confident	27 Å²	27	36 Å²	36	14%	0.141	21%	0.206	C	C	.	.			trans	-88.6	137.3	179.2	-55.4	-179.9	0	0	0	110.6	L211 S269 T271	L209-L211 HydrophobicContact CB-CD1 4.32Å; L209-L211 HydrophobicContact CB-CD2 3.83Å; L209-L211 HydrophobicContact CB-CG 3.81Å; L209-L211 HydrophobicContact CD1-CD2 4.18Å; L209-S269 WeakPolarHBondContact CD1-O 3.33Å; L209-T271 HydrophobicContact CD2-CG2 3.7Å
210	H	82.8	Confident	84.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.197	C	C	.	.			trans	-82.9	-44.2	179.6	-172.8	-33.7	0	0	0	112.3	M198 D212 L213 I228 S229 D230 F231 G232 D274	M198-H210 HydrophobicContact CE-CB 3.8Å; M198-H210 HydrophobicContact SD-CB 4.21Å; H210-D212 PolarHBondContact CE1-O 3.18Å; H210-D212 PolarHBondContact O-N 3.03Å; H210-L213 PolarHBondContact ND1-N 3.4Å; H210-I228 VanDerWaalsContact CD2-CG2 3.47Å; H210-I228 WeakPolarHBondContact CD2-CG2 3.45Å; H210-S229 PolarHBondContact NE2-O 3.33Å; H210-D230 PolarHBondContact CE1-O 2.85Å; H210-F231 HydrophobicContact CB-CD1 4.11Å; H210-F231 AromaticContact CD2-CD1 3.71Å; H210-F231 AromaticContact CD2-CE1 3.8Å; H210-F231 AromaticContact CG-CD1 3.82Å; H210-G232 PolarHBondContact O-N 3.45Å; H210-D274 PolarHBondContact N-OD1 3.49Å; H210-D274 PolarHBondContact N-OD2 2.98Å
211	L	79	Confident	84.4	Confident	12 Å²	12	33.3 Å²	33.3	6%	0.063	19%	0.194	C	C	.	.	S	Bend	trans	63.2	-8.6	174.3	-53.4	179.2	0	0	0	117.8	L209 W236 D274	L209-L211 HydrophobicContact CB-CD1 4.32Å; L209-L211 HydrophobicContact CB-CD2 3.83Å; L209-L211 HydrophobicContact CB-CG 3.81Å; L209-L211 HydrophobicContact CD1-CD2 4.18Å; L211-W236 HydrophobicContact CD1-CE3 3.74Å; L211-W236 HydrophobicContact CD1-CZ3 3.76Å; L211-D274 PolarHBondContact N-OD1 3.09Å
212	D	79.6	Confident	84.1	Confident	15 Å²	15	34.9 Å²	34.9	8%	0.08	21%	0.21	C	C	.	.			trans	-140.9	39.6	173.4	-168.7	38.4	0	0	0	111.5	H210 K214 N217 G252 T253	H210-D212 PolarHBondContact CE1-O 3.18Å; H210-D212 PolarHBondContact O-N 3.03Å; D212-K214 PolarHBondContact O-N 3.28Å; D212-K214 IonicContact OD1-NZ 2.83Å; D212-K214 WeakPolarHBondContact OD2-CE 3.42Å; D212-K214 IonicContact OD2-NZ 3.81Å; D212-K214 PolarHBondContact OD2-NZ 3.01Å; D212-N217 PolarHBondContact O-ND2 2.88Å; D212-N217 PolarHBondContact OD2-ND2 3.07Å; D212-G252 VanDerWaalsContact OD1-CA 3.32Å; D212-G252 WeakPolarHBondContact OD1-CA 3.34Å; D212-T253 PolarHBondContact OD1-N 3.49Å; D212-T253 PolarHBondContact OD1-OG1 2.99Å
213	L	87	Confident	84	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.236	C	C	.	.			trans	-66.8	117.4	177.9	-176.2	68.9	0	0	0	110.5	M198 H210 I218 I228 F278 V281	M198-L213 HydrophobicContact CG-CD2 4.07Å; M198-L213 HydrophobicContact SD-CD1 4.17Å; M198-L213 HydrophobicContact SD-CD2 4.14Å; H210-L213 PolarHBondContact ND1-N 3.4Å; L213-I218 HydrophobicContact CD1-CD1 4.14Å; L213-I218 HydrophobicContact CD1-CG1 4.1Å; L213-I228 HydrophobicContact CD1-CG2 4.37Å; L213-F278 HydrophobicContact CD2-CB 3.81Å; L213-F278 HydrophobicContact CD2-CD2 3.97Å; L213-F278 HydrophobicContact CD2-CG 4.32Å; L213-V281 HydrophobicContact CG-CG2 4.46Å
214	K	86.8	Confident	84	Confident	27 Å²	27	40.5 Å²	40.5	12%	0.117	22%	0.224	C	C	.	.			trans	-153.4	164.6	-179.4	69.4	-162.6	-178.6	-158.3	0	110.3	D212 A216 N217 T253 Y256	D212-K214 PolarHBondContact O-N 3.28Å; D212-K214 IonicContact OD1-NZ 2.83Å; D212-K214 WeakPolarHBondContact OD2-CE 3.42Å; D212-K214 IonicContact OD2-NZ 3.81Å; D212-K214 PolarHBondContact OD2-NZ 3.01Å; K214-A216 HydrophobicContact CD-CB 4.38Å; K214-A216 HydrophobicContact CG-CB 4.02Å; K214-A216 PolarHBondContact O-N 2.81Å; K214-A216 VanDerWaalsContact O-N 3.09Å; K214-N217 WeakPolarHBondContact CE-OD1 3.49Å; K214-N217 HydrophobicContact CG-CB 4.3Å; K214-N217 PolarHBondContact O-N 2.92Å; K214-T253 VanDerWaalsContact CD-OG1 3.23Å; K214-T253 WeakPolarHBondContact CD-OG1 3.46Å; K214-T253 PolarHBondContact NZ-OG1 3.05Å; K214-T253 VanDerWaalsContact NZ-OG1 3.11Å; K214-Y256 HydrophobicContact CB-CD1 4.3Å; K214-Y256 HydrophobicContact CB-CD2 4.1Å; K214-Y256 HydrophobicContact CB-CE1 4.32Å; K214-Y256 HydrophobicContact CB-CE2 4.09Å; K214-Y256 HydrophobicContact CB-CG 4.22Å
215	P	87.9	Confident	84.5	Confident	7 Å²	7	40.5 Å²	40.5	5%	0.045	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-58.9	-24.7	-179	-25.8	36.8	0	0	0	114.6	L173 E174 L177 N217 Y256	L173-P215 HydrophobicContact CB-CB 4.35Å; L173-P215 WeakPolarHBondContact CB-O 3.42Å; L173-P215 HydrophobicContact CD2-CB 4.33Å; L173-P215 HydrophobicContact CG-CB 4.23Å; L173-P215 PolarHBondContact N-O 2.83Å; E174-P215 HydrophobicContact CB-CB 4.04Å; E174-P215 PolarHBondContact N-O 3.5Å; L177-P215 HydrophobicContact CD1-CB 4.2Å; L177-P215 HydrophobicContact CD1-CG 4.39Å; P215-N217 VanDerWaalsContact C-N 3.28Å; P215-N217 PolarHBondContact O-N 3.14Å; P215-Y256 VanDerWaalsContact CD-OH 3.27Å; P215-Y256 WeakPolarHBondContact CD-OH 3.37Å; P215-Y256 HydrophobicContact CG-CE1 4.38Å
216	A	84.6	Confident	85.5	Confident	26 Å²	26	32.8 Å²	32.8	22%	0.215	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-68	-27.7	175	0	0	0	0	0	113.4	S172 E174 K214	S172-A216 WeakPolarHBondContact CB-O 3.37Å; E174-A216 HydrophobicContact CB-CB 4.35Å; E174-A216 WeakPolarHBondContact OE2-CB 3.39Å; K214-A216 HydrophobicContact CD-CB 4.38Å; K214-A216 HydrophobicContact CG-CB 4.02Å; K214-A216 PolarHBondContact O-N 2.81Å; K214-A216 VanDerWaalsContact O-N 3.09Å
217	N	88.4	Confident	86.2	Confident	7 Å²	7	28.8 Å²	28.8	4%	0.037	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-99.3	7.6	-176.3	-64.3	-2.5	0	0	0	112.3	D212 K214 P215 S229 D230	D212-N217 PolarHBondContact O-ND2 2.88Å; D212-N217 PolarHBondContact OD2-ND2 3.07Å; K214-N217 WeakPolarHBondContact CE-OD1 3.49Å; K214-N217 HydrophobicContact CG-CB 4.3Å; K214-N217 PolarHBondContact O-N 2.92Å; P215-N217 VanDerWaalsContact C-N 3.28Å; P215-N217 PolarHBondContact O-N 3.14Å; N217-S229 PolarHBondContact O-N 2.91Å; N217-S229 PolarHBondContact O-OG 3.07Å; N217-D230 HydrophobicContact CB-CB 4.41Å
218	I	89.9	Confident	86.7	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	106	173.4	-64.2	167.7	0	0	0	105.8	L173 T194 L213 V226 V281	L173-I218 HydrophobicContact CB-CB 4.09Å; L173-I218 HydrophobicContact CB-CG2 4.1Å; L173-I218 VanDerWaalsContact CB-O 3.28Å; L173-I218 WeakPolarHBondContact CB-O 3.27Å; L173-I218 HydrophobicContact CD2-CB 4.15Å; L173-I218 HydrophobicContact CD2-CD1 4.18Å; L173-I218 HydrophobicContact CD2-CG2 3.9Å; L173-I218 PolarHBondContact N-O 3.5Å; T194-I218 HydrophobicContact CG2-CD1 3.87Å; T194-I218 HydrophobicContact CG2-CG1 4.4Å; L213-I218 HydrophobicContact CD1-CD1 4.14Å; L213-I218 HydrophobicContact CD1-CG1 4.1Å; I218-V226 HydrophobicContact CG2-CG1 3.83Å; I218-V226 HydrophobicContact CG2-CG2 4.32Å; I218-V281 HydrophobicContact CD1-CG1 3.63Å; I218-V281 HydrophobicContact CD1-CG2 4.46Å
219	L	91.8	Very high	86.9	Confident	29 Å²	29	24.9 Å²	24.9	15%	0.152	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	158.4	-179	-51.3	-177.6	0	0	0	110.6	L151 M168 G171 V226 K227	L151-L219 HydrophobicContact CD1-CD1 4.28Å; L151-L219 HydrophobicContact CD2-CD1 3.95Å; M168-L219 HydrophobicContact CB-CB 4.05Å; M168-L219 HydrophobicContact CB-CD1 4.3Å; M168-L219 HydrophobicContact CE-CB 4.26Å; M168-L219 HydrophobicContact CG-CB 3.73Å; M168-L219 HydrophobicContact CG-CD1 3.67Å; M168-L219 HydrophobicContact CG-CG 4.35Å; G171-L219 WeakPolarHBondContact O-CA 3.41Å; L219-V226 CarbonylContact O-C 3.58Å; L219-V226 WeakPolarHBondContact O-CA 3.33Å; L219-K227 HydrophobicContact CB-CB 4.45Å; L219-K227 PolarHBondContact N-O 3.25Å; L219-K227 PolarHBondContact O-N 2.85Å
220	L	88.8	Confident	86.5	Confident	1 Å²	1	25.7 Å²	25.7	1%	0.005	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	135.1	-177.2	-70	165.3	0	0	0	110.6	M168 T170 G171 L173 L176 I190 Y224 H225 V226	M168-L220 WeakPolarHBondContact CE-O 3.34Å; T170-L220 PolarHBondContact N-O 3.08Å; T170-L220 WeakPolarHBondContact OG1-CB 3.3Å; T170-L220 PolarHBondContact OG1-O 3.17Å; G171-L220 PolarHBondContact O-N 3.31Å; L173-L220 HydrophobicContact CD1-CD1 4.15Å; L176-L220 HydrophobicContact CD2-CD1 3.32Å; I190-L220 HydrophobicContact CD1-CD1 4.4Å; I190-L220 HydrophobicContact CD1-CD2 4.46Å; I190-L220 HydrophobicContact CG1-CD2 4.24Å; L220-Y224 WeakPolarHBondContact CD2-O 3.38Å; L220-H225 WeakPolarHBondContact CA-O 3.45Å; L220-V226 HydrophobicContact CD2-CG2 3.86Å
221	D	86.9	Confident	85.8	Confident	33 Å²	33	26 Å²	26	18%	0.176	14%	0.136	C	C	.	.			trans	-79.6	178.6	176.3	71.9	9	0	0	0	111.9	M168 T170 H223 Y224 H225	M168-D221 HydrophobicContact CE-CB 3.72Å; T170-D221 WeakPolarHBondContact CG2-O 3.45Å; T170-D221 PolarHBondContact OG1-O 2.91Å; D221-H223 PolarHBondContact O-N 3.03Å; D221-H223 VanDerWaalsContact OD1-C 3.26Å; D221-H223 VanDerWaalsContact OD1-CA 3.29Å; D221-H223 WeakPolarHBondContact OD1-CA 3.33Å; D221-H223 WeakPolarHBondContact OD1-CB 3.25Å; D221-H223 PolarHBondContact OD1-N 2.9Å; D221-Y224 PolarHBondContact O-N 2.92Å; D221-Y224 PolarHBondContact OD1-N 2.89Å; D221-H225 PolarHBondContact N-O 3.28Å; D221-H225 VanDerWaalsContact N-O 3.08Å; D221-H225 PolarHBondContact OD1-N 2.9Å; D221-H225 IonicContact OD2-CD2 3.12Å
222	G	82	Confident	84.7	Confident	34 Å²	34	26.8 Å²	26.8	35%	0.351	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-10.4	177.3	0	0	0	0	0	114.8
223	H	86.1	Confident	83.3	Confident	145 Å²	145	26.8 Å²	26.8	67%	0.671	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109.7	9	175.7	-62.6	-51.2	0	0	0	113.3	D221 H225	D221-H223 PolarHBondContact O-N 3.03Å; D221-H223 VanDerWaalsContact OD1-C 3.26Å; D221-H223 VanDerWaalsContact OD1-CA 3.29Å; D221-H223 WeakPolarHBondContact OD1-CA 3.33Å; D221-H223 WeakPolarHBondContact OD1-CB 3.25Å; D221-H223 PolarHBondContact OD1-N 2.9Å; H223-H225 VanDerWaalsContact C-N 3.29Å; H223-H225 PolarHBondContact O-N 3.49Å
224	Y	87.6	Confident	81.4	Confident	89 Å²	89	28.1 Å²	28.1	35%	0.349	16%	0.158	S	C	.	.			trans	61.3	29.2	-175.8	-56.5	-94.4	0	0	0	114.6	T170 L176 L186 L220 D221	T170-Y224 HydrophobicContact CG2-CE1 4.46Å; L176-Y224 HydrophobicContact CD1-CE1 4.22Å; L176-Y224 HydrophobicContact CD2-CD1 4.11Å; L176-Y224 HydrophobicContact CD2-CE1 4.16Å; L186-Y224 HydrophobicContact CD1-CG 4.48Å; L186-Y224 HydrophobicContact CD2-CD1 4.1Å; L186-Y224 HydrophobicContact CD2-CG 4.3Å; L220-Y224 WeakPolarHBondContact CD2-O 3.38Å; D221-Y224 PolarHBondContact O-N 2.92Å; D221-Y224 PolarHBondContact OD1-N 2.89Å
225	H	91.4	Very high	79.5	Confident	43 Å²	43	34.7 Å²	34.7	20%	0.199	18%	0.183	C	C	.	.			trans	-83	142.7	166.7	-72.4	-63.3	0	0	0	111.5	E193 L220 D221 H223	E193-H225 IonicContact OE1-CE1 3.63Å; E193-H225 PolarHBondContact OE1-CE1 2.83Å; E193-H225 IonicContact OE1-ND1 3.72Å; E193-H225 PolarHBondContact OE1-ND1 2.95Å; E193-H225 WeakPolarHBondContact OE2-CA 3.47Å; E193-H225 IonicContact OE2-ND1 2.85Å; E193-H225 PolarHBondContact OE2-ND1 3.3Å; L220-H225 WeakPolarHBondContact CA-O 3.45Å; D221-H225 PolarHBondContact N-O 3.28Å; D221-H225 VanDerWaalsContact N-O 3.08Å; D221-H225 PolarHBondContact OD1-N 2.9Å; D221-H225 IonicContact OD2-CD2 3.12Å; H223-H225 VanDerWaalsContact C-N 3.29Å; H223-H225 PolarHBondContact O-N 3.49Å
226	V	93.5	Very high	77.1	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	137.1	-176.2	169.6	0	0	0	0	112.3	Y149 I190 E193 I218 L219 L220 I228	Y149-V226 WeakPolarHBondContact CA-O 3.47Å; Y149-V226 WeakPolarHBondContact CD1-O 3.45Å; I190-V226 HydrophobicContact CB-CG2 4.26Å; I190-V226 HydrophobicContact CG1-CG2 4.31Å; I190-V226 HydrophobicContact CG2-CG2 3.91Å; E193-V226 HydrophobicContact CB-CB 3.9Å; E193-V226 HydrophobicContact CB-CG2 3.97Å; E193-V226 PolarHBondContact OE2-N 3.23Å; I218-V226 HydrophobicContact CG2-CG1 3.83Å; I218-V226 HydrophobicContact CG2-CG2 4.32Å; L219-V226 CarbonylContact O-C 3.58Å; L219-V226 WeakPolarHBondContact O-CA 3.33Å; L220-V226 HydrophobicContact CD2-CG2 3.86Å; V226-I228 HydrophobicContact CG1-CG1 4.18Å
227	K	92.1	Very high	74.6	Confident	23 Å²	23	44.4 Å²	44.4	10%	0.1	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	117.4	164.8	-62.8	-67.4	-168.3	161.7	0	109.7	R148 Y149 L151 E166 M168 L219	R148-K227 VanDerWaalsContact O-CD 3.24Å; R148-K227 WeakPolarHBondContact O-CD 3.44Å; R148-K227 VanDerWaalsContact O-CE 3.26Å; R148-K227 WeakPolarHBondContact O-CE 3.45Å; R148-K227 PolarHBondContact O-NZ 3.28Å; Y149-K227 CarbonylContact O-C 3.47Å; Y149-K227 WeakPolarHBondContact O-CA 3.4Å; L151-K227 HydrophobicContact CB-CB 4.37Å; L151-K227 HydrophobicContact CD1-CB 4.24Å; E166-K227 IonicContact OE2-NZ 2.69Å; M168-K227 HydrophobicContact CE-CB 3.77Å; M168-K227 HydrophobicContact CE-CG 3.31Å; M168-K227 HydrophobicContact SD-CB 4.2Å; M168-K227 HydrophobicContact SD-CG 3.83Å; L219-K227 HydrophobicContact CB-CB 4.45Å; L219-K227 PolarHBondContact N-O 3.25Å; L219-K227 PolarHBondContact O-N 2.85Å
228	I	90.3	Very high	71.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	130.2	176.8	-53.6	174	0	0	0	108.7	Y149 I150 L151 T194 M198 H210 L213 V226 F231	Y149-I228 PolarHBondContact O-N 2.91Å; I150-I228 HydrophobicContact CD1-CB 4.1Å; I150-I228 HydrophobicContact CD1-CD1 4.27Å; L151-I228 WeakPolarHBondContact CB-O 3.49Å; L151-I228 PolarHBondContact N-O 3.45Å; T194-I228 HydrophobicContact CG2-CD1 4.38Å; M198-I228 HydrophobicContact CG-CD1 3.84Å; M198-I228 HydrophobicContact SD-CD1 3.86Å; M198-I228 HydrophobicContact SD-CG2 4.49Å; H210-I228 VanDerWaalsContact CD2-CG2 3.47Å; H210-I228 WeakPolarHBondContact CD2-CG2 3.45Å; L213-I228 HydrophobicContact CD1-CG2 4.37Å; V226-I228 HydrophobicContact CG1-CG1 4.18Å; I228-F231 HydrophobicContact CB-CE1 4.27Å; I228-F231 HydrophobicContact CB-CZ 4.14Å; I228-F231 HydrophobicContact CG2-CE1 3.5Å; I228-F231 VanDerWaalsContact CG2-CE1 3.5Å; I228-F231 HydrophobicContact CG2-CZ 3.81Å
229	S	86.8	Confident	69.1	Low	4 Å²	4	55.6 Å²	55.6	3%	0.028	30%	0.297	C	S	.	.			trans	-126.8	173.4	-178.9	69.7	0	0	0	0	111.6	H210 N217 F231	H210-S229 PolarHBondContact NE2-O 3.33Å; N217-S229 PolarHBondContact O-N 2.91Å; N217-S229 PolarHBondContact O-OG 3.07Å; S229-F231 PolarHBondContact O-N 2.78Å
230	D	74.2	Confident	66	Low	45 Å²	45	57.8 Å²	57.8	24%	0.241	32%	0.319	C	S	.	.			trans	53	53.8	169.8	-66.3	-18.2	0	0	0	114.5	K120 H210 N217 G232	K120-D230 IonicContact NZ-OD1 2.69Å; K120-D230 PolarHBondContact NZ-OD1 2.81Å; K120-D230 IonicContact NZ-OD2 3.84Å; H210-D230 PolarHBondContact CE1-O 2.85Å; N217-D230 HydrophobicContact CB-CB 4.41Å; D230-G232 PolarHBondContact O-N 2.69Å
231	F	67.6	Low	63.3	Low	5 Å²	5	65.8 Å²	65.8	2%	0.022	36%	0.357	C	S	.	.			trans	-60.9	132.6	165.6	-50.4	-70.7	0	0	0	108	M142 I150 L201 H210 I228 S229 L233	M142-F231 HydrophobicContact CE-CD2 4.21Å; M142-F231 HydrophobicContact CE-CE2 3.72Å; M142-F231 HydrophobicContact SD-CD2 3.2Å; M142-F231 WeakPolarHBondContact SD-CD2 3.19Å; M142-F231 HydrophobicContact SD-CE2 3.22Å; M142-F231 WeakPolarHBondContact SD-CE2 3.46Å; I150-F231 HydrophobicContact CD1-CZ 3.95Å; I150-F231 HydrophobicContact CG2-CE2 3.87Å; I150-F231 HydrophobicContact CG2-CZ 3.83Å; L201-F231 HydrophobicContact CD1-CD1 3.87Å; L201-F231 HydrophobicContact CD1-CE1 3.21Å; L201-F231 HydrophobicContact CD1-CZ 3.95Å; L201-F231 HydrophobicContact CD2-CE1 4.27Å; L201-F231 HydrophobicContact CD2-CZ 4.35Å; L201-F231 HydrophobicContact CG-CE1 4.37Å; H210-F231 HydrophobicContact CB-CD1 4.11Å; H210-F231 AromaticContact CD2-CD1 3.71Å; H210-F231 AromaticContact CD2-CE1 3.8Å; H210-F231 AromaticContact CG-CD1 3.82Å; I228-F231 HydrophobicContact CB-CE1 4.27Å; I228-F231 HydrophobicContact CB-CZ 4.14Å; I228-F231 HydrophobicContact CG2-CE1 3.5Å; I228-F231 VanDerWaalsContact CG2-CE1 3.5Å; I228-F231 HydrophobicContact CG2-CZ 3.81Å; S229-F231 PolarHBondContact O-N 2.78Å; F231-L233 HydrophobicContact CB-CD1 3.53Å; F231-L233 HydrophobicContact CB-CD2 4.12Å; F231-L233 HydrophobicContact CB-CG 3.47Å; F231-L233 VanDerWaalsContact CB-CG 3.47Å; F231-L233 HydrophobicContact CD2-CD1 4.35Å; F231-L233 HydrophobicContact CG-CD1 4.27Å; F231-L233 PolarHBondContact O-N 2.96Å
232	G	54.4	Low	60.6	Low	30 Å²	30	70.1 Å²	70.1	31%	0.309	39%	0.385	S	S	.	.	S	Bend	trans	-69.6	40.6	-175.8	0	0	0	0	0	115.1	H210 D230	H210-G232 PolarHBondContact O-N 3.45Å; D230-G232 PolarHBondContact O-N 2.69Å
233	L	52	Low	57.9	Low	15 Å²	15	76.1 Å²	76.1	8%	0.079	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-76.6	-31.4	-164	-61.8	172.4	0	0	0	113.6	K141 L208 F231 R235 W236	K141-L233 HydrophobicContact CB-CD1 3.87Å; K141-L233 HydrophobicContact CD-CB 4.28Å; K141-L233 HydrophobicContact CD-CD1 3.95Å; K141-L233 HydrophobicContact CD-CD2 4.19Å; K141-L233 HydrophobicContact CD-CG 4.35Å; L208-L233 HydrophobicContact CD1-CD1 4.41Å; L208-L233 HydrophobicContact CD1-CD2 3.5Å; L208-L233 HydrophobicContact CD2-CD1 4.22Å; L208-L233 HydrophobicContact CD2-CD2 4.43Å; L208-L233 HydrophobicContact CG-CD2 3.99Å; F231-L233 HydrophobicContact CB-CD1 3.53Å; F231-L233 HydrophobicContact CB-CD2 4.12Å; F231-L233 HydrophobicContact CB-CG 3.47Å; F231-L233 VanDerWaalsContact CB-CG 3.47Å; F231-L233 HydrophobicContact CD2-CD1 4.35Å; F231-L233 HydrophobicContact CG-CD1 4.27Å; F231-L233 PolarHBondContact O-N 2.96Å; L233-R235 PolarHBondContact O-N 3.31Å; L233-W236 PolarHBondContact O-N 2.8Å
234	A	46	Very low	55.1	Low	28 Å²	28	76.6 Å²	76.6	23%	0.231	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-62.4	-23.8	178.5	0	0	0	0	0	113	E134	E134-A234 HydrophobicContact CB-CB 4.28Å
235	R	47.4	Very low	52.3	Low	165 Å²	165	79.9 Å²	79.9	62%	0.623	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-91.3	2.9	-177.5	-69	-171	169.8	-171.3	-2.9	115	L233 C251	L233-R235 PolarHBondContact O-N 3.31Å; R235-C251 VanDerWaalsContact CD-SG 3.59Å
236	W	37.5	Very low	49.4	Very low	129 Å²	129	83.1 Å²	83.1	49%	0.489	47%	0.466	S	S	.	.			trans	-101.3	14.1	-171	-163.7	-90.9	0	0	0	115.1	L211 L233	L211-W236 HydrophobicContact CD1-CE3 3.74Å; L211-W236 HydrophobicContact CD1-CZ3 3.76Å; L233-W236 PolarHBondContact O-N 2.8Å
237	N	30.9	Very low	46.6	Very low	107 Å²	107	94 Å²	94	57%	0.572	51%	0.507	S	S	*	.			trans	-106	90.7	173.8	-75	2.6	0	0	0	110.9	L239	N237-L239 PolarHBondContact O-N 3.38Å
238	G	33.1	Very low	43.9	Very low	74 Å²	74	99 Å²	99	76%	0.763	53%	0.531	S	S	*	.			trans	-69.9	109.3	169.9	0	0	0	0	0	111.5
239	L	29.9	Very low	41.5	Very low	168 Å²	168	102 Å²	102	88%	0.88	56%	0.561	S	S	*	*			trans	163	95.7	139.7	-91.1	154.1	0	0	0	110	N237	N237-L239 PolarHBondContact O-N 3.38Å
240	A	27.4	Very low	39.7	Very low	75 Å²	75	105.2 Å²	105.2	62%	0.62	58%	0.575	S	S	*	*			trans	-138.3	100.2	146.9	0	0	0	0	0	106.6
241	Q	32.1	Very low	38.5	Very low	169 Å²	169	104.5 Å²	104.5	79%	0.79	57%	0.573	S	S	*	*			trans	-57.4	152.4	159.4	-100.3	171.6	-20.1	0	0	109
242	T	29.5	Very low	38.1	Very low	124 Å²	124	105.4 Å²	105.4	76%	0.761	58%	0.584	S	S	*	*			trans	80.2	75.3	174.7	79.4	0	0	0	0	115.7
243	D	27.1	Very low	38.9	Very low	161 Å²	161	106.3 Å²	106.3	86%	0.861	58%	0.583	S	S	*	*				-174.4	136.3	93.9	-88	-18.7	0	0	0	111.2	I245	D243-I245 PolarHBondContact O-N 3.19Å
244	D	27.1	Very low	40	Very low	155 Å²	155	107.3 Å²	107.3	83%	0.829	59%	0.588	S	S	*	*			trans	-64.7	116.9	-171.9	-92.6	-44.6	0	0	0	113
245	I	28.6	Very low	41.5	Very low	158 Å²	158	106.6 Å²	106.6	81%	0.81	58%	0.583	S	S	*	*	S	Bend	trans	147.3	72.3	134.2	-66.5	154.2	0	0	0	110	D243	D243-I245 PolarHBondContact O-N 3.19Å
246	S	30.3	Very low	43.3	Very low	111 Å²	111	99.9 Å²	99.9	78%	0.776	56%	0.558	S	S	*	*			trans	-175.5	81.2	130.4	-86.1	0	0	0	0	109.6
247	R	33.8	Very low	45.2	Very low	228 Å²	228	93.9 Å²	93.9	86%	0.86	54%	0.535	S	S	*	.			trans	-55.5	135.1	145.1	-69.4	163.5	70.3	162.5	0.8	106.4
248	E	35.9	Very low	47.7	Very low	128 Å²	128	88.8 Å²	88.8	60%	0.598	51%	0.508	S	S	*	.			trans	90.7	73.7	173	-52.6	169.9	-176.4	0	0	117.9	K265	E248-K265 VanDerWaalsContact CD-CE 3.41Å; E248-K265 HydrophobicContact CG-CD 4.32Å; E248-K265 WeakPolarHBondContact OE1-CD 3.44Å; E248-K265 VanDerWaalsContact OE1-CE 3.31Å; E248-K265 WeakPolarHBondContact OE1-CE 3.32Å; E248-K265 IonicContact OE1-NZ 3.39Å; E248-K265 PolarHBondContact OE1-NZ 2.86Å; E248-K265 VanDerWaalsContact OE2-CE 3.31Å; E248-K265 WeakPolarHBondContact OE2-CE 3.46Å; E248-K265 IonicContact OE2-NZ 3.26Å; E248-K265 PolarHBondContact OE2-NZ 3.36Å
249	G	40.5	Very low	49.9	Very low	63 Å²	63	85.6 Å²	85.6	65%	0.649	47%	0.474	S	S	*	.			trans	-99.1	102	161.9	0	0	0	0	0	111.5	C251	G249-C251 PolarHBondContact O-N 3.4Å; G249-C251 VanDerWaalsContact O-N 3.1Å
250	F	47.9	Very low	52.3	Low	72 Å²	72	78.2 Å²	78.2	32%	0.316	44%	0.435	S	S	.	.			trans	-54.2	116.6	166	-79.6	-77.1	0	0	0	109.8	L257 R261 I262	F250-L257 HydrophobicContact CD1-CD2 3.62Å; F250-L257 HydrophobicContact CE1-CD2 4.13Å; F250-L257 HydrophobicContact CG-CD2 4.5Å; F250-R261 VanDerWaalsContact CE1-O 3.31Å; F250-R261 WeakPolarHBondContact CE1-O 3.39Å; F250-I262 HydrophobicContact CE1-CB 4.23Å; F250-I262 HydrophobicContact CE1-CG1 4.06Å; F250-I262 HydrophobicContact CE1-CG2 4.43Å; F250-I262 HydrophobicContact CZ-CB 4.37Å; F250-I262 HydrophobicContact CZ-CG2 4.1Å
251	C	50.1	Low	54.4	Low	30 Å²	30	76.4 Å²	76.4	20%	0.203	41%	0.412	C	S	.	.			trans	-89.4	123	169.5	-63.9	0	0	0	0	108.6	R235 G249 L257 R261	R235-C251 VanDerWaalsContact CD-SG 3.59Å; G249-C251 PolarHBondContact O-N 3.4Å; G249-C251 VanDerWaalsContact O-N 3.1Å; C251-L257 WeakPolarHBondContact O-CD1 3.46Å; C251-R261 PolarHBondContact O-NH1 2.95Å; C251-R261 VanDerWaalsContact O-NH1 3.15Å; C251-R261 PolarHBondContact O-NH2 3.43Å
252	G	57.7	Low	56.2	Low	23 Å²	23	69.4 Å²	69.4	24%	0.237	38%	0.379	C	S	.	.	S	Bend	trans	118	155.2	-178.3	0	0	0	0	0	113.5	D212	D212-G252 VanDerWaalsContact OD1-CA 3.32Å; D212-G252 WeakPolarHBondContact OD1-CA 3.34Å
253	T	71.3	Confident	58	Low	50 Å²	50	68.3 Å²	68.3	31%	0.307	37%	0.368	S	S	.	.			trans	-77.7	121.4	177.2	-54.2	0	0	0	0	109.8	D212 K214 A255 Y256 L257	D212-T253 PolarHBondContact OD1-N 3.49Å; D212-T253 PolarHBondContact OD1-OG1 2.99Å; K214-T253 VanDerWaalsContact CD-OG1 3.23Å; K214-T253 WeakPolarHBondContact CD-OG1 3.46Å; K214-T253 PolarHBondContact NZ-OG1 3.05Å; K214-T253 VanDerWaalsContact NZ-OG1 3.11Å; T253-A255 PolarHBondContact O-N 3.31Å; T253-Y256 HydrophobicContact CG2-CD2 3.94Å; T253-Y256 HydrophobicContact CG2-CE2 4.36Å; T253-Y256 PolarHBondContact O-N 2.93Å; T253-L257 PolarHBondContact O-N 3.11Å
254	I	75.1	Confident	59.8	Low	35 Å²	35	65.1 Å²	65.1	18%	0.179	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-50.5	-36.9	-170.1	-71.7	166.2	0	0	0	113.9	Y256 L257 I298 I301 M302	I254-Y256 PolarHBondContact O-N 3.36Å; I254-L257 PolarHBondContact O-N 2.94Å; I254-I298 HydrophobicContact CB-CD1 3.78Å; I254-I298 HydrophobicContact CB-CG1 4.34Å; I254-I298 HydrophobicContact CD1-CD1 3.76Å; I254-I298 HydrophobicContact CD1-CG1 3.35Å; I254-I298 HydrophobicContact CG1-CD1 4.28Å; I254-I298 HydrophobicContact CG1-CG1 4.38Å; I254-I298 HydrophobicContact CG2-CD1 4.1Å; I254-I301 HydrophobicContact CG2-CG2 4.24Å; I254-M302 HydrophobicContact CG2-CB 4.01Å; I254-M302 HydrophobicContact CG2-CG 4.42Å
255	A	79.4	Confident	61	Low	14 Å²	14	63.8 Å²	63.8	12%	0.116	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-65.4	-20.7	179	0	0	0	0	0	114.4	T253 P291 Y292 I301	T253-A255 PolarHBondContact O-N 3.31Å; A255-P291 HydrophobicContact CB-CG 4.04Å; A255-Y292 HydrophobicContact CB-CD2 4.29Å; A255-I301 HydrophobicContact CB-CG2 4.36Å
256	Y	83.5	Confident	62.1	Low	24 Å²	24	64.1 Å²	64.1	9%	0.094	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-107.9	-5.7	-179.4	-61.9	-93.7	0	0	0	112	K214 P215 T253 I254 Y276 S277 I280 V281 P291	K214-Y256 HydrophobicContact CB-CD1 4.3Å; K214-Y256 HydrophobicContact CB-CD2 4.1Å; K214-Y256 HydrophobicContact CB-CE1 4.32Å; K214-Y256 HydrophobicContact CB-CE2 4.09Å; K214-Y256 HydrophobicContact CB-CG 4.22Å; P215-Y256 VanDerWaalsContact CD-OH 3.27Å; P215-Y256 WeakPolarHBondContact CD-OH 3.37Å; P215-Y256 HydrophobicContact CG-CE1 4.38Å; T253-Y256 HydrophobicContact CG2-CD2 3.94Å; T253-Y256 HydrophobicContact CG2-CE2 4.36Å; T253-Y256 PolarHBondContact O-N 2.93Å; I254-Y256 PolarHBondContact O-N 3.36Å; Y256-Y276 WeakPolarHBondContact O-CD1 3.38Å; Y256-S277 PolarHBondContact O-OG 3.18Å; Y256-I280 HydrophobicContact CD1-CB 3.71Å; Y256-I280 HydrophobicContact CD1-CG2 3.54Å; Y256-I280 HydrophobicContact CE1-CB 4.09Å; Y256-I280 HydrophobicContact CE1-CG2 3.56Å; Y256-I280 HydrophobicContact CG-CG2 4.28Å; Y256-V281 HydrophobicContact CD1-CG2 4.19Å; Y256-V281 HydrophobicContact CE1-CG2 4.1Å; Y256-P291 HydrophobicContact CE1-CG 4.44Å; Y256-P291 HydrophobicContact CE2-CG 4.09Å
257	L	78.9	Confident	63.4	Low	3 Å²	3	63.6 Å²	63.6	2%	0.016	32%	0.319	C	S	.	.	S	Bend	trans	-77.5	136.6	-174.2	-158.5	72.7	0	0	0	111	F250 C251 T253 I254 R261 I262 Y276 V305	F250-L257 HydrophobicContact CD1-CD2 3.62Å; F250-L257 HydrophobicContact CE1-CD2 4.13Å; F250-L257 HydrophobicContact CG-CD2 4.5Å; C251-L257 WeakPolarHBondContact O-CD1 3.46Å; T253-L257 PolarHBondContact O-N 3.11Å; I254-L257 PolarHBondContact O-N 2.94Å; L257-R261 HydrophobicContact CD1-CG 4.29Å; L257-R261 HydrophobicContact CD2-CB 4.32Å; L257-R261 HydrophobicContact CD2-CG 4.24Å; L257-R261 HydrophobicContact CG-CB 4.19Å; L257-R261 HydrophobicContact CG-CG 4.31Å; L257-I262 HydrophobicContact CD2-CD1 4.26Å; L257-I262 HydrophobicContact CD2-CG1 3.69Å; L257-Y276 VanDerWaalsContact O-CE1 3.3Å; L257-Y276 WeakPolarHBondContact O-CE1 3.41Å; L257-V305 WeakPolarHBondContact O-CG1 3.45Å
258	P	81.8	Confident	64.6	Low	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.312	C	S	.	.			trans	-65.3	144.8	172.9	22.6	-30.5	0	0	0	111.7	E260 R261 H273 Y276	P258-E260 VanDerWaalsContact C-N 3.31Å; P258-E260 VanDerWaalsContact CB-CD 3.48Å; P258-E260 HydrophobicContact CB-CG 4.39Å; P258-E260 VanDerWaalsContact CB-OE1 3.27Å; P258-E260 WeakPolarHBondContact CB-OE1 3.47Å; P258-E260 PolarHBondContact O-N 3.43Å; P258-R261 HydrophobicContact CG-CB 4.09Å; P258-R261 WeakPolarHBondContact O-CB 3.38Å; P258-R261 PolarHBondContact O-N 3.13Å; P258-H273 HydrophobicContact CG-CB 4.32Å; P258-Y276 HydrophobicContact CB-CD1 3.84Å; P258-Y276 HydrophobicContact CB-CD2 4.19Å; P258-Y276 HydrophobicContact CB-CE1 4.37Å; P258-Y276 HydrophobicContact CB-CG 3.75Å
259	P	80.8	Confident	66	Low	7 Å²	7	53 Å²	53	5%	0.045	29%	0.289	C	S	.	.	H	α-helix	trans	-62.1	-36.1	-177.2	25.2	-34.5	0	0	0	113.2	R261 I262 I263 V305	P259-R261 PolarHBondContact O-N 2.87Å; P259-I262 PolarHBondContact O-N 3.14Å; P259-I263 WeakPolarHBondContact O-CG1 3.33Å; P259-I263 PolarHBondContact O-N 3.41Å; P259-I263 VanDerWaalsContact O-N 3.15Å; P259-V305 HydrophobicContact CB-CG1 4.21Å; P259-V305 WeakPolarHBondContact CB-O 3.39Å
260	E	78.7	Confident	67.8	Low	13 Å²	13	52.2 Å²	52.2	6%	0.061	27%	0.27	C	S	.	.	H	α-helix	trans	-61.2	-28.7	179	62.5	-86.2	-164.7	0	0	112.7	P258 I262 I263 E264 P339 R342	P258-E260 VanDerWaalsContact C-N 3.31Å; P258-E260 VanDerWaalsContact CB-CD 3.48Å; P258-E260 HydrophobicContact CB-CG 4.39Å; P258-E260 VanDerWaalsContact CB-OE1 3.27Å; P258-E260 WeakPolarHBondContact CB-OE1 3.47Å; P258-E260 PolarHBondContact O-N 3.43Å; E260-I262 VanDerWaalsContact C-N 3.27Å; E260-I262 PolarHBondContact O-N 3.15Å; E260-I263 PolarHBondContact O-N 2.58Å; E260-E264 WeakPolarHBondContact O-CB 3.25Å; E260-E264 PolarHBondContact O-N 3.39Å; E260-P339 HydrophobicContact CG-CG 4.12Å; E260-R342 VanDerWaalsContact CD-NH2 3.25Å; E260-R342 IonicContact OE1-CZ 3.73Å; E260-R342 IonicContact OE1-NH1 2.72Å; E260-R342 PolarHBondContact OE1-NH1 3.14Å; E260-R342 IonicContact OE1-NH2 3.89Å; E260-R342 PolarHBondContact OE1-NH2 3.27Å; E260-R342 IonicContact OE2-NH2 2.67Å; E260-R342 PolarHBondContact OE2-NH2 3.14Å
261	R	72.6	Confident	69.5	Low	36 Å²	36	50.9 Å²	50.9	14%	0.136	27%	0.268	C	S	.	.	H	α-helix	trans	-71.4	-26.3	177.3	-169.8	160	176.8	-176.8	14.5	112.3	F250 C251 L257 P258 P259	F250-R261 VanDerWaalsContact CE1-O 3.31Å; F250-R261 WeakPolarHBondContact CE1-O 3.39Å; C251-R261 PolarHBondContact O-NH1 2.95Å; C251-R261 VanDerWaalsContact O-NH1 3.15Å; C251-R261 PolarHBondContact O-NH2 3.43Å; L257-R261 HydrophobicContact CD1-CG 4.29Å; L257-R261 HydrophobicContact CD2-CB 4.32Å; L257-R261 HydrophobicContact CD2-CG 4.24Å; L257-R261 HydrophobicContact CG-CB 4.19Å; L257-R261 HydrophobicContact CG-CG 4.31Å; P258-R261 HydrophobicContact CG-CB 4.09Å; P258-R261 WeakPolarHBondContact O-CB 3.38Å; P258-R261 PolarHBondContact O-N 3.13Å; P259-R261 PolarHBondContact O-N 2.87Å
262	I	69.4	Low	71.3	Confident	22 Å²	22	50.8 Å²	50.8	11%	0.113	26%	0.264	C	S	.	.	H	α-helix	trans	-81.5	-32.5	176.6	-53.2	168.3	0	0	0	111.2	F250 L257 P259 E260 M302 V305 V306	F250-I262 HydrophobicContact CE1-CB 4.23Å; F250-I262 HydrophobicContact CE1-CG1 4.06Å; F250-I262 HydrophobicContact CE1-CG2 4.43Å; F250-I262 HydrophobicContact CZ-CB 4.37Å; F250-I262 HydrophobicContact CZ-CG2 4.1Å; L257-I262 HydrophobicContact CD2-CD1 4.26Å; L257-I262 HydrophobicContact CD2-CG1 3.69Å; P259-I262 PolarHBondContact O-N 3.14Å; E260-I262 VanDerWaalsContact C-N 3.27Å; E260-I262 PolarHBondContact O-N 3.15Å; I262-M302 HydrophobicContact CD1-CG 4.12Å; I262-M302 HydrophobicContact CG2-CG 3.94Å; I262-M302 HydrophobicContact CG2-SD 4.22Å; I262-V305 HydrophobicContact CD1-CB 4.24Å; I262-V305 HydrophobicContact CD1-CG1 3.74Å; I262-V306 HydrophobicContact CB-CG2 3.76Å; I262-V306 HydrophobicContact CD1-CG2 4.07Å; I262-V306 HydrophobicContact CG2-CG2 3.37Å
263	I	68	Low	72.7	Confident	102 Å²	102	49.9 Å²	49.9	52%	0.523	25%	0.254	S	S	.	.	H	α-helix	trans	-87.8	-43.3	-175.6	-61	164.6	0	0	0	111.6	P259 E260 V306	P259-I263 WeakPolarHBondContact O-CG1 3.33Å; P259-I263 PolarHBondContact O-N 3.41Å; P259-I263 VanDerWaalsContact O-N 3.15Å; E260-I263 PolarHBondContact O-N 2.58Å; I263-V306 HydrophobicContact CD1-CG1 4.12Å; I263-V306 HydrophobicContact CG1-CG1 3.97Å; I263-V306 HydrophobicContact CG1-CG2 4.45Å
264	E	64.3	Low	73.5	Confident	94 Å²	94	47.5 Å²	47.5	44%	0.439	24%	0.239	S	C	.	.			trans	-108.7	93.7	-172.5	-61.5	175.6	173.3	0	0	110.2	E260 D266 R267	E260-E264 WeakPolarHBondContact O-CB 3.25Å; E260-E264 PolarHBondContact O-N 3.39Å; E264-D266 VanDerWaalsContact C-N 3.29Å; E264-D266 PolarHBondContact O-N 2.86Å; E264-R267 HydrophobicContact CB-CB 4.31Å; E264-R267 WeakPolarHBondContact OE2-CD 3.37Å; E264-R267 IonicContact OE2-CZ 2.97Å; E264-R267 IonicContact OE2-NE 3.63Å; E264-R267 IonicContact OE2-NH1 2.6Å; E264-R267 PolarHBondContact OE2-NH1 3.32Å
265	K	53.5	Low	74.3	Confident	127 Å²	127	45.9 Å²	45.9	55%	0.552	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-22.6	-175.3	-73.6	178.4	174.1	175.7	0	114.9	E248	E248-K265 VanDerWaalsContact CD-CE 3.41Å; E248-K265 HydrophobicContact CG-CD 4.32Å; E248-K265 WeakPolarHBondContact OE1-CD 3.44Å; E248-K265 VanDerWaalsContact OE1-CE 3.31Å; E248-K265 WeakPolarHBondContact OE1-CE 3.32Å; E248-K265 IonicContact OE1-NZ 3.39Å; E248-K265 PolarHBondContact OE1-NZ 2.86Å; E248-K265 VanDerWaalsContact OE2-CE 3.31Å; E248-K265 WeakPolarHBondContact OE2-CE 3.46Å; E248-K265 IonicContact OE2-NZ 3.26Å; E248-K265 PolarHBondContact OE2-NZ 3.36Å
266	D	50.3	Low	74.8	Confident	165 Å²	165	45.2 Å²	45.2	88%	0.882	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.1	8.5	-173.5	-71.5	-28.5	0	0	0	114.4	E264	E264-D266 VanDerWaalsContact C-N 3.29Å; E264-D266 PolarHBondContact O-N 2.86Å
267	R	57.6	Low	75.2	Confident	99 Å²	99	44.3 Å²	44.3	37%	0.374	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-85.1	126.3	-177.3	-165.2	165.8	179.5	177.1	-0.3	111.9	E264 S269	E264-R267 HydrophobicContact CB-CB 4.31Å; E264-R267 WeakPolarHBondContact OE2-CD 3.37Å; E264-R267 IonicContact OE2-CZ 2.97Å; E264-R267 IonicContact OE2-NE 3.63Å; E264-R267 IonicContact OE2-NH1 2.6Å; E264-R267 PolarHBondContact OE2-NH1 3.32Å; R267-S269 PolarHBondContact O-N 2.98Å
268	V	59.7	Low	75.9	Confident	117 Å²	117	44.2 Å²	44.2	71%	0.709	22%	0.222	S	C	*	.	P	Polyproline II helix	trans	-61.1	128.4	173.8	-177.3	0	0	0	0	109.4	D270	V268-D270 PolarHBondContact O-N 3.27Å
269	S	66	Low	76.5	Confident	17 Å²	17	44.2 Å²	44.2	12%	0.119	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-63.7	133.8	177.1	-60.7	0	0	0	0	110.4	L209 R267	L209-S269 WeakPolarHBondContact CD1-O 3.33Å; R267-S269 PolarHBondContact O-N 2.98Å
270	D	77.4	Confident	77	Confident	47 Å²	47	43.9 Å²	43.9	25%	0.251	22%	0.22	S	C	.	.			trans	-121	175.5	178.8	80.5	-3.6	0	0	0	111.4	V268 K272 H273	V268-D270 PolarHBondContact O-N 3.27Å; D270-K272 PolarHBondContact O-N 3.44Å; D270-K272 VanDerWaalsContact OD1-CA 3.28Å; D270-K272 WeakPolarHBondContact OD1-CA 3.38Å; D270-K272 WeakPolarHBondContact OD1-CB 3.49Å; D270-K272 PolarHBondContact OD1-N 3.42Å; D270-K272 WeakPolarHBondContact OD2-CG 3.37Å; D270-H273 PolarHBondContact N-CE1 3.5Å; D270-H273 PolarHBondContact N-ND1 3.17Å; D270-H273 WeakPolarHBondContact O-CB 3.43Å; D270-H273 PolarHBondContact O-N 2.79Å; D270-H273 VanDerWaalsContact O-N 3.17Å; D270-H273 PolarHBondContact O-ND1 3.11Å; D270-H273 IonicContact OD1-CE1 3.62Å; D270-H273 PolarHBondContact OD1-CE1 3.14Å; D270-H273 IonicContact OD1-CG 3.94Å; D270-H273 PolarHBondContact OD1-N 3.21Å; D270-H273 IonicContact OD1-ND1 3.95Å; D270-H273 PolarHBondContact OD1-ND1 2.92Å
271	T	83.6	Confident	77.6	Confident	44 Å²	44	43.2 Å²	43.2	27%	0.27	22%	0.217	S	C	.	.	H	α-helix	trans	-60.9	-23	176.9	52.8	0	0	0	0	113.6	H202 P207 L209 H273 D274 V275	H202-T271 HydrophobicContact CB-CG2 4.18Å; H202-T271 VanDerWaalsContact CE1-CB 3.48Å; H202-T271 WeakPolarHBondContact CE1-CB 3.32Å; H202-T271 PolarHBondContact CE1-O 3.21Å; H202-T271 VanDerWaalsContact CE1-O 3.29Å; H202-T271 VanDerWaalsContact ND1-CB 3.35Å; H202-T271 WeakPolarHBondContact ND1-CB 3.47Å; H202-T271 WeakPolarHBondContact ND1-CG2 3.19Å; P207-T271 HydrophobicContact CB-CG2 4.38Å; L209-T271 HydrophobicContact CD2-CG2 3.7Å; T271-H273 PolarHBondContact O-N 3.08Å; T271-D274 PolarHBondContact O-N 2.69Å; T271-V275 PolarHBondContact O-N 3.43Å
272	K	87.3	Confident	78.6	Confident	28 Å²	28	41.5 Å²	41.5	12%	0.122	21%	0.21	C	C	.	.	H	α-helix	trans	-74.5	-14.3	179.6	-52.9	-63.1	-176.7	169.7	0	113	D270 Y276 P339 R342 P343	D270-K272 PolarHBondContact O-N 3.44Å; D270-K272 VanDerWaalsContact OD1-CA 3.28Å; D270-K272 WeakPolarHBondContact OD1-CA 3.38Å; D270-K272 WeakPolarHBondContact OD1-CB 3.49Å; D270-K272 PolarHBondContact OD1-N 3.42Å; D270-K272 WeakPolarHBondContact OD2-CG 3.37Å; K272-Y276 PolarHBondContact O-N 3.19Å; K272-P339 HydrophobicContact CB-CB 4.24Å; K272-R342 HydrophobicContact CD-CB 4.22Å; K272-R342 PolarHBondContact NZ-O 3.28Å; K272-R342 PolarHBondContact O-NH1 3.42Å; K272-P343 VanDerWaalsContact NZ-C 3.27Å; K272-P343 PolarHBondContact NZ-O 3.24Å
273	H	86.9	Confident	79.6	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.019	21%	0.206	C	C	.	.	H	α-helix	trans	-68.9	-47	171.5	-68	70.2	0	0	0	110.9	P258 D270 T271 V275 Y276 S277	P258-H273 HydrophobicContact CG-CB 4.32Å; D270-H273 PolarHBondContact N-CE1 3.5Å; D270-H273 PolarHBondContact N-ND1 3.17Å; D270-H273 WeakPolarHBondContact O-CB 3.43Å; D270-H273 PolarHBondContact O-N 2.79Å; D270-H273 VanDerWaalsContact O-N 3.17Å; D270-H273 PolarHBondContact O-ND1 3.11Å; D270-H273 IonicContact OD1-CE1 3.62Å; D270-H273 PolarHBondContact OD1-CE1 3.14Å; D270-H273 IonicContact OD1-CG 3.94Å; D270-H273 PolarHBondContact OD1-N 3.21Å; D270-H273 IonicContact OD1-ND1 3.95Å; D270-H273 PolarHBondContact OD1-ND1 2.92Å; T271-H273 PolarHBondContact O-N 3.08Å; H273-V275 VanDerWaalsContact C-N 3.27Å; H273-V275 PolarHBondContact O-N 3.03Å; H273-Y276 WeakPolarHBondContact O-CB 3.47Å; H273-Y276 PolarHBondContact O-N 2.95Å; H273-Y276 VanDerWaalsContact O-N 3.15Å; H273-S277 PolarHBondContact O-N 3.27Å; H273-S277 VanDerWaalsContact O-N 3.09Å; H273-S277 PolarHBondContact O-OG 3.37Å
274	D	88.6	Confident	80.6	Confident	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-64.2	-34.2	177.2	-72.4	-20.6	0	0	0	111.8	M198 H202 H210 L211 T271 Y276 S277 F278 F345	M198-D274 HydrophobicContact CE-CB 3.75Å; M198-D274 WeakPolarHBondContact CE-OD2 3.48Å; H202-D274 IonicContact CD2-OD2 3.05Å; H202-D274 IonicContact CE1-OD2 3.82Å; H202-D274 IonicContact NE2-OD2 2.75Å; H202-D274 PolarHBondContact NE2-OD2 2.66Å; H210-D274 PolarHBondContact N-OD1 3.49Å; H210-D274 PolarHBondContact N-OD2 2.98Å; L211-D274 PolarHBondContact N-OD1 3.09Å; T271-D274 PolarHBondContact O-N 2.69Å; D274-Y276 VanDerWaalsContact C-N 3.32Å; D274-Y276 PolarHBondContact O-N 3.24Å; D274-S277 PolarHBondContact O-N 3.12Å; D274-F278 VanDerWaalsContact O-CB 3.29Å; D274-F278 WeakPolarHBondContact O-CB 3.24Å; D274-F278 PolarHBondContact O-N 3.32Å; D274-F345 HydrophobicContact CB-CE2 3.89Å; D274-F345 HydrophobicContact CB-CZ 4.41Å
275	V	91.4	Very high	81.9	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-61.4	-40.5	174.4	174.8	0	0	0	0	111.4	T271 H273 F278 S279 C334 R342 F345 I348	T271-V275 PolarHBondContact O-N 3.43Å; H273-V275 VanDerWaalsContact C-N 3.27Å; H273-V275 PolarHBondContact O-N 3.03Å; V275-F278 PolarHBondContact O-N 3.35Å; V275-S279 PolarHBondContact O-N 3.01Å; V275-S279 VanDerWaalsContact O-N 3.13Å; V275-C334 HydrophobicContact CG1-CB 3.81Å; V275-R342 HydrophobicContact CG1-CB 4Å; V275-F345 HydrophobicContact CB-CE2 4.36Å; V275-F345 HydrophobicContact CG2-CD2 3.67Å; V275-F345 HydrophobicContact CG2-CE2 3.54Å; V275-F345 HydrophobicContact CG2-CZ 4.31Å; V275-I348 HydrophobicContact CG1-CD1 3.82Å; V275-I348 HydrophobicContact CG2-CD1 4.16Å
276	Y	91.4	Very high	83.5	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-65.4	-49.2	174.8	-176.3	-82	0	0	0	111	Y256 L257 P258 K272 H273 D274 F278 S279 I280 R310 W335	Y256-Y276 WeakPolarHBondContact O-CD1 3.38Å; L257-Y276 VanDerWaalsContact O-CE1 3.3Å; L257-Y276 WeakPolarHBondContact O-CE1 3.41Å; P258-Y276 HydrophobicContact CB-CD1 3.84Å; P258-Y276 HydrophobicContact CB-CD2 4.19Å; P258-Y276 HydrophobicContact CB-CE1 4.37Å; P258-Y276 HydrophobicContact CB-CG 3.75Å; K272-Y276 PolarHBondContact O-N 3.19Å; H273-Y276 WeakPolarHBondContact O-CB 3.47Å; H273-Y276 PolarHBondContact O-N 2.95Å; H273-Y276 VanDerWaalsContact O-N 3.15Å; D274-Y276 VanDerWaalsContact C-N 3.32Å; D274-Y276 PolarHBondContact O-N 3.24Å; Y276-F278 PolarHBondContact O-N 2.88Å; Y276-S279 WeakPolarHBondContact O-CB 3.46Å; Y276-S279 PolarHBondContact O-N 3.37Å; Y276-S279 PolarHBondContact O-OG 3.29Å; Y276-I280 HydrophobicContact CD1-CG1 4.49Å; Y276-I280 HydrophobicContact CE1-CD1 4.41Å; Y276-I280 HydrophobicContact CE1-CG1 4.07Å; Y276-I280 PolarHBondContact O-N 3.13Å; Y276-R310 PolarHBondContact OH-NE 2.99Å; Y276-R310 PolarHBondContact OH-NH1 3.28Å; Y276-W335 HydrophobicContact CD2-CB 4.05Å; Y276-W335 HydrophobicContact CE2-CB 3.88Å
277	S	90.3	Very high	85.2	Confident	5 Å²	5	18 Å²	18	4%	0.035	10%	0.095	C	C	.	.	H	α-helix	trans	-56.5	-42.7	177.6	-54.8	0	0	0	0	111.5	Y256 H273 D274 S279 I280 V281	Y256-S277 PolarHBondContact O-OG 3.18Å; H273-S277 PolarHBondContact O-N 3.27Å; H273-S277 VanDerWaalsContact O-N 3.09Å; H273-S277 PolarHBondContact O-OG 3.37Å; D274-S277 PolarHBondContact O-N 3.12Å; S277-S279 VanDerWaalsContact C-N 3.3Å; S277-S279 PolarHBondContact O-N 3.21Å; S277-I280 PolarHBondContact O-N 3.04Å; S277-I280 VanDerWaalsContact O-N 3.16Å; S277-V281 WeakPolarHBondContact O-CG2 3.41Å; S277-V281 PolarHBondContact O-N 3.42Å; S277-V281 VanDerWaalsContact O-N 3.13Å
278	F	94.6	Very high	86.6	Confident	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-61.2	-35.2	177.5	-174.1	-124	0	0	0	113	I191 T194 A195 L213 D274 V275 Y276 I280 V281 I282 F345 I348	I191-F278 HydrophobicContact CG2-CZ 4.01Å; I191-F278 WeakPolarHBondContact O-CZ 3.42Å; T194-F278 HydrophobicContact CG2-CD2 3.94Å; T194-F278 HydrophobicContact CG2-CE2 3.5Å; T194-F278 HydrophobicContact CG2-CZ 4.49Å; A195-F278 HydrophobicContact CB-CE1 4Å; A195-F278 HydrophobicContact CB-CZ 3.89Å; L213-F278 HydrophobicContact CD2-CB 3.81Å; L213-F278 HydrophobicContact CD2-CD2 3.97Å; L213-F278 HydrophobicContact CD2-CG 4.32Å; D274-F278 VanDerWaalsContact O-CB 3.29Å; D274-F278 WeakPolarHBondContact O-CB 3.24Å; D274-F278 PolarHBondContact O-N 3.32Å; V275-F278 PolarHBondContact O-N 3.35Å; Y276-F278 PolarHBondContact O-N 2.88Å; F278-I280 VanDerWaalsContact C-N 3.33Å; F278-I280 PolarHBondContact O-N 3.3Å; F278-V281 HydrophobicContact CD2-CB 4.46Å; F278-V281 CarbonylContact O-C 3.28Å; F278-V281 WeakPolarHBondContact O-CB 3.46Å; F278-V281 PolarHBondContact O-N 2.91Å; F278-I282 HydrophobicContact CD1-CD1 3.82Å; F278-I282 HydrophobicContact CD1-CG1 4.32Å; F278-I282 HydrophobicContact CE1-CD1 3.57Å; F278-I282 HydrophobicContact CE1-CG1 4.02Å; F278-I282 HydrophobicContact CE2-CG1 4.27Å; F278-I282 HydrophobicContact CZ-CD1 4.05Å; F278-I282 HydrophobicContact CZ-CG1 3.98Å; F278-I282 WeakPolarHBondContact O-CG1 3.44Å; F278-I282 PolarHBondContact O-N 3.33Å; F278-F345 HydrophobicContact CB-CE1 4.14Å; F278-F345 HydrophobicContact CB-CZ 3.82Å; F278-F345 AromaticContact CD1-CE1 3.64Å; F278-F345 HydrophobicContact CD1-CE1 3.64Å; F278-F345 HydrophobicContact CD1-CZ 4.17Å; F278-F345 HydrophobicContact CD2-CE1 4.48Å; F278-F345 HydrophobicContact CE1-CE1 4.14Å; F278-F345 AromaticContact CG-CE1 3.83Å; F278-F345 HydrophobicContact CG-CE1 3.83Å; F278-F345 HydrophobicContact CG-CZ 4.05Å; F278-I348 HydrophobicContact CD1-CG2 4.27Å; F278-I348 HydrophobicContact CE1-CG2 3.71Å
279	S	93.3	Very high	87.7	Confident	0 Å²	0	13.5 Å²	13.5	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-61.8	-38.9	175.4	77.2	0	0	0	0	113.2	V275 Y276 S277 V281 I282 W283 M331 W335	V275-S279 PolarHBondContact O-N 3.01Å; V275-S279 VanDerWaalsContact O-N 3.13Å; Y276-S279 WeakPolarHBondContact O-CB 3.46Å; Y276-S279 PolarHBondContact O-N 3.37Å; Y276-S279 PolarHBondContact O-OG 3.29Å; S277-S279 VanDerWaalsContact C-N 3.3Å; S277-S279 PolarHBondContact O-N 3.21Å; S279-V281 VanDerWaalsContact C-N 3.32Å; S279-I282 PolarHBondContact O-N 3.14Å; S279-W283 PolarHBondContact O-N 3.45Å; S279-M331 WeakPolarHBondContact O-CG 3.5Å; S279-W335 VanDerWaalsContact OG-CB 3.3Å; S279-W335 WeakPolarHBondContact OG-CB 3.46Å
280	I	91.3	Very high	88.4	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-72.2	-33.8	178.2	-54	-63.6	0	0	0	109.6	Y256 Y276 S277 F278 W283 G284 P291 P311 W335	Y256-I280 HydrophobicContact CD1-CB 3.71Å; Y256-I280 HydrophobicContact CD1-CG2 3.54Å; Y256-I280 HydrophobicContact CE1-CB 4.09Å; Y256-I280 HydrophobicContact CE1-CG2 3.56Å; Y256-I280 HydrophobicContact CG-CG2 4.28Å; Y276-I280 HydrophobicContact CD1-CG1 4.49Å; Y276-I280 HydrophobicContact CE1-CD1 4.41Å; Y276-I280 HydrophobicContact CE1-CG1 4.07Å; Y276-I280 PolarHBondContact O-N 3.13Å; S277-I280 PolarHBondContact O-N 3.04Å; S277-I280 VanDerWaalsContact O-N 3.16Å; F278-I280 VanDerWaalsContact C-N 3.33Å; F278-I280 PolarHBondContact O-N 3.3Å; I280-W283 PolarHBondContact O-N 2.92Å; I280-G284 PolarHBondContact O-N 3.39Å; I280-P291 HydrophobicContact CG2-CB 3.98Å; I280-P291 HydrophobicContact CG2-CG 4.14Å; I280-P311 HydrophobicContact CD1-CG 4.36Å; I280-W335 HydrophobicContact CD1-CE3 3.77Å; I280-W335 HydrophobicContact CD1-CZ3 4.2Å
281	V	92.6	Very high	88.6	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.3	-47.6	169.8	174.3	0	0	0	0	111.2	L213 I218 Y256 S277 F278 S279 W283 G284 I285	L213-V281 HydrophobicContact CG-CG2 4.46Å; I218-V281 HydrophobicContact CD1-CG1 3.63Å; I218-V281 HydrophobicContact CD1-CG2 4.46Å; Y256-V281 HydrophobicContact CD1-CG2 4.19Å; Y256-V281 HydrophobicContact CE1-CG2 4.1Å; S277-V281 WeakPolarHBondContact O-CG2 3.41Å; S277-V281 PolarHBondContact O-N 3.42Å; S277-V281 VanDerWaalsContact O-N 3.13Å; F278-V281 HydrophobicContact CD2-CB 4.46Å; F278-V281 CarbonylContact O-C 3.28Å; F278-V281 WeakPolarHBondContact O-CB 3.46Å; F278-V281 PolarHBondContact O-N 2.91Å; S279-V281 VanDerWaalsContact C-N 3.32Å; V281-W283 VanDerWaalsContact C-N 3.3Å; V281-W283 PolarHBondContact O-N 3.47Å; V281-G284 PolarHBondContact O-N 2.97Å; V281-G284 VanDerWaalsContact O-N 3.12Å; V281-I285 HydrophobicContact CG1-CD1 3.74Å; V281-I285 HydrophobicContact CG1-CG1 4.35Å; V281-I285 WeakPolarHBondContact O-CG1 3.31Å; V281-I285 PolarHBondContact O-N 3.23Å
282	I	92.6	Very high	88.5	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-56.9	-46.7	175.1	-65.9	167.4	0	0	0	110.1	I191 F278 S279 G284 I285 L286 M331	I191-I282 HydrophobicContact CD1-CG2 4.02Å; I191-I282 HydrophobicContact CG1-CG1 4.33Å; I191-I282 HydrophobicContact CG2-CD1 4.27Å; I191-I282 HydrophobicContact CG2-CG1 3.94Å; F278-I282 HydrophobicContact CD1-CD1 3.82Å; F278-I282 HydrophobicContact CD1-CG1 4.32Å; F278-I282 HydrophobicContact CE1-CD1 3.57Å; F278-I282 HydrophobicContact CE1-CG1 4.02Å; F278-I282 HydrophobicContact CE2-CG1 4.27Å; F278-I282 HydrophobicContact CZ-CD1 4.05Å; F278-I282 HydrophobicContact CZ-CG1 3.98Å; F278-I282 WeakPolarHBondContact O-CG1 3.44Å; F278-I282 PolarHBondContact O-N 3.33Å; S279-I282 PolarHBondContact O-N 3.14Å; I282-G284 VanDerWaalsContact C-N 3.31Å; I282-G284 PolarHBondContact O-N 3.43Å; I282-I285 PolarHBondContact O-N 3.04Å; I282-L286 HydrophobicContact CG2-CD1 3.65Å; I282-L286 HydrophobicContact CG2-CG 4.05Å; I282-L286 WeakPolarHBondContact O-CB 3.46Å; I282-L286 VanDerWaalsContact O-CG 3.28Å; I282-L286 WeakPolarHBondContact O-CG 3.31Å; I282-L286 PolarHBondContact O-N 3.47Å; I282-M331 HydrophobicContact CB-CB 4.29Å; I282-M331 HydrophobicContact CB-CG 4.13Å; I282-M331 HydrophobicContact CD1-CB 4.48Å; I282-M331 HydrophobicContact CG2-CB 3.83Å; I282-M331 HydrophobicContact CG2-CG 4.04Å; I282-M331 HydrophobicContact CG2-SD 4.27Å
283	W	91.6	Very high	87.7	Confident	5 Å²	5	21.1 Å²	21.1	2%	0.019	10%	0.097	C	C	.	.	H	α-helix	trans	-56.8	-46.3	176.5	-177.7	88.8	0	0	0	111.6	S279 I280 V281 I285 L286 T287 K289 P291 P311 D312 L315 M331	S279-W283 PolarHBondContact O-N 3.45Å; I280-W283 PolarHBondContact O-N 2.92Å; V281-W283 VanDerWaalsContact C-N 3.3Å; V281-W283 PolarHBondContact O-N 3.47Å; W283-I285 PolarHBondContact O-N 3.31Å; W283-L286 PolarHBondContact O-N 3.12Å; W283-T287 HydrophobicContact CD2-CG2 4.18Å; W283-T287 HydrophobicContact CG-CG2 4.44Å; W283-T287 HydrophobicContact CZ2-CG2 4.08Å; W283-T287 WeakPolarHBondContact O-CB 3.4Å; W283-T287 WeakPolarHBondContact O-CG2 3.29Å; W283-T287 PolarHBondContact O-N 3.04Å; W283-T287 PolarHBondContact O-OG1 2.8Å; W283-K289 HydrophobicContact CH2-CB 4.01Å; W283-K289 HydrophobicContact CZ3-CB 4.31Å; W283-K289 WeakPolarHBondContact CZ3-O 3.4Å; W283-P291 HydrophobicContact CE3-CB 4.41Å; W283-P291 HydrophobicContact CZ3-CB 4.12Å; W283-P311 HydrophobicContact CD2-CB 3.66Å; W283-P311 HydrophobicContact CD2-CG 4.29Å; W283-P311 HydrophobicContact CE3-CB 4.06Å; W283-P311 HydrophobicContact CE3-CG 4.43Å; W283-P311 HydrophobicContact CG-CB 4.24Å; W283-P311 HydrophobicContact CH2-CB 3.93Å; W283-P311 HydrophobicContact CZ2-CB 3.48Å; W283-P311 VanDerWaalsContact CZ2-CB 3.48Å; W283-P311 HydrophobicContact CZ3-CB 4.2Å; W283-D312 PolarHBondContact NE1-O 3.46Å; W283-L315 HydrophobicContact CZ2-CD1 4.36Å; W283-M331 VanDerWaalsContact CA-SD 3.58Å; W283-M331 HydrophobicContact CB-SD 3.52Å; W283-M331 VanDerWaalsContact CB-SD 3.52Å; W283-M331 HydrophobicContact CG-SD 4.19Å
284	G	88.8	Confident	86.7	Confident	2 Å²	2	24 Å²	24	2%	0.021	13%	0.129	C	C	.	.	H	α-helix	trans	-62.1	-41.2	177.8	0	0	0	0	0	112.9	I280 V281 I282 Q288	I280-G284 PolarHBondContact O-N 3.39Å; V281-G284 PolarHBondContact O-N 2.97Å; V281-G284 VanDerWaalsContact O-N 3.12Å; I282-G284 VanDerWaalsContact C-N 3.31Å; I282-G284 PolarHBondContact O-N 3.43Å; G284-Q288 WeakPolarHBondContact O-CA 3.17Å; G284-Q288 PolarHBondContact O-N 3.46Å
285	I	90.6	Very high	86	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.1	-45.8	176.7	-67	165.1	0	0	0	111.1	L173 L177 R187 I190 I191 V281 I282 W283	L173-I285 HydrophobicContact CD2-CD1 3.95Å; L173-I285 HydrophobicContact CD2-CG1 3.93Å; L177-I285 HydrophobicContact CD1-CG1 4.5Å; R187-I285 HydrophobicContact CB-CG2 3.62Å; R187-I285 WeakPolarHBondContact CD-O 3.21Å; R187-I285 HydrophobicContact CG-CG2 3.89Å; I190-I285 HydrophobicContact CG2-CD1 3.81Å; I191-I285 HydrophobicContact CD1-CB 4.44Å; I191-I285 HydrophobicContact CD1-CG2 4.02Å; I191-I285 HydrophobicContact CG1-CB 4.34Å; I191-I285 HydrophobicContact CG1-CD1 3.79Å; I191-I285 HydrophobicContact CG1-CG2 4.02Å; V281-I285 HydrophobicContact CG1-CD1 3.74Å; V281-I285 HydrophobicContact CG1-CG1 4.35Å; V281-I285 WeakPolarHBondContact O-CG1 3.31Å; V281-I285 PolarHBondContact O-N 3.23Å; I282-I285 PolarHBondContact O-N 3.04Å; W283-I285 PolarHBondContact O-N 3.31Å
286	L	88.8	Confident	84.5	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-69.6	-36.5	-177.1	-65.9	177.1	0	0	0	112.4	W184 R187 F188 I191 I282 W283 F327 L328	W184-L286 HydrophobicContact CZ3-CD2 3.85Å; R187-L286 PolarHBondContact NH1-O 2.93Å; F188-L286 HydrophobicContact CD1-CD2 4.37Å; F188-L286 HydrophobicContact CE1-CD2 3.95Å; I191-L286 HydrophobicContact CD1-CD2 3.9Å; I191-L286 HydrophobicContact CD1-CG 4.21Å; I282-L286 HydrophobicContact CG2-CD1 3.65Å; I282-L286 HydrophobicContact CG2-CG 4.05Å; I282-L286 WeakPolarHBondContact O-CB 3.46Å; I282-L286 VanDerWaalsContact O-CG 3.28Å; I282-L286 WeakPolarHBondContact O-CG 3.31Å; I282-L286 PolarHBondContact O-N 3.47Å; W283-L286 PolarHBondContact O-N 3.12Å; L286-F327 HydrophobicContact CD1-CB 4.17Å; L286-F327 HydrophobicContact CD2-CB 4.4Å; L286-L328 HydrophobicContact CD1-CD2 3.78Å; L286-L328 HydrophobicContact CD1-CG 4Å
287	T	86	Confident	83.7	Confident	8 Å²	8	38.1 Å²	38.1	5%	0.049	20%	0.202	C	C	.	.	H	α-helix	trans	-92.2	-23.4	-178.1	61.4	0	0	0	0	113.8	W283 K289 V316	W283-T287 HydrophobicContact CD2-CG2 4.18Å; W283-T287 HydrophobicContact CG-CG2 4.44Å; W283-T287 HydrophobicContact CZ2-CG2 4.08Å; W283-T287 WeakPolarHBondContact O-CB 3.4Å; W283-T287 WeakPolarHBondContact O-CG2 3.29Å; W283-T287 PolarHBondContact O-N 3.04Å; W283-T287 PolarHBondContact O-OG1 2.8Å; T287-K289 PolarHBondContact O-N 3.37Å; T287-K289 PolarHBondContact OG1-N 3.5Å; T287-V316 HydrophobicContact CG2-CG2 3.89Å
288	Q	85.8	Confident	82.8	Confident	39 Å²	39	42.1 Å²	42.1	18%	0.182	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	41.4	-167.8	-56.6	-171.6	107	0	0	112.6	L177 E180 G284	L177-Q288 HydrophobicContact CD2-CB 4.47Å; L177-Q288 HydrophobicContact CD2-CG 3.95Å; E180-Q288 PolarHBondContact O-OE1 3.2Å; G284-Q288 WeakPolarHBondContact O-CA 3.17Å; G284-Q288 PolarHBondContact O-N 3.46Å
289	K	82.6	Confident	81.7	Confident	83 Å²	83	47 Å²	47	36%	0.361	25%	0.248	S	C	.	.	S	Bend	trans	-128	153.5	177.4	-68	-170.1	178.6	-173.1	0	110.8	W283 T287 L315	W283-K289 HydrophobicContact CH2-CB 4.01Å; W283-K289 HydrophobicContact CZ3-CB 4.31Å; W283-K289 WeakPolarHBondContact CZ3-O 3.4Å; T287-K289 PolarHBondContact O-N 3.37Å; T287-K289 PolarHBondContact OG1-N 3.5Å; K289-L315 HydrophobicContact CD-CB 4.32Å; K289-L315 HydrophobicContact CD-CD1 4.33Å
290	K	82.2	Confident	80.8	Confident	114 Å²	114	51.3 Å²	51.3	50%	0.496	27%	0.268	S	S	.	.			trans	-73.5	136.9	170.7	-67.4	-160.6	-178	-151.9	0	109.8	E174 Y292 Q293	E174-K290 IonicContact OE1-NZ 3.42Å; E174-K290 PolarHBondContact OE1-NZ 3.03Å; K290-Y292 PolarHBondContact O-N 2.95Å; K290-Q293 WeakPolarHBondContact O-CB 3.19Å; K290-Q293 PolarHBondContact O-N 3.21Å
291	P	81.6	Confident	80.1	Confident	15 Å²	15	52.3 Å²	52.3	10%	0.097	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	138.8	176.6	27.1	-34.2	0	0	0	109.6	A255 Y256 I280 W283 Q293 P311	A255-P291 HydrophobicContact CB-CG 4.04Å; Y256-P291 HydrophobicContact CE1-CG 4.44Å; Y256-P291 HydrophobicContact CE2-CG 4.09Å; I280-P291 HydrophobicContact CG2-CB 3.98Å; I280-P291 HydrophobicContact CG2-CG 4.14Å; W283-P291 HydrophobicContact CE3-CB 4.41Å; W283-P291 HydrophobicContact CZ3-CB 4.12Å; P291-Q293 PolarHBondContact O-N 3.41Å; P291-P311 HydrophobicContact CB-CG 4.24Å
292	Y	80.9	Confident	79.2	Confident	24 Å²	24	54.7 Å²	54.7	9%	0.094	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	29.9	-179.9	-49.7	-79.3	0	0	0	114.9	A255 K290 G294 E295 I301 K304 V305 I309 P311	A255-Y292 HydrophobicContact CB-CD2 4.29Å; K290-Y292 PolarHBondContact O-N 2.95Å; Y292-G294 PolarHBondContact O-N 3.02Å; Y292-E295 PolarHBondContact O-N 2.89Å; Y292-I301 HydrophobicContact CD2-CG2 3.76Å; Y292-I301 HydrophobicContact CE2-CG2 4.19Å; Y292-I301 HydrophobicContact CG-CG2 4.11Å; Y292-K304 HydrophobicContact CD1-CD 4.37Å; Y292-K304 HydrophobicContact CE1-CB 4.4Å; Y292-V305 HydrophobicContact CE2-CG2 4.11Å; Y292-I309 PolarHBondContact OH-O 2.91Å; Y292-P311 HydrophobicContact CE2-CG 4.18Å
293	Q	69.2	Low	78.5	Confident	143 Å²	143	57.9 Å²	57.9	67%	0.668	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	122.8	176.2	-172.9	174.4	13.1	0	0	111.8	K290 P291	K290-Q293 WeakPolarHBondContact O-CB 3.19Å; K290-Q293 PolarHBondContact O-N 3.21Å; P291-Q293 PolarHBondContact O-N 3.41Å
294	G	66.5	Low	77.9	Confident	66 Å²	66	60.6 Å²	60.6	68%	0.68	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	110.4	-12.7	-177.5	0	0	0	0	0	114.7	Y292	Y292-G294 PolarHBondContact O-N 3.02Å
295	E	74.4	Confident	77.5	Confident	61 Å²	61	60.5 Å²	60.5	29%	0.285	32%	0.315	S	S	.	.			trans	-90.2	115.5	171.7	-57.5	-66.2	149.1	0	0	109.9	Y292 Q300 I301 K304	Y292-E295 PolarHBondContact O-N 2.89Å; E295-Q300 PolarHBondContact OE2-OE1 3.03Å; E295-I301 HydrophobicContact CB-CD1 4.32Å; E295-I301 HydrophobicContact CB-CG1 3.86Å; E295-K304 IonicContact OE1-NZ 3.64Å; E295-K304 PolarHBondContact OE1-NZ 3.02Å; E295-K304 IonicContact OE2-NZ 3.65Å
296	N	60.4	Low	77	Confident	165 Å²	165	63.1 Å²	63.1	88%	0.882	33%	0.331	S	S	*	.			trans	-88.9	-10.8	-176.6	-67	-16.2	0	0	0	113.3
297	N	73.3	Confident	76.5	Confident	70 Å²	70	69.8 Å²	69.8	37%	0.374	36%	0.36	S	S	.	.			trans	-113.9	122.6	-176.7	-168.4	-21	0	0	0	111.4	L299 Q300 I301	N297-L299 PolarHBondContact O-N 3.31Å; N297-L299 WeakPolarHBondContact OD1-CB 3.17Å; N297-L299 PolarHBondContact OD1-N 3.39Å; N297-Q300 HydrophobicContact CB-CB 4.43Å; N297-Q300 HydrophobicContact CB-CG 3.99Å; N297-Q300 WeakPolarHBondContact O-CB 3.36Å; N297-Q300 PolarHBondContact O-N 3.25Å; N297-I301 PolarHBondContact O-N 3.48Å
298	I	71.3	Confident	75.9	Confident	90 Å²	90	70.7 Å²	70.7	46%	0.462	37%	0.371	S	S	.	.	H	α-helix	trans	-55.9	-32.7	177.9	-165.4	63.3	0	0	0	112.9	I254 I301 M302	I254-I298 HydrophobicContact CB-CD1 3.78Å; I254-I298 HydrophobicContact CB-CG1 4.34Å; I254-I298 HydrophobicContact CD1-CD1 3.76Å; I254-I298 HydrophobicContact CD1-CG1 3.35Å; I254-I298 HydrophobicContact CG1-CD1 4.28Å; I254-I298 HydrophobicContact CG1-CG1 4.38Å; I254-I298 HydrophobicContact CG2-CD1 4.1Å; I298-I301 PolarHBondContact O-N 3.17Å; I298-M302 WeakPolarHBondContact O-CB 3.39Å; I298-M302 PolarHBondContact O-N 3.01Å
299	L	71.6	Confident	75.6	Confident	101 Å²	101	72.7 Å²	72.7	53%	0.529	38%	0.382	S	S	.	.	H	α-helix	trans	-66.5	-34.9	175.7	-73.7	149	0	0	0	112	N297 M302 V303	N297-L299 PolarHBondContact O-N 3.31Å; N297-L299 WeakPolarHBondContact OD1-CB 3.17Å; N297-L299 PolarHBondContact OD1-N 3.39Å; L299-M302 HydrophobicContact CD2-CE 3.92Å; L299-M302 PolarHBondContact O-N 2.89Å; L299-V303 WeakPolarHBondContact O-CB 3.31Å; L299-V303 VanDerWaalsContact O-CG2 3.26Å; L299-V303 WeakPolarHBondContact O-CG2 3.44Å; L299-V303 PolarHBondContact O-N 3.03Å
300	Q	75.1	Confident	75.7	Confident	92 Å²	92	70.7 Å²	70.7	43%	0.43	37%	0.372	S	S	.	.	H	α-helix	trans	-67.7	-42.4	176.7	-69.7	170.3	-29.6	0	0	110.9	E295 N297 V303 K304	E295-Q300 PolarHBondContact OE2-OE1 3.03Å; N297-Q300 HydrophobicContact CB-CB 4.43Å; N297-Q300 HydrophobicContact CB-CG 3.99Å; N297-Q300 WeakPolarHBondContact O-CB 3.36Å; N297-Q300 PolarHBondContact O-N 3.25Å; Q300-V303 PolarHBondContact O-N 2.95Å; Q300-K304 WeakPolarHBondContact O-CG 3.42Å; Q300-K304 PolarHBondContact O-N 3.42Å
301	I	76.4	Confident	75.8	Confident	20 Å²	20	65.6 Å²	65.6	10%	0.103	35%	0.351	C	S	.	.	H	α-helix	trans	-61.5	-47.3	174.6	-59.8	175.6	0	0	0	109.5	I254 A255 Y292 E295 N297 I298 V303 K304 V305	I254-I301 HydrophobicContact CG2-CG2 4.24Å; A255-I301 HydrophobicContact CB-CG2 4.36Å; Y292-I301 HydrophobicContact CD2-CG2 3.76Å; Y292-I301 HydrophobicContact CE2-CG2 4.19Å; Y292-I301 HydrophobicContact CG-CG2 4.11Å; E295-I301 HydrophobicContact CB-CD1 4.32Å; E295-I301 HydrophobicContact CB-CG1 3.86Å; N297-I301 PolarHBondContact O-N 3.48Å; I298-I301 PolarHBondContact O-N 3.17Å; I301-V303 PolarHBondContact O-N 3.43Å; I301-K304 PolarHBondContact O-N 3.49Å; I301-K304 VanDerWaalsContact O-N 3.16Å; I301-V305 HydrophobicContact CG2-CG2 4.29Å; I301-V305 VanDerWaalsContact O-CG2 3.3Å; I301-V305 WeakPolarHBondContact O-CG2 3.49Å; I301-V305 PolarHBondContact O-N 3.38Å
302	M	74.6	Confident	75.5	Confident	50 Å²	50	69.8 Å²	69.8	25%	0.246	37%	0.372	C	S	.	.	H	α-helix	trans	-57.4	-47.5	177.7	-167.2	178.2	75.3	0	0	112.1	I254 I262 I298 L299 K304 V305 V306	I254-M302 HydrophobicContact CG2-CB 4.01Å; I254-M302 HydrophobicContact CG2-CG 4.42Å; I262-M302 HydrophobicContact CD1-CG 4.12Å; I262-M302 HydrophobicContact CG2-CG 3.94Å; I262-M302 HydrophobicContact CG2-SD 4.22Å; I298-M302 WeakPolarHBondContact O-CB 3.39Å; I298-M302 PolarHBondContact O-N 3.01Å; L299-M302 HydrophobicContact CD2-CE 3.92Å; L299-M302 PolarHBondContact O-N 2.89Å; M302-K304 VanDerWaalsContact C-N 3.33Å; M302-K304 PolarHBondContact O-N 3.4Å; M302-V305 PolarHBondContact O-N 2.97Å; M302-V306 WeakPolarHBondContact O-CB 3.42Å; M302-V306 VanDerWaalsContact O-CG2 3.28Å; M302-V306 WeakPolarHBondContact O-CG2 3.5Å; M302-V306 PolarHBondContact O-N 3.42Å
303	V	77.2	Confident	75	Confident	68 Å²	68	71.7 Å²	71.7	41%	0.412	38%	0.384	S	S	.	.	H	α-helix	trans	-61.2	-40.8	177	169.7	0	0	0	0	111.5	L299 Q300 I301 K307	L299-V303 WeakPolarHBondContact O-CB 3.31Å; L299-V303 VanDerWaalsContact O-CG2 3.26Å; L299-V303 WeakPolarHBondContact O-CG2 3.44Å; L299-V303 PolarHBondContact O-N 3.03Å; Q300-V303 PolarHBondContact O-N 2.95Å; I301-V303 PolarHBondContact O-N 3.43Å; V303-K307 HydrophobicContact CG1-CD 3.98Å; V303-K307 HydrophobicContact CG1-CG 4.48Å; V303-K307 WeakPolarHBondContact O-CB 3.39Å; V303-K307 VanDerWaalsContact O-CG 3.27Å; V303-K307 WeakPolarHBondContact O-CG 3.47Å; V303-K307 PolarHBondContact O-N 3.18Å
304	K	79.8	Confident	74.7	Confident	61 Å²	61	67.9 Å²	67.9	27%	0.265	38%	0.383	S	S	.	.	H	α-helix	trans	-64.4	-45.7	176	-74.8	-175.2	-175.2	-169.8	0	111.8	Y292 E295 Q300 I301 M302 K307 G308 I309	Y292-K304 HydrophobicContact CD1-CD 4.37Å; Y292-K304 HydrophobicContact CE1-CB 4.4Å; E295-K304 IonicContact OE1-NZ 3.64Å; E295-K304 PolarHBondContact OE1-NZ 3.02Å; E295-K304 IonicContact OE2-NZ 3.65Å; Q300-K304 WeakPolarHBondContact O-CG 3.42Å; Q300-K304 PolarHBondContact O-N 3.42Å; I301-K304 PolarHBondContact O-N 3.49Å; I301-K304 VanDerWaalsContact O-N 3.16Å; M302-K304 VanDerWaalsContact C-N 3.33Å; M302-K304 PolarHBondContact O-N 3.4Å; K304-K307 PolarHBondContact O-N 3.08Å; K304-G308 PolarHBondContact O-N 3.41Å; K304-I309 HydrophobicContact CB-CB 4.1Å; K304-I309 HydrophobicContact CB-CG2 4.48Å; K304-I309 HydrophobicContact CG-CD1 4.26Å; K304-I309 WeakPolarHBondContact O-CB 3.38Å; K304-I309 PolarHBondContact O-N 3.44Å
305	V	80.3	Confident	74.6	Confident	0 Å²	0	68 Å²	68	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-59.2	-50.2	177.8	173	0	0	0	0	110.2	L257 P259 I262 Y292 I301 M302 K307 G308	L257-V305 WeakPolarHBondContact O-CG1 3.45Å; P259-V305 HydrophobicContact CB-CG1 4.21Å; P259-V305 WeakPolarHBondContact CB-O 3.39Å; I262-V305 HydrophobicContact CD1-CB 4.24Å; I262-V305 HydrophobicContact CD1-CG1 3.74Å; Y292-V305 HydrophobicContact CE2-CG2 4.11Å; I301-V305 HydrophobicContact CG2-CG2 4.29Å; I301-V305 VanDerWaalsContact O-CG2 3.3Å; I301-V305 WeakPolarHBondContact O-CG2 3.49Å; I301-V305 PolarHBondContact O-N 3.38Å; M302-V305 PolarHBondContact O-N 2.97Å; V305-K307 VanDerWaalsContact C-N 3.32Å; V305-K307 PolarHBondContact O-N 3.32Å; V305-G308 PolarHBondContact O-N 2.91Å
306	V	78.6	Confident	74.4	Confident	56 Å²	56	66 Å²	66	34%	0.339	36%	0.36	S	S	.	.	H	α-helix	trans	-59.1	-40.2	177.6	170.4	0	0	0	0	112.1	I262 I263 M302 G308	I262-V306 HydrophobicContact CB-CG2 3.76Å; I262-V306 HydrophobicContact CD1-CG2 4.07Å; I262-V306 HydrophobicContact CG2-CG2 3.37Å; I263-V306 HydrophobicContact CD1-CG1 4.12Å; I263-V306 HydrophobicContact CG1-CG1 3.97Å; I263-V306 HydrophobicContact CG1-CG2 4.45Å; M302-V306 WeakPolarHBondContact O-CB 3.42Å; M302-V306 VanDerWaalsContact O-CG2 3.28Å; M302-V306 WeakPolarHBondContact O-CG2 3.5Å; M302-V306 PolarHBondContact O-N 3.42Å; V306-G308 PolarHBondContact O-N 3.36Å; V306-G308 VanDerWaalsContact O-N 3.15Å
307	K	78.1	Confident	74.7	Confident	139 Å²	139	60.4 Å²	60.4	60%	0.604	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	0.6	175.2	-74.4	-179.5	176.9	-177.3	0	114	V303 K304 V305 I309	V303-K307 HydrophobicContact CG1-CD 3.98Å; V303-K307 HydrophobicContact CG1-CG 4.48Å; V303-K307 WeakPolarHBondContact O-CB 3.39Å; V303-K307 VanDerWaalsContact O-CG 3.27Å; V303-K307 WeakPolarHBondContact O-CG 3.47Å; V303-K307 PolarHBondContact O-N 3.18Å; K304-K307 PolarHBondContact O-N 3.08Å; V305-K307 VanDerWaalsContact C-N 3.32Å; V305-K307 PolarHBondContact O-N 3.32Å; K307-I309 VanDerWaalsContact C-N 3.31Å; K307-I309 HydrophobicContact CB-CD1 4.2Å; K307-I309 HydrophobicContact CB-CG1 4.18Å; K307-I309 PolarHBondContact O-N 3.44Å
308	G	73.8	Confident	74	Confident	27 Å²	27	69.1 Å²	69.1	28%	0.278	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.7	9.3	-178.9	0	0	0	0	0	114.3	K304 V305 V306 R310	K304-G308 PolarHBondContact O-N 3.41Å; V305-G308 PolarHBondContact O-N 2.91Å; V306-G308 PolarHBondContact O-N 3.36Å; V306-G308 VanDerWaalsContact O-N 3.15Å; G308-R310 VanDerWaalsContact C-NH1 3.28Å; G308-R310 VanDerWaalsContact CA-NH1 3.35Å; G308-R310 PolarHBondContact O-N 3.16Å; G308-R310 PolarHBondContact O-NH1 3.3Å
309	I	80.3	Confident	73.5	Confident	81 Å²	81	69.4 Å²	69.4	42%	0.415	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-78.4	121.7	-178.4	-58	173.3	0	0	0	109.2	Y292 K304 K307	Y292-I309 PolarHBondContact OH-O 2.91Å; K304-I309 HydrophobicContact CB-CB 4.1Å; K304-I309 HydrophobicContact CB-CG2 4.48Å; K304-I309 HydrophobicContact CG-CD1 4.26Å; K304-I309 WeakPolarHBondContact O-CB 3.38Å; K304-I309 PolarHBondContact O-N 3.44Å; K307-I309 VanDerWaalsContact C-N 3.31Å; K307-I309 HydrophobicContact CB-CD1 4.2Å; K307-I309 HydrophobicContact CB-CG1 4.18Å; K307-I309 PolarHBondContact O-N 3.44Å
310	R	84.3	Confident	73.7	Confident	41 Å²	41	70.2 Å²	70.2	16%	0.155	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-102.9	162	-178.2	-61.4	-61.7	-179.6	-97	-3.5	112.1	Y276 G308 W335 N337	Y276-R310 PolarHBondContact OH-NE 2.99Å; Y276-R310 PolarHBondContact OH-NH1 3.28Å; G308-R310 VanDerWaalsContact C-NH1 3.28Å; G308-R310 VanDerWaalsContact CA-NH1 3.35Å; G308-R310 PolarHBondContact O-N 3.16Å; G308-R310 PolarHBondContact O-NH1 3.3Å; R310-W335 HydrophobicContact CB-CE3 4.35Å; R310-W335 HydrophobicContact CB-CH2 3.98Å; R310-W335 HydrophobicContact CB-CZ2 4.22Å; R310-W335 HydrophobicContact CB-CZ3 4.07Å; R310-W335 HydrophobicContact CG-CD2 4.22Å; R310-W335 HydrophobicContact CG-CE3 4.35Å; R310-W335 PolarHBondContact NH2-O 3.41Å; R310-N337 PolarHBondContact NH2-OD1 3.28Å
311	P	83.6	Confident	73.9	Confident	7 Å²	7	68.2 Å²	68.2	5%	0.045	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-56.2	142.4	172.3	-25.3	35.4	0	0	0	112.5	I280 W283 P291 Y292 L313 W335	I280-P311 HydrophobicContact CD1-CG 4.36Å; W283-P311 HydrophobicContact CD2-CB 3.66Å; W283-P311 HydrophobicContact CD2-CG 4.29Å; W283-P311 HydrophobicContact CE3-CB 4.06Å; W283-P311 HydrophobicContact CE3-CG 4.43Å; W283-P311 HydrophobicContact CG-CB 4.24Å; W283-P311 HydrophobicContact CH2-CB 3.93Å; W283-P311 HydrophobicContact CZ2-CB 3.48Å; W283-P311 VanDerWaalsContact CZ2-CB 3.48Å; W283-P311 HydrophobicContact CZ3-CB 4.2Å; P291-P311 HydrophobicContact CB-CG 4.24Å; Y292-P311 HydrophobicContact CE2-CG 4.18Å; P311-L313 PolarHBondContact O-N 3.42Å; P311-W335 HydrophobicContact CG-CZ3 4.48Å
312	D	76.3	Confident	74	Confident	103 Å²	103	71 Å²	71	55%	0.551	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-65.1	133.6	-176.7	-177	15.6	0	0	0	111.8	W283 G314 L315	W283-D312 PolarHBondContact NE1-O 3.46Å; D312-G314 PolarHBondContact OD1-N 3.06Å; D312-L315 HydrophobicContact CB-CD1 4.03Å; D312-L315 HydrophobicContact CB-CG 4.47Å
313	L	70.3	Confident	74.3	Confident	65 Å²	65	70.1 Å²	70.1	34%	0.34	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-85.2	-16.3	180	-64.4	173.9	0	0	0	112.6	P311 L315 M331 Q332 W335	P311-L313 PolarHBondContact O-N 3.42Å; L313-L315 PolarHBondContact O-N 3.38Å; L313-M331 HydrophobicContact CD2-CE 3.4Å; L313-M331 VanDerWaalsContact CD2-CE 3.4Å; L313-Q332 VanDerWaalsContact CD1-NE2 3.26Å; L313-W335 HydrophobicContact CD1-CZ2 4.36Å; L313-W335 HydrophobicContact CD2-CH2 3.71Å; L313-W335 HydrophobicContact CD2-CZ2 3.89Å; L313-W335 HydrophobicContact CG-CH2 4.36Å; L313-W335 HydrophobicContact CG-CZ2 4.38Å
314	G	62.1	Low	74.7	Confident	63 Å²	63	66.9 Å²	66.9	65%	0.649	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-69.5	-7.1	179.5	0	0	0	0	0	115.1	D312	D312-G314 PolarHBondContact OD1-N 3.06Å
315	L	65.7	Low	74.9	Confident	69 Å²	69	66.5 Å²	66.5	36%	0.361	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-91.8	0.2	-173.2	-64.6	164.4	0	0	0	114.2	W283 K289 D312 L313	W283-L315 HydrophobicContact CZ2-CD1 4.36Å; K289-L315 HydrophobicContact CD-CB 4.32Å; K289-L315 HydrophobicContact CD-CD1 4.33Å; D312-L315 HydrophobicContact CB-CD1 4.03Å; D312-L315 HydrophobicContact CB-CG 4.47Å; L313-L315 PolarHBondContact O-N 3.38Å
316	V	70.2	Confident	75.2	Confident	18 Å²	18	67.4 Å²	67.4	11%	0.109	38%	0.377	C	S	.	.	S	Bend	trans	-70.2	131.3	174.6	-176.4	0	0	0	0	109.3	W184 T287 R318 L328	W184-V316 HydrophobicContact CH2-CG1 4.01Å; T287-V316 HydrophobicContact CG2-CG2 3.89Å; V316-R318 PolarHBondContact O-N 3.37Å; V316-L328 HydrophobicContact CG2-CD1 4.45Å; V316-L328 HydrophobicContact CG2-CD2 4.23Å
317	P	66.9	Low	75.8	Confident	48 Å²	48	64.7 Å²	64.7	31%	0.312	36%	0.361	S	S	.	.			trans	-52.2	135	178.5	-26.9	34.1	0	0	0	112.3	S319	P317-S319 PolarHBondContact O-N 2.74Å
318	R	59	Low	76.3	Confident	253 Å²	253	59 Å²	59	96%	0.955	34%	0.337	S	S	*	.	S	Bend	trans	-61.6	-26.5	-178.7	-68.5	-174.7	179.7	175.1	0.3	112.8	V316 R320	V316-R318 PolarHBondContact O-N 3.37Å; R318-R320 PolarHBondContact O-N 3.13Å
319	S	59.1	Low	77	Confident	95 Å²	95	60.3 Å²	60.3	66%	0.664	34%	0.342	S	S	*	.	S	Bend	trans	-84.5	80.8	172.8	57.2	0	0	0	0	111	W184 P317	W184-S319 PolarHBondContact NE1-O 2.91Å; P317-S319 PolarHBondContact O-N 2.74Å
320	R	75.4	Confident	77.5	Confident	119 Å²	119	56.5 Å²	56.5	45%	0.449	32%	0.322	S	S	.	.			trans	-126.8	140.1	-178.5	65.4	-175.2	-178.5	149	-0.7	112.6	W184 R318 C324	W184-R320 HydrophobicContact CH2-CB 4.1Å; W184-R320 HydrophobicContact CZ2-CB 3.65Å; R318-R320 PolarHBondContact O-N 3.13Å; R320-C324 HydrophobicContact CB-CB 4.04Å; R320-C324 HydrophobicContact CG-CB 4.37Å
321	P	80.9	Confident	77.9	Confident	49 Å²	49	54.5 Å²	54.5	32%	0.318	32%	0.315	S	S	.	.			trans	-62	155.9	170.6	-22.4	33.3	0	0	0	112.2	W184 F188 T323 C324	W184-P321 HydrophobicContact CB-CG 3.9Å; W184-P321 VanDerWaalsContact CD1-CD 3.49Å; W184-P321 HydrophobicContact CD2-CG 4.31Å; W184-P321 HydrophobicContact CG-CG 3.78Å; F188-P321 HydrophobicContact CE2-CB 4.4Å; F188-P321 HydrophobicContact CE2-CG 4.28Å; F188-P321 HydrophobicContact CZ-CG 4.45Å; P321-T323 PolarHBondContact O-N 2.84Å; P321-C324 WeakPolarHBondContact O-CB 3.43Å; P321-C324 PolarHBondContact O-N 3.25Å
322	S	77.9	Confident	78.2	Confident	80 Å²	80	58.3 Å²	58.3	56%	0.559	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-35.3	176	52.5	0	0	0	0	112.6	C324 A325	S322-C324 PolarHBondContact O-N 3.43Å; S322-C324 VanDerWaalsContact O-N 3.15Å; S322-A325 WeakPolarHBondContact O-CB 3.36Å; S322-A325 PolarHBondContact O-N 3.04Å
323	T	80.7	Confident	78.9	Confident	30 Å²	30	57.4 Å²	57.4	18%	0.184	32%	0.321	C	S	.	.	H	α-helix	trans	-56.3	-29.1	175.3	-42.5	0	0	0	0	113.3	F188 P321 A325 G326 F327 L355	F188-T323 HydrophobicContact CD2-CG2 4.43Å; F188-T323 HydrophobicContact CE2-CG2 4.33Å; P321-T323 PolarHBondContact O-N 2.84Å; T323-A325 PolarHBondContact O-N 3.24Å; T323-G326 PolarHBondContact O-N 2.69Å; T323-G326 VanDerWaalsContact O-N 3.12Å; T323-F327 HydrophobicContact CG2-CD2 4.01Å; T323-F327 HydrophobicContact CG2-CE2 3.81Å; T323-F327 PolarHBondContact O-N 2.83Å; T323-L355 HydrophobicContact CG2-CB 3.98Å; T323-L355 WeakPolarHBondContact CG2-O 3.29Å
324	C	85.8	Confident	79.8	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-61.6	-32.4	176.5	-178	0	0	0	0	112.1	W184 F188 R320 P321 S322 G326 F327 L328	W184-C324 HydrophobicContact CZ3-CB 4.3Å; F188-C324 HydrophobicContact CE1-CB 4.37Å; F188-C324 HydrophobicContact CZ-CB 4.12Å; R320-C324 HydrophobicContact CB-CB 4.04Å; R320-C324 HydrophobicContact CG-CB 4.37Å; P321-C324 WeakPolarHBondContact O-CB 3.43Å; P321-C324 PolarHBondContact O-N 3.25Å; S322-C324 PolarHBondContact O-N 3.43Å; S322-C324 VanDerWaalsContact O-N 3.15Å; C324-G326 VanDerWaalsContact C-N 3.33Å; C324-F327 PolarHBondContact O-N 3.45Å; C324-L328 WeakPolarHBondContact O-CB 3.35Å; C324-L328 VanDerWaalsContact O-CG 3.32Å; C324-L328 WeakPolarHBondContact O-CG 3.34Å; C324-L328 PolarHBondContact O-N 3.01Å
325	A	84.3	Confident	81.2	Confident	54 Å²	54	52.5 Å²	52.5	45%	0.446	28%	0.278	S	S	.	.	H	α-helix	trans	-65.2	-38.4	176.1	0	0	0	0	0	111.8	S322 T323 L328 S329	S322-A325 WeakPolarHBondContact O-CB 3.36Å; S322-A325 PolarHBondContact O-N 3.04Å; T323-A325 PolarHBondContact O-N 3.24Å; A325-L328 PolarHBondContact O-N 2.91Å; A325-S329 PolarHBondContact O-N 3.38Å
326	G	87	Confident	82.2	Confident	18 Å²	18	51.7 Å²	51.7	19%	0.186	28%	0.276	C	S	.	.	H	α-helix	trans	-62.2	-50.1	173.8	0	0	0	0	0	112	T323 C324 L328 S329 L330	T323-G326 PolarHBondContact O-N 2.69Å; T323-G326 VanDerWaalsContact O-N 3.12Å; C324-G326 VanDerWaalsContact C-N 3.33Å; G326-L328 VanDerWaalsContact C-N 3.31Å; G326-L328 PolarHBondContact O-N 3.17Å; G326-S329 WeakPolarHBondContact O-CB 3.46Å; G326-S329 PolarHBondContact O-N 3.39Å; G326-S329 VanDerWaalsContact O-N 3.12Å; G326-L330 PolarHBondContact O-N 3.12Å
327	F	89.5	Confident	82.7	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63.2	-33.2	177.6	-80.5	-70.7	0	0	0	113.6	F188 I191 L286 T323 C324 L330 M331 A352 L355	F188-F327 HydrophobicContact CB-CE2 3.77Å; F188-F327 HydrophobicContact CB-CZ 4.14Å; F188-F327 AromaticContact CD1-CD2 3.35Å; F188-F327 HydrophobicContact CD1-CD2 3.35Å; F188-F327 AromaticContact CD1-CE2 3.44Å; F188-F327 HydrophobicContact CD1-CE2 3.44Å; F188-F327 VanDerWaalsContact CD1-CE2 3.44Å; F188-F327 HydrophobicContact CD1-CG 4.2Å; F188-F327 HydrophobicContact CD1-CZ 4.35Å; F188-F327 AromaticContact CE1-CD2 3.67Å; F188-F327 HydrophobicContact CE1-CD2 3.67Å; F188-F327 HydrophobicContact CE1-CE2 4.17Å; F188-F327 HydrophobicContact CE1-CG 4.49Å; F188-F327 HydrophobicContact CG-CD2 4.04Å; F188-F327 AromaticContact CG-CE2 3.66Å; F188-F327 HydrophobicContact CG-CE2 3.66Å; F188-F327 HydrophobicContact CG-CZ 4.49Å; I191-F327 HydrophobicContact CB-CE1 4.17Å; I191-F327 HydrophobicContact CD1-CD1 4.2Å; I191-F327 HydrophobicContact CD1-CG 4.48Å; I191-F327 HydrophobicContact CG2-CD1 3.77Å; I191-F327 HydrophobicContact CG2-CE1 3.55Å; L286-F327 HydrophobicContact CD1-CB 4.17Å; L286-F327 HydrophobicContact CD2-CB 4.4Å; T323-F327 HydrophobicContact CG2-CD2 4.01Å; T323-F327 HydrophobicContact CG2-CE2 3.81Å; T323-F327 PolarHBondContact O-N 2.83Å; C324-F327 PolarHBondContact O-N 3.45Å; F327-L330 HydrophobicContact CD1-CD2 4.18Å; F327-L330 HydrophobicContact CE1-CD2 4.44Å; F327-M331 VanDerWaalsContact O-CB 3.24Å; F327-M331 WeakPolarHBondContact O-CB 3.14Å; F327-M331 PolarHBondContact O-N 3.43Å; F327-A352 HydrophobicContact CE1-CB 3.92Å; F327-A352 HydrophobicContact CZ-CB 4.32Å; F327-L355 HydrophobicContact CD1-CD1 4.26Å; F327-L355 HydrophobicContact CD2-CD1 4.21Å; F327-L355 HydrophobicContact CE1-CD1 4.33Å; F327-L355 HydrophobicContact CE2-CB 3.98Å; F327-L355 HydrophobicContact CE2-CD1 4.29Å; F327-L355 HydrophobicContact CG-CD1 4.2Å; F327-L355 HydrophobicContact CZ-CB 4.14Å; F327-L355 HydrophobicContact CZ-CD1 4.34Å
328	L	88.6	Confident	83.4	Confident	19 Å²	19	56.1 Å²	56.1	10%	0.099	30%	0.301	C	S	.	.	H	α-helix	trans	-68.7	-38.3	173.1	-74.6	166.6	0	0	0	112.5	L286 V316 C324 A325 G326 M331 Q332	L286-L328 HydrophobicContact CD1-CD2 3.78Å; L286-L328 HydrophobicContact CD1-CG 4Å; V316-L328 HydrophobicContact CG2-CD1 4.45Å; V316-L328 HydrophobicContact CG2-CD2 4.23Å; C324-L328 WeakPolarHBondContact O-CB 3.35Å; C324-L328 VanDerWaalsContact O-CG 3.32Å; C324-L328 WeakPolarHBondContact O-CG 3.34Å; C324-L328 PolarHBondContact O-N 3.01Å; A325-L328 PolarHBondContact O-N 2.91Å; G326-L328 VanDerWaalsContact C-N 3.31Å; G326-L328 PolarHBondContact O-N 3.17Å; L328-M331 HydrophobicContact CD2-CE 3.74Å; L328-M331 HydrophobicContact CD2-SD 4.2Å; L328-Q332 WeakPolarHBondContact O-CB 3.47Å; L328-Q332 VanDerWaalsContact O-CG 3.25Å; L328-Q332 WeakPolarHBondContact O-CG 3.44Å; L328-Q332 PolarHBondContact O-N 3.07Å
329	S	89.1	Confident	84.5	Confident	55 Å²	55	44.6 Å²	44.6	39%	0.385	26%	0.259	S	S	.	.	H	α-helix	trans	-65	-42.9	174.1	-174.6	0	0	0	0	111.5	A325 G326 Q332 R333	A325-S329 PolarHBondContact O-N 3.38Å; G326-S329 WeakPolarHBondContact O-CB 3.46Å; G326-S329 PolarHBondContact O-N 3.39Å; G326-S329 VanDerWaalsContact O-N 3.12Å; S329-Q332 PolarHBondContact O-N 2.85Å; S329-R333 PolarHBondContact O-N 3.19Å; S329-R333 VanDerWaalsContact O-N 3.11Å
330	L	90.8	Very high	85.7	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-58.8	-51	173.8	178.4	62.8	0	0	0	111.7	G326 F327 Q332 R333 C334 I348	G326-L330 PolarHBondContact O-N 3.12Å; F327-L330 HydrophobicContact CD1-CD2 4.18Å; F327-L330 HydrophobicContact CE1-CD2 4.44Å; L330-Q332 VanDerWaalsContact C-N 3.31Å; L330-Q332 PolarHBondContact O-N 3.44Å; L330-R333 VanDerWaalsContact CD1-NH2 3.31Å; L330-R333 PolarHBondContact O-N 2.94Å; L330-C334 PolarHBondContact O-N 3.22Å; L330-C334 VanDerWaalsContact O-N 3.13Å; L330-C334 PolarHBondContact O-SG 3.3Å; L330-I348 HydrophobicContact CD1-CB 4.43Å; L330-I348 HydrophobicContact CD1-CG1 4.15Å; L330-I348 HydrophobicContact CD1-CG2 4.35Å; L330-I348 HydrophobicContact CD2-CG2 4.19Å
331	M	92.4	Very high	86.2	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-55.5	-45.1	175.2	-179.7	-162.8	76.8	0	0	112	S279 I282 W283 L313 F327 L328 R333 C334 W335	S279-M331 WeakPolarHBondContact O-CG 3.5Å; I282-M331 HydrophobicContact CB-CB 4.29Å; I282-M331 HydrophobicContact CB-CG 4.13Å; I282-M331 HydrophobicContact CD1-CB 4.48Å; I282-M331 HydrophobicContact CG2-CB 3.83Å; I282-M331 HydrophobicContact CG2-CG 4.04Å; I282-M331 HydrophobicContact CG2-SD 4.27Å; W283-M331 VanDerWaalsContact CA-SD 3.58Å; W283-M331 HydrophobicContact CB-SD 3.52Å; W283-M331 VanDerWaalsContact CB-SD 3.52Å; W283-M331 HydrophobicContact CG-SD 4.19Å; L313-M331 HydrophobicContact CD2-CE 3.4Å; L313-M331 VanDerWaalsContact CD2-CE 3.4Å; F327-M331 VanDerWaalsContact O-CB 3.24Å; F327-M331 WeakPolarHBondContact O-CB 3.14Å; F327-M331 PolarHBondContact O-N 3.43Å; L328-M331 HydrophobicContact CD2-CE 3.74Å; L328-M331 HydrophobicContact CD2-SD 4.2Å; M331-R333 VanDerWaalsContact C-N 3.3Å; M331-R333 PolarHBondContact O-N 3.45Å; M331-C334 WeakPolarHBondContact O-CB 3.26Å; M331-C334 PolarHBondContact O-N 3.28Å; M331-W335 HydrophobicContact CE-CH2 3.74Å; M331-W335 HydrophobicContact CE-CZ2 3.83Å; M331-W335 HydrophobicContact CE-CZ3 4.24Å; M331-W335 PolarHBondContact O-N 3.17Å
332	Q	90.1	Very high	86.8	Confident	86 Å²	86	41.7 Å²	41.7	40%	0.402	25%	0.25	S	S	.	.	H	α-helix	trans	-63.4	-33.2	179.9	-79	175.4	-23.5	0	0	113.4	L313 L328 S329 L330 W335 V336	L313-Q332 VanDerWaalsContact CD1-NE2 3.26Å; L328-Q332 WeakPolarHBondContact O-CB 3.47Å; L328-Q332 VanDerWaalsContact O-CG 3.25Å; L328-Q332 WeakPolarHBondContact O-CG 3.44Å; L328-Q332 PolarHBondContact O-N 3.07Å; S329-Q332 PolarHBondContact O-N 2.85Å; L330-Q332 VanDerWaalsContact C-N 3.31Å; L330-Q332 PolarHBondContact O-N 3.44Å; Q332-W335 HydrophobicContact CG-CZ2 4.28Å; Q332-W335 PolarHBondContact O-NE1 3.41Å; Q332-V336 WeakPolarHBondContact O-CG2 3.44Å
333	R	91.3	Very high	87.5	Confident	84 Å²	84	38.2 Å²	38.2	32%	0.317	23%	0.226	S	C	.	.	H	α-helix	trans	-74.5	-26.7	173.5	-72.2	-176.1	-66.7	112.1	8.6	112.6	S329 L330 M331 V336 P343 E351	S329-R333 PolarHBondContact O-N 3.19Å; S329-R333 VanDerWaalsContact O-N 3.11Å; L330-R333 VanDerWaalsContact CD1-NH2 3.31Å; L330-R333 PolarHBondContact O-N 2.94Å; M331-R333 VanDerWaalsContact C-N 3.3Å; M331-R333 PolarHBondContact O-N 3.45Å; R333-V336 WeakPolarHBondContact O-CG2 3.4Å; R333-P343 WeakPolarHBondContact O-CD 3.16Å; R333-E351 IonicContact CZ-OE1 2.69Å; R333-E351 IonicContact CZ-OE2 2.72Å; R333-E351 IonicContact NH1-OE2 3.86Å; R333-E351 PolarHBondContact NH1-OE2 2.88Å; R333-E351 IonicContact NH2-OE1 3.44Å; R333-E351 PolarHBondContact NH2-OE1 2.84Å; R333-E351 IonicContact NH2-OE2 3.94Å; R333-E351 PolarHBondContact NH2-OE2 2.86Å
334	C	89.7	Confident	88.1	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-75.6	-27.9	179.7	-64.2	0	0	0	0	113.7	V275 L330 M331 R342	V275-C334 HydrophobicContact CG1-CB 3.81Å; L330-C334 PolarHBondContact O-N 3.22Å; L330-C334 VanDerWaalsContact O-N 3.13Å; L330-C334 PolarHBondContact O-SG 3.3Å; M331-C334 WeakPolarHBondContact O-CB 3.26Å; M331-C334 PolarHBondContact O-N 3.28Å; C334-R342 VanDerWaalsContact O-CD 3.24Å; C334-R342 WeakPolarHBondContact O-CD 3.35Å; C334-R342 WeakPolarHBondContact O-CG 3.49Å
335	W	90.2	Very high	88.4	Confident	26 Å²	26	39.5 Å²	39.5	10%	0.098	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	16.1	-179.2	66.5	13.2	0	0	0	116.2	Y276 S279 I280 R310 P311 L313 M331 Q332	Y276-W335 HydrophobicContact CD2-CB 4.05Å; Y276-W335 HydrophobicContact CE2-CB 3.88Å; S279-W335 VanDerWaalsContact OG-CB 3.3Å; S279-W335 WeakPolarHBondContact OG-CB 3.46Å; I280-W335 HydrophobicContact CD1-CE3 3.77Å; I280-W335 HydrophobicContact CD1-CZ3 4.2Å; R310-W335 HydrophobicContact CB-CE3 4.35Å; R310-W335 HydrophobicContact CB-CH2 3.98Å; R310-W335 HydrophobicContact CB-CZ2 4.22Å; R310-W335 HydrophobicContact CB-CZ3 4.07Å; R310-W335 HydrophobicContact CG-CD2 4.22Å; R310-W335 HydrophobicContact CG-CE3 4.35Å; R310-W335 PolarHBondContact NH2-O 3.41Å; P311-W335 HydrophobicContact CG-CZ3 4.48Å; L313-W335 HydrophobicContact CD1-CZ2 4.36Å; L313-W335 HydrophobicContact CD2-CH2 3.71Å; L313-W335 HydrophobicContact CD2-CZ2 3.89Å; L313-W335 HydrophobicContact CG-CH2 4.36Å; L313-W335 HydrophobicContact CG-CZ2 4.38Å; M331-W335 HydrophobicContact CE-CH2 3.74Å; M331-W335 HydrophobicContact CE-CZ2 3.83Å; M331-W335 HydrophobicContact CE-CZ3 4.24Å; M331-W335 PolarHBondContact O-N 3.17Å; Q332-W335 HydrophobicContact CG-CZ2 4.28Å; Q332-W335 PolarHBondContact O-NE1 3.41Å
336	V	87.2	Confident	88.8	Confident	52 Å²	52	43 Å²	43	32%	0.315	24%	0.24	S	C	.	.			trans	-60.4	142.4	178.2	178.7	0	0	0	0	109.9	Q332 R333 S338 A341 R342	Q332-V336 WeakPolarHBondContact O-CG2 3.44Å; R333-V336 WeakPolarHBondContact O-CG2 3.4Å; V336-S338 VanDerWaalsContact C-N 3.26Å; V336-S338 WeakPolarHBondContact CG1-OG 3.5Å; V336-S338 PolarHBondContact O-N 3.47Å; V336-A341 HydrophobicContact CG1-CB 4.27Å; V336-R342 PolarHBondContact O-NE 2.82Å; V336-R342 PolarHBondContact O-NH2 3.19Å; V336-R342 VanDerWaalsContact O-NH2 3.1Å
337	N	80	Confident	89.1	Confident	101 Å²	101	47 Å²	47	54%	0.54	25%	0.254	S	S	.	.	S	Bend	trans	-60.6	-32.6	-177.3	-74.5	-18	0	0	0	113.1	R310 P339	R310-N337 PolarHBondContact NH2-OD1 3.28Å; N337-P339 WeakPolarHBondContact O-CD 3.4Å
338	S	81.6	Confident	89.3	Confident	57 Å²	57	47 Å²	47	40%	0.399	26%	0.255	S	S	.	.	S	Bend	trans	-83.2	115.1	176.4	43	0	0	0	0	111	V336 N340 A341	V336-S338 VanDerWaalsContact C-N 3.26Å; V336-S338 WeakPolarHBondContact CG1-OG 3.5Å; V336-S338 PolarHBondContact O-N 3.47Å; S338-N340 VanDerWaalsContact C-N 3.29Å; S338-N340 PolarHBondContact O-N 3.37Å; S338-A341 PolarHBondContact O-N 3.41Å; S338-A341 VanDerWaalsContact O-N 3.1Å; S338-A341 VanDerWaalsContact OG-CB 3.23Å; S338-A341 WeakPolarHBondContact OG-CB 3.31Å
339	P	83.3	Confident	89.5	Confident	12 Å²	12	46.9 Å²	46.9	8%	0.078	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-59.5	-38.6	-178.1	-25.4	35.7	0	0	0	113.1	E260 K272 N337 A341 R342	E260-P339 HydrophobicContact CG-CG 4.12Å; K272-P339 HydrophobicContact CB-CB 4.24Å; N337-P339 WeakPolarHBondContact O-CD 3.4Å; P339-A341 PolarHBondContact O-N 3Å; P339-R342 WeakPolarHBondContact O-CB 2.88Å; P339-R342 PolarHBondContact O-N 2.91Å; P339-R342 VanDerWaalsContact O-N 3.14Å
340	N	83.7	Confident	89.6	Confident	139 Å²	139	47.5 Å²	47.5	74%	0.743	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-66.5	-21.3	-179.7	-62.2	-9.2	0	0	0	113.5	S338	S338-N340 VanDerWaalsContact C-N 3.29Å; S338-N340 PolarHBondContact O-N 3.37Å
341	A	86.8	Confident	89.7	Confident	60 Å²	60	49.9 Å²	49.9	50%	0.496	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-87.6	-10.1	178.5	0	0	0	0	0	112.8	V336 S338 P339	V336-A341 HydrophobicContact CG1-CB 4.27Å; S338-A341 PolarHBondContact O-N 3.41Å; S338-A341 VanDerWaalsContact O-N 3.1Å; S338-A341 VanDerWaalsContact OG-CB 3.23Å; S338-A341 WeakPolarHBondContact OG-CB 3.31Å; P339-A341 PolarHBondContact O-N 3Å
342	R	92.9	Very high	89.6	Confident	3 Å²	3	49.9 Å²	49.9	1%	0.011	27%	0.27	C	S	.	.	S	Bend	trans	-72.8	141.8	176.6	-59.8	176.2	-170.1	152.8	8.3	109.2	E260 K272 V275 C334 V336 P339	E260-R342 VanDerWaalsContact CD-NH2 3.25Å; E260-R342 IonicContact OE1-CZ 3.73Å; E260-R342 IonicContact OE1-NH1 2.72Å; E260-R342 PolarHBondContact OE1-NH1 3.14Å; E260-R342 IonicContact OE1-NH2 3.89Å; E260-R342 PolarHBondContact OE1-NH2 3.27Å; E260-R342 IonicContact OE2-NH2 2.67Å; E260-R342 PolarHBondContact OE2-NH2 3.14Å; K272-R342 HydrophobicContact CD-CB 4.22Å; K272-R342 PolarHBondContact NZ-O 3.28Å; K272-R342 PolarHBondContact O-NH1 3.42Å; V275-R342 HydrophobicContact CG1-CB 4Å; C334-R342 VanDerWaalsContact O-CD 3.24Å; C334-R342 WeakPolarHBondContact O-CD 3.35Å; C334-R342 WeakPolarHBondContact O-CG 3.49Å; V336-R342 PolarHBondContact O-NE 2.82Å; V336-R342 PolarHBondContact O-NH2 3.19Å; V336-R342 VanDerWaalsContact O-NH2 3.1Å; P339-R342 WeakPolarHBondContact O-CB 2.88Å; P339-R342 PolarHBondContact O-N 2.91Å; P339-R342 VanDerWaalsContact O-N 3.14Å
343	P	93.1	Very high	89.7	Confident	7 Å²	7	50.9 Å²	50.9	5%	0.045	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-65.4	167.5	176.7	27.2	-33.5	0	0	0	112.1	K272 R333 E347 I348	K272-P343 VanDerWaalsContact NZ-C 3.27Å; K272-P343 PolarHBondContact NZ-O 3.24Å; R333-P343 WeakPolarHBondContact O-CD 3.16Å; P343-E347 WeakPolarHBondContact CA-OE2 3.42Å; P343-E347 HydrophobicContact CB-CB 4.15Å; P343-E347 VanDerWaalsContact CB-OE2 3.25Å; P343-E347 WeakPolarHBondContact CB-OE2 3.45Å; P343-I348 HydrophobicContact CB-CG1 4.05Å; P343-I348 HydrophobicContact CG-CD1 4.05Å; P343-I348 HydrophobicContact CG-CG1 3.74Å
344	T	92.8	Very high	89.5	Confident	53 Å²	53	51.9 Å²	51.9	33%	0.325	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-85.9	158.8	168.6	62.8	0	0	0	0	110.7	Q346 E347 I348	T344-Q346 PolarHBondContact O-N 3.14Å; T344-E347 PolarHBondContact N-OE2 3.41Å; T344-E347 PolarHBondContact O-N 3.36Å; T344-E347 VanDerWaalsContact O-N 3.11Å; T344-E347 WeakPolarHBondContact OG1-CG 3.39Å; T344-E347 PolarHBondContact OG1-N 3.43Å; T344-I348 VanDerWaalsContact O-CG1 3.25Å; T344-I348 WeakPolarHBondContact O-CG1 3.45Å; T344-I348 PolarHBondContact O-N 3.12Å
345	F	93.3	Very high	89.4	Confident	3 Å²	3	53.4 Å²	53.4	1%	0.013	29%	0.291	C	S	.	.	H	α-helix	trans	-61.5	-24.7	174.7	-88.6	-79.4	0	0	0	113.4	M198 N199 H202 D274 V275 F278 I348 T349	M198-F345 HydrophobicContact CB-CD1 3.49Å; M198-F345 VanDerWaalsContact CB-CD1 3.49Å; M198-F345 HydrophobicContact CB-CD2 4.18Å; M198-F345 HydrophobicContact CB-CE1 3.3Å; M198-F345 HydrophobicContact CB-CE2 4Å; M198-F345 HydrophobicContact CB-CG 3.93Å; M198-F345 HydrophobicContact CB-CZ 3.56Å; M198-F345 HydrophobicContact CE-CE2 4.24Å; M198-F345 HydrophobicContact CE-CZ 4.24Å; M198-F345 HydrophobicContact CG-CD1 4.49Å; M198-F345 HydrophobicContact CG-CE1 3.83Å; M198-F345 HydrophobicContact CG-CZ 3.86Å; N199-F345 HydrophobicContact CB-CB 3.9Å; H202-F345 AromaticContact CE1-CD2 3.37Å; H202-F345 WeakPolarHBondContact CE1-CD2 3.44Å; H202-F345 AromaticContact CE1-CE2 3.46Å; H202-F345 VanDerWaalsContact CE1-CE2 3.46Å; H202-F345 WeakPolarHBondContact CE1-CE2 3.38Å; H202-F345 AromaticContact ND1-CD2 3.3Å; H202-F345 VanDerWaalsContact ND1-CD2 3.3Å; H202-F345 WeakPolarHBondContact ND1-CD2 3.24Å; H202-F345 AromaticContact ND1-CE2 3.91Å; D274-F345 HydrophobicContact CB-CE2 3.89Å; D274-F345 HydrophobicContact CB-CZ 4.41Å; V275-F345 HydrophobicContact CB-CE2 4.36Å; V275-F345 HydrophobicContact CG2-CD2 3.67Å; V275-F345 HydrophobicContact CG2-CE2 3.54Å; V275-F345 HydrophobicContact CG2-CZ 4.31Å; F278-F345 HydrophobicContact CB-CE1 4.14Å; F278-F345 HydrophobicContact CB-CZ 3.82Å; F278-F345 AromaticContact CD1-CE1 3.64Å; F278-F345 HydrophobicContact CD1-CE1 3.64Å; F278-F345 HydrophobicContact CD1-CZ 4.17Å; F278-F345 HydrophobicContact CD2-CE1 4.48Å; F278-F345 HydrophobicContact CE1-CE1 4.14Å; F278-F345 AromaticContact CG-CE1 3.83Å; F278-F345 HydrophobicContact CG-CE1 3.83Å; F278-F345 HydrophobicContact CG-CZ 4.05Å; F345-I348 HydrophobicContact CD1-CD1 4.22Å; F345-I348 HydrophobicContact CE1-CD1 4.47Å; F345-I348 HydrophobicContact CG-CD1 4.43Å; F345-T349 VanDerWaalsContact O-CB 3.27Å; F345-T349 WeakPolarHBondContact O-CB 3.23Å; F345-T349 PolarHBondContact O-N 3.12Å; F345-T349 PolarHBondContact O-OG1 2.97Å
346	Q	91.9	Very high	89.1	Confident	127 Å²	127	55.1 Å²	55.1	59%	0.593	31%	0.306	S	S	*	.	H	α-helix	trans	-65.2	-45.8	172.8	-174.6	-178.9	2.4	0	0	111.7	N199 T344 T349 S350	N199-Q346 VanDerWaalsContact OD1-CA 3.25Å; N199-Q346 WeakPolarHBondContact OD1-CA 3.32Å; N199-Q346 PolarHBondContact OD1-N 3.02Å; T344-Q346 PolarHBondContact O-N 3.14Å; Q346-T349 PolarHBondContact O-N 3.42Å; Q346-S350 WeakPolarHBondContact O-CB 3.48Å; Q346-S350 PolarHBondContact O-N 2.91Å; Q346-S350 PolarHBondContact O-OG 2.84Å
347	E	92.6	Very high	88.4	Confident	103 Å²	103	56.6 Å²	56.6	48%	0.481	32%	0.319	S	S	.	.	H	α-helix	trans	-65.7	-44.3	175.6	-69	164.9	167	0	0	111.1	P343 T344 T349 S350 E351	P343-E347 WeakPolarHBondContact CA-OE2 3.42Å; P343-E347 HydrophobicContact CB-CB 4.15Å; P343-E347 VanDerWaalsContact CB-OE2 3.25Å; P343-E347 WeakPolarHBondContact CB-OE2 3.45Å; T344-E347 PolarHBondContact N-OE2 3.41Å; T344-E347 PolarHBondContact O-N 3.36Å; T344-E347 VanDerWaalsContact O-N 3.11Å; T344-E347 WeakPolarHBondContact OG1-CG 3.39Å; T344-E347 PolarHBondContact OG1-N 3.43Å; E347-T349 VanDerWaalsContact C-N 3.33Å; E347-T349 PolarHBondContact O-N 2.95Å; E347-S350 PolarHBondContact O-N 3.32Å; E347-E351 WeakPolarHBondContact O-CB 3.43Å; E347-E351 PolarHBondContact O-N 3.45Å
348	I	94.1	Very high	87.2	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-59.2	-45.1	177.3	-65	168.3	0	0	0	110.7	A195 V275 F278 L330 P343 T344 F345 E351 A352	A195-I348 HydrophobicContact CB-CG2 3.95Å; V275-I348 HydrophobicContact CG1-CD1 3.82Å; V275-I348 HydrophobicContact CG2-CD1 4.16Å; F278-I348 HydrophobicContact CD1-CG2 4.27Å; F278-I348 HydrophobicContact CE1-CG2 3.71Å; L330-I348 HydrophobicContact CD1-CB 4.43Å; L330-I348 HydrophobicContact CD1-CG1 4.15Å; L330-I348 HydrophobicContact CD1-CG2 4.35Å; L330-I348 HydrophobicContact CD2-CG2 4.19Å; P343-I348 HydrophobicContact CB-CG1 4.05Å; P343-I348 HydrophobicContact CG-CD1 4.05Å; P343-I348 HydrophobicContact CG-CG1 3.74Å; T344-I348 VanDerWaalsContact O-CG1 3.25Å; T344-I348 WeakPolarHBondContact O-CG1 3.45Å; T344-I348 PolarHBondContact O-N 3.12Å; F345-I348 HydrophobicContact CD1-CD1 4.22Å; F345-I348 HydrophobicContact CE1-CD1 4.47Å; F345-I348 HydrophobicContact CG-CD1 4.43Å; I348-E351 PolarHBondContact O-N 2.98Å; I348-A352 VanDerWaalsContact O-CB 3.24Å; I348-A352 WeakPolarHBondContact O-CB 3.48Å; I348-A352 PolarHBondContact O-N 2.75Å
349	T	92.8	Very high	85.4	Confident	16 Å²	16	59.8 Å²	59.8	10%	0.098	33%	0.333	C	S	.	.	H	α-helix	trans	-63.8	-47.6	179.6	-58.9	0	0	0	0	110.9	A195 V196 F345 Q346 E347 E351 A352 E353	A195-T349 PolarHBondContact O-OG1 3.09Å; V196-T349 HydrophobicContact CB-CG2 4.46Å; V196-T349 HydrophobicContact CG2-CG2 3.6Å; F345-T349 VanDerWaalsContact O-CB 3.27Å; F345-T349 WeakPolarHBondContact O-CB 3.23Å; F345-T349 PolarHBondContact O-N 3.12Å; F345-T349 PolarHBondContact O-OG1 2.97Å; Q346-T349 PolarHBondContact O-N 3.42Å; E347-T349 VanDerWaalsContact C-N 3.33Å; E347-T349 PolarHBondContact O-N 2.95Å; T349-E351 VanDerWaalsContact C-N 3.32Å; T349-E351 PolarHBondContact O-N 2.84Å; T349-A352 PolarHBondContact O-N 3.2Å; T349-E353 WeakPolarHBondContact O-CB 3.15Å; T349-E353 PolarHBondContact O-N 2.93Å
350	S	91.4	Very high	83.5	Confident	67 Å²	67	65.4 Å²	65.4	47%	0.469	36%	0.358	S	S	.	.	H	α-helix	trans	-60.6	-42	180	-55.3	0	0	0	0	111.9	Q346 E347 E354	Q346-S350 WeakPolarHBondContact O-CB 3.48Å; Q346-S350 PolarHBondContact O-N 2.91Å; Q346-S350 PolarHBondContact O-OG 2.84Å; E347-S350 PolarHBondContact O-N 3.32Å; S350-E354 PolarHBondContact O-N 3.1Å; S350-E354 VanDerWaalsContact O-N 3.07Å
351	E	92.2	Very high	81.3	Confident	51 Å²	51	66.2 Å²	66.2	24%	0.238	36%	0.363	C	S	.	.	H	α-helix	trans	-72.6	-40.4	178.4	-173.7	174.8	158.9	0	0	112.6	R333 E347 I348 T349 E353 E354 L355	R333-E351 IonicContact CZ-OE1 2.69Å; R333-E351 IonicContact CZ-OE2 2.72Å; R333-E351 IonicContact NH1-OE2 3.86Å; R333-E351 PolarHBondContact NH1-OE2 2.88Å; R333-E351 IonicContact NH2-OE1 3.44Å; R333-E351 PolarHBondContact NH2-OE1 2.84Å; R333-E351 IonicContact NH2-OE2 3.94Å; R333-E351 PolarHBondContact NH2-OE2 2.86Å; E347-E351 WeakPolarHBondContact O-CB 3.43Å; E347-E351 PolarHBondContact O-N 3.45Å; I348-E351 PolarHBondContact O-N 2.98Å; T349-E351 VanDerWaalsContact C-N 3.32Å; T349-E351 PolarHBondContact O-N 2.84Å; E351-E353 VanDerWaalsContact C-N 3.3Å; E351-E353 PolarHBondContact O-N 3.39Å; E351-E354 PolarHBondContact O-N 3.03Å; E351-L355 HydrophobicContact CG-CD1 4.27Å; E351-L355 WeakPolarHBondContact O-CB 3.42Å; E351-L355 VanDerWaalsContact O-CG 3.26Å; E351-L355 WeakPolarHBondContact O-CG 3.42Å; E351-L355 PolarHBondContact O-N 3.45Å
352	A	90.8	Very high	78.7	Confident	0 Å²	0	72 Å²	72	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-62	-39.5	174.7	0	0	0	0	0	111.5	H192 F327 I348 T349 L355 C356	H192-A352 HydrophobicContact CB-CB 4.37Å; F327-A352 HydrophobicContact CE1-CB 3.92Å; F327-A352 HydrophobicContact CZ-CB 4.32Å; I348-A352 VanDerWaalsContact O-CB 3.24Å; I348-A352 WeakPolarHBondContact O-CB 3.48Å; I348-A352 PolarHBondContact O-N 2.75Å; T349-A352 PolarHBondContact O-N 3.2Å; A352-L355 PolarHBondContact O-N 2.83Å; A352-C356 WeakPolarHBondContact O-CB 3.47Å; A352-C356 PolarHBondContact O-N 3.19Å; A352-C356 PolarHBondContact O-SG 2.98Å
353	E	91.2	Very high	75.7	Confident	107 Å²	107	77.7 Å²	77.7	50%	0.5	42%	0.417	S	S	.	.	H	α-helix	trans	-63.8	-43.2	174.5	-171.9	176.5	-170.8	0	0	111.6	T349 E351 L355 C356 S357	T349-E353 WeakPolarHBondContact O-CB 3.15Å; T349-E353 PolarHBondContact O-N 2.93Å; E351-E353 VanDerWaalsContact C-N 3.3Å; E351-E353 PolarHBondContact O-N 3.39Å; E353-L355 PolarHBondContact O-N 3.26Å; E353-C356 PolarHBondContact O-N 2.81Å; E353-S357 VanDerWaalsContact O-CB 3.3Å; E353-S357 WeakPolarHBondContact O-CB 3.29Å; E353-S357 PolarHBondContact O-N 3.11Å; E353-S357 PolarHBondContact O-OG 2.61Å
354	E	88.8	Confident	72.7	Confident	104 Å²	104	88.8 Å²	88.8	49%	0.486	46%	0.458	S	S	.	.	H	α-helix	trans	-62.9	-41.5	176.5	-174.3	176.3	-175.5	0	0	112.2	S350 E351 C356 S357 K358	S350-E354 PolarHBondContact O-N 3.1Å; S350-E354 VanDerWaalsContact O-N 3.07Å; E351-E354 PolarHBondContact O-N 3.03Å; E354-C356 VanDerWaalsContact C-N 3.33Å; E354-S357 PolarHBondContact O-N 2.77Å; E354-K358 HydrophobicContact CG-CD 4.31Å; E354-K358 IonicContact OE1-NZ 3.84Å; E354-K358 PolarHBondContact OE1-NZ 3.45Å
355	L	87.6	Confident	69.6	Low	32 Å²	32	92.2 Å²	92.2	17%	0.168	48%	0.479	C	S	.	.	H	α-helix	trans	-65.6	-35.4	176.6	-72	173.4	0	0	0	112.2	T323 F327 E351 A352 E353	T323-L355 HydrophobicContact CG2-CB 3.98Å; T323-L355 WeakPolarHBondContact CG2-O 3.29Å; F327-L355 HydrophobicContact CD1-CD1 4.26Å; F327-L355 HydrophobicContact CD2-CD1 4.21Å; F327-L355 HydrophobicContact CE1-CD1 4.33Å; F327-L355 HydrophobicContact CE2-CB 3.98Å; F327-L355 HydrophobicContact CE2-CD1 4.29Å; F327-L355 HydrophobicContact CG-CD1 4.2Å; F327-L355 HydrophobicContact CZ-CB 4.14Å; F327-L355 HydrophobicContact CZ-CD1 4.34Å; E351-L355 HydrophobicContact CG-CD1 4.27Å; E351-L355 WeakPolarHBondContact O-CB 3.42Å; E351-L355 VanDerWaalsContact O-CG 3.26Å; E351-L355 WeakPolarHBondContact O-CG 3.42Å; E351-L355 PolarHBondContact O-N 3.45Å; A352-L355 PolarHBondContact O-N 2.83Å; E353-L355 PolarHBondContact O-N 3.26Å
356	C	83	Confident	66.5	Low	62 Å²	62	98.1 Å²	98.1	42%	0.419	52%	0.518	S	S	.	.	H	α-helix	trans	-78.1	-26.5	177.5	-71.6	0	0	0	0	113.5	A352 E353 E354	A352-C356 WeakPolarHBondContact O-CB 3.47Å; A352-C356 PolarHBondContact O-N 3.19Å; A352-C356 PolarHBondContact O-SG 2.98Å; E353-C356 PolarHBondContact O-N 2.81Å; E354-C356 VanDerWaalsContact C-N 3.33Å
357	S	72.8	Confident	63.3	Low	83 Å²	83	103.6 Å²	103.6	58%	0.58	53%	0.533	S	S	*	.	H	α-helix	trans	-88.5	-13	-172.1	-61.1	0	0	0	0	115.3	E353 E354	E353-S357 VanDerWaalsContact O-CB 3.3Å; E353-S357 WeakPolarHBondContact O-CB 3.29Å; E353-S357 PolarHBondContact O-N 3.11Å; E353-S357 PolarHBondContact O-OG 2.61Å; E354-S357 PolarHBondContact O-N 2.77Å
358	K	53.6	Low	60.2	Low	99 Å²	99	106.5 Å²	106.5	43%	0.43	55%	0.551	S	S	.	*			trans	-109.5	110.3	-177.1	-69.3	176.7	178.2	173.5	0	111.5	E354 Q360	E354-K358 HydrophobicContact CG-CD 4.31Å; E354-K358 IonicContact OE1-NZ 3.84Å; E354-K358 PolarHBondContact OE1-NZ 3.45Å; K358-Q360 HydrophobicContact CB-CG 4.1Å; K358-Q360 PolarHBondContact O-N 3.38Å; K358-Q360 VanDerWaalsContact O-N 3.14Å
359	P	44.7	Very low	56.8	Low	126 Å²	126	111.1 Å²	111.1	82%	0.818	58%	0.583	S	S	*	*			trans	-70.2	103.6	154	27.7	-27.3	0	0	0	106.9	D361	P359-D361 PolarHBondContact O-N 3.2Å
360	Q	43.4	Very low	53.6	Low	130 Å²	130	117.3 Å²	117.3	61%	0.607	62%	0.621	S	S	*	*			trans	-78.8	113.6	-179.9	-68.2	-157.5	1.6	0	0	110.6	K358	K358-Q360 HydrophobicContact CB-CG 4.1Å; K358-Q360 PolarHBondContact O-N 3.38Å; K358-Q360 VanDerWaalsContact O-N 3.14Å
361	D	36.8	Very low	50.4	Low	156 Å²	156	119.4 Å²	119.4	83%	0.834	64%	0.636	S	S	*	*			trans	-54.1	136.8	157.2	-80.5	-41.9	0	0	0	110	P359	P359-D361 PolarHBondContact O-N 3.2Å
362	E	32.2	Very low	47.4	Very low	182 Å²	182	122.4 Å²	122.4	85%	0.85	66%	0.663	S	S	*	*			trans	-54.7	135.5	176.8	-75	-162.7	151.5	0	0	112.3	R364	E362-R364 PolarHBondContact O-N 3.47Å
363	P	31.6	Very low	44.2	Very low	123 Å²	123	131.2 Å²	131.2	80%	0.799	70%	0.704	S	S	*	*			trans	-76.4	109.3	167.2	23.9	-19.6	0	0	0	109.9	T365	P363-T365 PolarHBondContact O-N 3.22Å
364	R	28.3	Very low	41.3	Very low	240 Å²	240	131.7 Å²	131.7	91%	0.906	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-49.8	127.7	158.3	-77.8	177.8	175.2	148.8	-0.6	109.7	E362	E362-R364 PolarHBondContact O-N 3.47Å
365	T	27.7	Very low	38.2	Very low	124 Å²	124	135.3 Å²	135.3	76%	0.761	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-56.4	138.3	169.1	40.2	0	0	0	0	111.4	P363 R367	P363-T365 PolarHBondContact O-N 3.22Å; T365-R367 PolarHBondContact O-N 3.29Å
366	P	30.1	Very low	35.8	Very low	127 Å²	127	138.5 Å²	138.5	83%	0.825	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-82.7	116.5	168.4	7.6	8.8	0	0	0	109.6
367	R	24	Very low	33	Very low	243 Å²	243	143.7 Å²	143.7	92%	0.917	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-75.9	132.1	162.2	-75.3	-177	175.7	-176	-1.5	109.4	T365	T365-R367 PolarHBondContact O-N 3.29Å
368	L	27	Very low	30.7	Very low	163 Å²	163	144.5 Å²	144.5	85%	0.853	78%	0.784	S	S	*	*			trans	-118.2	107.1	157.8	-110.7	135.7	0	0	0	108.6
369	S	23.4	Very low	30	Very low	98 Å²	98	145.3 Å²	145.3	69%	0.685	80%	0.799	S	S	*	*			trans	34.9	107.3	147.1	59.3	0	0	0	0	120.1
370	T	25.2	Very low	29.1	Very low	147 Å²	147	146.5 Å²	146.5	90%	0.902	80%	0.799	S	S	*	*				-138.9	138.3	123.8	45	0	0	0	0	109.5
371	S	25.1	Very low	28.9	Very low	110 Å²	110	145.6 Å²	145.6	77%	0.769	80%	0.804	S	S	*	*			trans	-72.1	167.6	-175.8	45.7	0	0	0	0	113.9
372	S	28	Very low	28.3	Very low	115 Å²	115	144.4 Å²	144.4	80%	0.804	80%	0.802	S	S	*	*			trans	78.8	107.8	162.3	53.1	0	0	0	0	119.3
373	E	23.1	Very low	28	Very low	185 Å²	185	139.8 Å²	139.8	86%	0.864	80%	0.795	S	S	*	*			trans	-47.5	174.8	153.1	-76.6	-170.3	157.8	0	0	114.8
374	P	31.8	Very low	27.7	Very low	117 Å²	117	138.8 Å²	138.8	76%	0.76	79%	0.791	S	S	*	*			cis	-131.6	166.5	6.7	19.4	6.2	0	0	0	116.9
375	E	22	Very low	27.6	Very low	180 Å²	180	133.3 Å²	133.3	84%	0.841	78%	0.78	S	S	*	*			trans	-51.7	-176.1	160.3	-78.9	-154.8	166	0	0	115.4
376	P	38	Very low	27.5	Very low	99 Å²	99	135.4 Å²	135.4	64%	0.643	78%	0.781	S	S	*	*			cis	-130.3	177	-34.3	27.6	-8.2	0	0	0	110.6
377	L	25.1	Very low	27.2	Very low	170 Å²	170	134.6 Å²	134.6	89%	0.89	78%	0.779	S	S	*	*			trans	179.6	118.2	138.4	-93.8	155.4	0	0	0	110.9
378	S	24.6	Very low	27.2	Very low	100 Å²	100	130.8 Å²	130.8	70%	0.699	78%	0.776	S	S	*	*			trans	-59.3	177	158	56.9	0	0	0	0	112.4
379	P	37.3	Very low	27	Very low	117 Å²	117	127.4 Å²	127.4	76%	0.76	77%	0.772	S	S	*	*			cis	-135.3	178.9	-0.6	23.7	2.3	0	0	0	114.5
380	N	26.8	Very low	26.9	Very low	150 Å²	150	128.2 Å²	128.2	80%	0.802	78%	0.777	S	S	*	*			trans	-37.5	167.8	159.7	-61	-33.4	0	0	0	113.9
381	P	37.9	Very low	26.9	Very low	112 Å²	112	130.6 Å²	130.6	73%	0.727	78%	0.775	S	S	*	*			cis	-161	-174.1	31.5	47	-23.9	0	0	0	119
382	V	24.9	Very low	26.9	Very low	131 Å²	131	131.1 Å²	131.1	79%	0.794	78%	0.776	S	S	*	*			trans	66.3	117.4	147.3	-170.6	0	0	0	0	121.9
383	A	27	Very low	26.7	Very low	85 Å²	85	131.8 Å²	131.8	70%	0.702	78%	0.775	S	S	*	*			trans	16.3	137.4	137.5	0	0	0	0	0	121.4
384	S	25.4	Very low	26.7	Very low	101 Å²	101	133.4 Å²	133.4	71%	0.706	77%	0.773	S	S	*	*				162.5	149.5	95.1	57.7	0	0	0	0	112.3
385	D	24.4	Very low	26.3	Very low	125 Å²	125	133.7 Å²	133.7	67%	0.668	78%	0.775	S	S	*	*			trans	69.5	109.1	149.1	-71.1	-28	0	0	0	120
386	Q	26.8	Very low	26.4	Very low	168 Å²	168	133.4 Å²	133.4	79%	0.785	77%	0.771	S	S	*	*				87.2	130.8	86.7	-81.2	-174.7	51.5	0	0	114.5
387	S	23.4	Very low	25.7	Very low	111 Å²	111	134.3 Å²	134.3	78%	0.776	78%	0.78	S	S	*	*			trans	108.7	111.6	149.3	78.2	0	0	0	0	119.1
388	N	24.2	Very low	25.7	Very low	163 Å²	163	130.5 Å²	130.5	87%	0.872	77%	0.773	S	S	*	*			trans	13.9	128.8	142	-63.5	-22.7	0	0	0	120
389	A	21.8	Very low	25.6	Very low	91 Å²	91	133.1 Å²	133.1	75%	0.752	78%	0.776	S	S	*	*				171.3	132	105.4	0	0	0	0	0	114
390	S	22.4	Very low	24.9	Very low	115 Å²	115	134.1 Å²	134.1	80%	0.804	77%	0.774	S	S	*	*			trans	48.1	110.4	144.5	59	0	0	0	0	123.6
391	K	25.2	Very low	25.2	Very low	197 Å²	197	132.2 Å²	132.2	86%	0.857	77%	0.77	S	S	*	*			trans	1.7	149.9	138.9	-68.1	178.5	178.2	172.6	0	120.6
392	P	25.4	Very low	25	Very low	122 Å²	122	135.4 Å²	135.4	79%	0.792	78%	0.775	S	S	*	*				-140.6	132.9	90.6	31.9	-13.5	0	0	0	115.4
393	V	23.1	Very low	25	Very low	129 Å²	129	137.1 Å²	137.1	78%	0.782	77%	0.772	S	S	*	*				77	99.5	106.1	-173.2	0	0	0	0	118
394	R	23.4	Very low	25.1	Very low	218 Å²	218	140.9 Å²	140.9	82%	0.823	78%	0.78	S	S	*	*			trans	27.7	153.8	131.3	-77.6	-175.9	178.7	172.2	-0.5	123
395	P	24.1	Very low	25.5	Very low	124 Å²	124	143.8 Å²	143.8	81%	0.805	78%	0.777	S	S	*	*				-123.8	130	94.2	8.7	12	0	0	0	112.3
396	K	22.5	Very low	26.1	Very low	174 Å²	174	141.2 Å²	141.2	76%	0.757	77%	0.769	S	S	*	*				74.2	102.5	87	-74	-172.7	178.8	-179.8	0	114
397	S	24	Very low	26.5	Very low	117 Å²	117	140.2 Å²	140.2	82%	0.818	77%	0.768	S	S	*	*				93.5	138.5	111.1	-77.5	0	0	0	0	112.6
398	A	24.3	Very low	27.3	Very low	91 Å²	91	138.4 Å²	138.4	75%	0.752	76%	0.755	S	S	*	*			cis	-149.2	132.4	34	0	0	0	0	0	111.1
399	M	22.4	Very low	28.2	Very low	155 Å²	155	136 Å²	136	76%	0.764	74%	0.739	S	S	*	*				63.4	98.1	91.2	-58.7	-114.2	93.7	0	0	114.3
400	L	23.9	Very low	29.1	Very low	138 Å²	138	136.7 Å²	136.7	72%	0.723	73%	0.729	S	S	*	*				92.1	156.4	97.3	-83.1	177	0	0	0	113.9
401	P	31.7	Very low	29.7	Very low	109 Å²	109	136.6 Å²	136.6	71%	0.708	72%	0.719	S	S	*	*			cis	-130.3	160.4	1.6	35.3	-16.2	0	0	0	116.6
402	E	34.4	Very low	30.4	Very low	180 Å²	180	132.8 Å²	132.8	84%	0.841	71%	0.708	S	S	*	*			trans	-64.1	142.4	157.9	-67.6	170.2	154.4	0	0	110.7
403	K	25.1	Very low	30.8	Very low	167 Å²	167	134.5 Å²	134.5	73%	0.726	71%	0.706	S	S	*	*			trans	-134.9	112.3	159	-87.9	-171	175.5	-176.7	0	108.9	Y405	K403-Y405 HydrophobicContact CB-CE2 4.28Å; K403-Y405 PolarHBondContact O-N 2.95Å
404	D	29.5	Very low	31.6	Very low	164 Å²	164	134 Å²	134	88%	0.877	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-61.2	124.5	161.5	-65.5	-45.5	0	0	0	108.8
405	Y	33.5	Very low	31.9	Very low	162 Å²	162	129.9 Å²	129.9	64%	0.635	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-98.3	119.4	169.7	-79.2	-83.4	0	0	0	109.2	K403	K403-Y405 HydrophobicContact CB-CE2 4.28Å; K403-Y405 PolarHBondContact O-N 2.95Å
406	S	36.5	Very low	32.4	Very low	71 Å²	71	129.2 Å²	129.2	50%	0.497	70%	0.695	S	S	.	*	P	Polyproline II helix	trans	-63.4	138.7	169.3	170.6	0	0	0	0	110.3	S408 E409	S406-S408 PolarHBondContact O-N 2.9Å; S406-S408 PolarHBondContact OG-OG 3.43Å; S406-E409 PolarHBondContact O-N 2.81Å
407	L	35.6	Very low	33	Very low	146 Å²	146	123.7 Å²	123.7	76%	0.764	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.5	-17.8	177.7	-115.3	150.6	0	0	0	114.4
408	S	40.3	Very low	33.3	Very low	73 Å²	73	125.8 Å²	125.8	51%	0.51	69%	0.688	S	S	.	*	T	Hydrogen-bonded Turn	trans	-73.5	-22.9	175.7	54.1	0	0	0	0	114.5	S406	S406-S408 PolarHBondContact O-N 2.9Å; S406-S408 PolarHBondContact OG-OG 3.43Å
409	E	42.7	Very low	33.3	Very low	113 Å²	113	127.1 Å²	127.1	53%	0.528	69%	0.691	S	S	.	*	T	Hydrogen-bonded Turn	trans	-91.6	-22.5	-173.8	-144.6	155.1	-166	0	0	112.6	S406 L411	S406-E409 PolarHBondContact O-N 2.81Å; E409-L411 VanDerWaalsContact C-N 3.35Å
410	L	40.4	Very low	33.5	Very low	105 Å²	105	131.3 Å²	131.3	55%	0.55	70%	0.699	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75.3	-21.1	172.1	-98	156.5	0	0	0	113.3
411	L	36.8	Very low	33.6	Very low	114 Å²	114	129.7 Å²	129.7	60%	0.597	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.7	-23.7	176.5	-70.6	169.6	0	0	0	112.5	E409 Q413 V414	E409-L411 VanDerWaalsContact C-N 3.35Å; L411-Q413 VanDerWaalsContact C-N 3.31Å; L411-Q413 PolarHBondContact O-N 3.5Å; L411-V414 PolarHBondContact O-N 3.4Å
412	N	38.8	Very low	33.2	Very low	117 Å²	117	134.5 Å²	134.5	63%	0.626	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-8.7	177.2	-80.5	-18.4	0	0	0	114.6
413	Q	34.9	Very low	32.8	Very low	158 Å²	158	132.5 Å²	132.5	74%	0.738	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90	-7.4	174.6	-74.8	-173.4	-9.4	0	0	113.7	L411	L411-Q413 VanDerWaalsContact C-N 3.31Å; L411-Q413 PolarHBondContact O-N 3.5Å
414	V	39.2	Very low	32.7	Very low	117 Å²	117	135 Å²	135	71%	0.709	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	-19.7	177.3	-175.2	0	0	0	0	111.7	L411	L411-V414 PolarHBondContact O-N 3.4Å
415	D	30.4	Very low	32.5	Very low	132 Å²	132	134.1 Å²	134.1	71%	0.706	71%	0.709	S	S	*	*	S	Bend	trans	-95.5	1.4	-175.9	-75.5	-21.1	0	0	0	115.6	G417	D415-G417 VanDerWaalsContact C-N 3.34Å; D415-G417 PolarHBondContact O-N 3.07Å
416	S	33.9	Very low	32.1	Very low	111 Å²	111	134 Å²	134	78%	0.776	71%	0.712	S	S	*	*	S	Bend	trans	-90.1	8.8	-177.6	64.8	0	0	0	0	115.1
417	G	34	Very low	31.5	Very low	57 Å²	57	137.3 Å²	137.3	59%	0.588	72%	0.72	S	S	*	*	S	Bend	trans	-136.3	41.3	-170.8	0	0	0	0	0	115.4	D415	D415-G417 VanDerWaalsContact C-N 3.34Å; D415-G417 PolarHBondContact O-N 3.07Å
418	I	30.3	Very low	30.9	Very low	162 Å²	162	137.5 Å²	137.5	83%	0.831	72%	0.722	S	S	*	*			trans	-168.3	101.6	146.6	-79.6	128.2	0	0	0	107.3
419	S	24.2	Very low	30.1	Very low	118 Å²	118	138.5 Å²	138.5	83%	0.825	73%	0.728	S	S	*	*			trans	-167.5	97.4	152.3	-98.7	0	0	0	0	109.8
420	R	27.4	Very low	29.2	Very low	244 Å²	244	139.6 Å²	139.6	92%	0.921	74%	0.736	S	S	*	*			trans	-158.5	93.4	142.3	-76.1	-153.4	178.9	166.1	0.3	109.4
421	S	26.1	Very low	28.4	Very low	104 Å²	104	143.2 Å²	143.2	73%	0.727	75%	0.75	S	S	*	*				152.2	114	123.8	57.8	0	0	0	0	109.5
422	F	24.1	Very low	27.8	Very low	209 Å²	209	142.8 Å²	142.8	92%	0.917	76%	0.757	S	S	*	*				-172.9	127.8	120.2	-104.7	-75.8	0	0	0	108
423	D	24.9	Very low	27.2	Very low	138 Å²	138	146.7 Å²	146.7	74%	0.738	77%	0.768	S	S	*	*			trans	-116.3	133	177.7	-150.3	-1.8	0	0	0	106.7
424	R	24.2	Very low	26.7	Very low	219 Å²	219	148.4 Å²	148.4	83%	0.826	78%	0.776	S	S	*	*			trans	70.5	127.3	167.1	-56.7	177.7	172.6	-163.8	-5.3	117.5
425	V	24.8	Very low	26.1	Very low	146 Å²	146	150.2 Å²	150.2	89%	0.885	78%	0.782	S	S	*	*				-174	155.5	84.6	163.7	0	0	0	0	109.3
426	K	24.3	Very low	25.9	Very low	159 Å²	159	150.5 Å²	150.5	69%	0.691	79%	0.788	S	S	*	*			trans	-65.4	160.5	-172.3	-76.4	164.9	138.3	-115.4	0	117.7
427	E	24.1	Very low	25.5	Very low	142 Å²	142	151.6 Å²	151.6	66%	0.664	80%	0.795	S	S	*	*			trans	46.3	119	135.7	-64.7	165.5	154.3	0	0	119.4
428	D	23.2	Very low	25.2	Very low	150 Å²	150	158.7 Å²	158.7	80%	0.802	81%	0.81	S	S	*	*				167.4	140.3	103.2	-94	-28.8	0	0	0	114.6
429	S	23	Very low	25.1	Very low	93 Å²	93	162.1 Å²	162.1	65%	0.65	81%	0.812	S	S	*	*			trans	51	120.4	140.2	116.2	0	0	0	0	122.2
430	I	24.4	Very low	25.1	Very low	136 Å²	136	164.8 Å²	164.8	70%	0.697	82%	0.816	S	S	*	*				103	123.9	87.3	-75.6	173.2	0	0	0	113.4
431	H	24.1	Very low	25	Very low	181 Å²	181	159 Å²	159	84%	0.838	81%	0.813	S	S	*	*			trans	63.7	142.3	163.3	-67	-42.7	0	0	0	118
432	S	24.1	Very low	25	Very low	105 Å²	105	157.7 Å²	157.7	73%	0.734	82%	0.816	S	S	*	*			cis	-162.3	145.7	19.9	45.3	0	0	0	0	111.8
433	K	25.8	Very low	25.1	Very low	199 Å²	199	156.1 Å²	156.1	87%	0.865	82%	0.815	S	S	*	*			trans	7.6	127.4	150.7	-61.5	173.7	176.2	176.7	0	118.9
434	E	24.6	Very low	25.2	Very low	194 Å²	194	154.6 Å²	154.6	91%	0.907	82%	0.816	S	S	*	*				-174.8	149.8	103.7	-103.6	173.5	179	0	0	112.7
435	N	26.9	Very low	25.3	Very low	156 Å²	156	149.6 Å²	149.6	83%	0.834	81%	0.814	S	S	*	*			trans	-76.7	134.1	-169.5	-70.4	-40.1	0	0	0	112.8
436	T	25.2	Very low	25.4	Very low	137 Å²	137	147.5 Å²	147.5	84%	0.84	81%	0.812	S	S	*	*			trans	-153.9	103.7	137.2	44.5	0	0	0	0	110.9	K438	T436-K438 PolarHBondContact O-N 3.38Å
437	C	25.6	Very low	25.3	Very low	135 Å²	135	147.5 Å²	147.5	91%	0.912	82%	0.82	S	S	*	*			trans	-79	101.2	169.3	-80.8	0	0	0	0	110.2
438	K	27.8	Very low	25.4	Very low	206 Å²	206	146.3 Å²	146.3	90%	0.896	83%	0.827	S	S	*	*			trans	-94.3	105.8	154.4	-76.3	-179.1	179.2	175.1	0	108	T436	T436-K438 PolarHBondContact O-N 3.38Å
439	R	27.7	Very low	25.3	Very low	234 Å²	234	144.1 Å²	144.1	88%	0.883	83%	0.829	S	S	*	*			trans	-114.2	100.8	170.9	-153.8	174.7	-167.4	166.1	2.9	109.4
440	L	25.2	Very low	25.2	Very low	174 Å²	174	150 Å²	150	91%	0.911	84%	0.844	S	S	*	*			trans	18.1	105.7	138.8	-60.3	163.4	0	0	0	116.5
441	S	24.9	Very low	25.1	Very low	122 Å²	122	148.2 Å²	148.2	85%	0.853	84%	0.844	S	S	*	*			trans	-117.2	124.7	160.4	61.3	0	0	0	0	109.3
442	G	25.3	Very low	25.1	Very low	77 Å²	77	144.3 Å²	144.3	79%	0.794	84%	0.836	S	S	*	*			trans	-172.6	58.3	178.5	0	0	0	0	0	114.4
443	I	27.1	Very low	25.3	Very low	176 Å²	176	147.2 Å²	147.2	90%	0.903	84%	0.838	S	S	*	*			trans	-161	136.4	164.6	-22.4	163.7	0	0	0	104.9
444	S	26	Very low	25.2	Very low	106 Å²	106	144.1 Å²	144.1	74%	0.741	83%	0.832	S	S	*	*			cis	-166.9	160.7	-10.5	161.7	0	0	0	0	105.2
445	S	28.2	Very low	25.1	Very low	113 Å²	113	140.5 Å²	140.5	79%	0.79	83%	0.827	S	S	*	*			trans	-54.2	144.7	161.6	-54.8	0	0	0	0	112.7
446	A	26	Very low	25.1	Very low	102 Å²	102	140 Å²	140	84%	0.843	82%	0.824	S	S	*	*				157.3	142.8	116.9	0	0	0	0	0	112.5
447	D	22.8	Very low	25	Very low	160 Å²	160	139.3 Å²	139.3	86%	0.856	82%	0.824	S	S	*	*			trans	-76.1	154.3	172.6	-99.2	-45.1	0	0	0	113.6
448	S	24.8	Very low	25	Very low	116 Å²	116	139.7 Å²	139.7	81%	0.811	82%	0.816	S	S	*	*			trans	81.1	103.8	156.5	-58.2	0	0	0	0	120.3
449	A	22.6	Very low	24.9	Very low	104 Å²	104	135.3 Å²	135.3	86%	0.86	81%	0.812	S	S	*	*				-162.1	124.6	125.8	0	0	0	0	0	111.3
450	F	20.9	Very low	25.1	Very low	216 Å²	216	133.2 Å²	133.2	95%	0.947	81%	0.809	S	S	*	*			trans	-63.9	140	166.2	-110.5	-102.5	0	0	0	111.3
451	S	21.4	Very low	25.3	Very low	100 Å²	100	133.7 Å²	133.7	70%	0.699	81%	0.807	S	S	*	*				139.5	127.1	129.3	-167	0	0	0	0	114
452	S	24.6	Very low	25.6	Very low	98 Å²	98	137.3 Å²	137.3	69%	0.685	81%	0.807	S	S	*	*			trans	63.8	137.9	158	45	0	0	0	0	117.7
453	Q	27	Very low	25.7	Very low	166 Å²	166	143 Å²	143	78%	0.776	81%	0.813	S	S	*	*			cis	-167	148.7	9.6	-116.8	175.2	-11	0	0	107.7
454	D	24.1	Very low	25.8	Very low	135 Å²	135	139.7 Å²	139.7	72%	0.722	80%	0.801	S	S	*	*			trans	35.9	117.5	145.2	-60.6	-45.8	0	0	0	121
455	S	23.3	Very low	26.4	Very low	117 Å²	117	141.8 Å²	141.8	82%	0.818	81%	0.809	S	S	*	*				177.8	112.6	105.7	41.7	0	0	0	0	113.4
456	I	25.6	Very low	27.1	Very low	147 Å²	147	144.3 Å²	144.3	75%	0.754	81%	0.806	S	S	*	*			trans	-5.7	128.7	148	-50.4	166.5	0	0	0	116.3
457	S	24.3	Very low	28.3	Very low	121 Å²	121	145.1 Å²	145.1	85%	0.846	80%	0.797	S	S	*	*			trans	-153	111.3	141.3	-70.5	0	0	0	0	109.7
458	L	25	Very low	30.1	Very low	144 Å²	144	142 Å²	142	75%	0.754	79%	0.788	S	S	*	*			trans	-68.5	133	176.4	-70.9	149.4	0	0	0	110.5
459	S	26.4	Very low	32.1	Very low	114 Å²	114	139.2 Å²	139.2	80%	0.797	77%	0.771	S	S	*	*			trans	-133.8	106.3	153.2	46	0	0	0	0	108.9	E461	S459-E461 PolarHBondContact O-N 3.42Å
460	F	30.9	Very low	34.5	Very low	190 Å²	190	137.9 Å²	137.9	83%	0.833	75%	0.747	S	S	*	*			trans	-60.6	119.1	169.7	-85.1	-101	0	0	0	110.1
461	E	29.2	Very low	37.2	Very low	183 Å²	183	130.8 Å²	130.8	86%	0.855	72%	0.722	S	S	*	*			trans	-124.5	92.5	157	-76	-168	161.5	0	0	109.5	S459 E463	S459-E461 PolarHBondContact O-N 3.42Å; E461-E463 PolarHBondContact O-N 2.86Å
462	K	31.7	Very low	40	Very low	199 Å²	199	128.3 Å²	128.3	87%	0.865	70%	0.699	S	S	*	*			trans	31.6	87.9	135.6	-135.1	173.8	-175.2	-180	0	115.7	T464	K462-T464 PolarHBondContact O-N 3.3Å; K462-T464 VanDerWaalsContact O-N 3.12Å
463	E	27.9	Very low	42.8	Very low	197 Å²	197	125.7 Å²	125.7	92%	0.921	68%	0.675	S	S	*	*			trans	-60.4	108.3	165.3	-71.1	175.8	156.6	0	0	110	E461	E461-E463 PolarHBondContact O-N 2.86Å
464	T	28.8	Very low	45.5	Very low	106 Å²	106	124.6 Å²	124.6	65%	0.65	67%	0.668	S	S	*	*			trans	-83	134.9	153	46.2	0	0	0	0	107.7	K462 F466	K462-T464 PolarHBondContact O-N 3.3Å; K462-T464 VanDerWaalsContact O-N 3.12Å; T464-F466 PolarHBondContact O-N 3.1Å
465	T	39.2	Very low	48.4	Very low	149 Å²	149	123.5 Å²	123.5	91%	0.914	66%	0.657	S	S	*	*			trans	-54.2	93.3	179.4	48.2	0	0	0	0	111.2
466	F	42	Very low	51.3	Low	166 Å²	166	117.9 Å²	117.9	73%	0.728	62%	0.618	S	S	*	*			trans	-109.4	137.7	163.9	-92.4	-86.8	0	0	0	108.2	T464 S468	T464-F466 PolarHBondContact O-N 3.1Å; F466-S468 PolarHBondContact O-N 2.91Å
467	D	50.9	Low	54.2	Low	119 Å²	119	111.7 Å²	111.7	64%	0.636	59%	0.587	S	S	*	*			trans	-30.3	117.5	-171.5	-72.5	-50.5	0	0	0	115.5	A469 E470 V471	D467-A469 PolarHBondContact O-N 3.41Å; D467-E470 HydrophobicContact CB-CB 4.09Å; D467-E470 PolarHBondContact O-N 3.03Å; D467-V471 PolarHBondContact O-N 3.39Å
468	S	62.5	Low	57.2	Low	96 Å²	96	108.1 Å²	108.1	67%	0.671	56%	0.559	S	S	*	*	H	α-helix	trans	-50.2	-31.7	173.9	-176.4	0	0	0	0	112.4	F466 Q472	F466-S468 PolarHBondContact O-N 2.91Å; S468-Q472 WeakPolarHBondContact O-CB 3.33Å; S468-Q472 PolarHBondContact O-N 3.19Å; S468-Q472 VanDerWaalsContact O-N 3.1Å
469	A	65.4	Low	60.1	Low	56 Å²	56	101.3 Å²	101.3	46%	0.463	52%	0.523	S	S	.	.	H	α-helix	trans	-68.5	-37.9	176.6	0	0	0	0	0	113	D467 Q472 K473	D467-A469 PolarHBondContact O-N 3.41Å; A469-Q472 PolarHBondContact O-N 2.91Å; A469-K473 WeakPolarHBondContact O-CG 3.3Å; A469-K473 PolarHBondContact O-N 3.22Å
470	E	74	Confident	63.1	Low	77 Å²	77	96 Å²	96	36%	0.36	49%	0.485	S	S	.	.	H	α-helix	trans	-74.4	-35.9	-179.2	-155.5	55.6	-128.3	0	0	111.4	D467 Q472 K473 K474	D467-E470 HydrophobicContact CB-CB 4.09Å; D467-E470 PolarHBondContact O-N 3.03Å; E470-Q472 VanDerWaalsContact C-N 3.31Å; E470-Q472 PolarHBondContact O-N 3.03Å; E470-K473 WeakPolarHBondContact O-CB 3.32Å; E470-K473 PolarHBondContact O-N 3.05Å; E470-K473 WeakPolarHBondContact OE1-CD 3.16Å; E470-K473 WeakPolarHBondContact OE2-CD 3.2Å; E470-K473 IonicContact OE2-NZ 2.79Å; E470-K473 PolarHBondContact OE2-NZ 3.2Å; E470-K474 WeakPolarHBondContact O-CB 3.02Å; E470-K474 PolarHBondContact O-N 3.13Å
471	V	76.9	Confident	65.8	Low	67 Å²	67	93.2 Å²	93.2	41%	0.406	47%	0.47	S	S	.	.	H	α-helix	trans	-64.1	-38.5	170.8	178.8	0	0	0	0	111	D467 K475	D467-V471 PolarHBondContact O-N 3.39Å; V471-K475 HydrophobicContact CG1-CD 4.27Å; V471-K475 VanDerWaalsContact O-CG 3.29Å; V471-K475 WeakPolarHBondContact O-CG 3.32Å; V471-K475 PolarHBondContact O-N 3.47Å; V471-K475 VanDerWaalsContact O-N 3.09Å
472	Q	80.8	Confident	68.6	Low	47 Å²	47	88.9 Å²	88.9	22%	0.22	46%	0.455	C	S	.	.	H	α-helix	trans	-69.7	-42.7	178	-170	155	-22.6	0	0	112.2	S468 A469 E470 K474 K475 L476 D496	S468-Q472 WeakPolarHBondContact O-CB 3.33Å; S468-Q472 PolarHBondContact O-N 3.19Å; S468-Q472 VanDerWaalsContact O-N 3.1Å; A469-Q472 PolarHBondContact O-N 2.91Å; E470-Q472 VanDerWaalsContact C-N 3.31Å; E470-Q472 PolarHBondContact O-N 3.03Å; Q472-K474 PolarHBondContact O-N 3.07Å; Q472-K475 PolarHBondContact O-N 3.19Å; Q472-L476 HydrophobicContact CG-CD1 4.38Å; Q472-L476 WeakPolarHBondContact O-CG 3.43Å; Q472-L476 PolarHBondContact O-N 2.9Å; Q472-D496 PolarHBondContact NE2-OD2 3.3Å
473	K	82.5	Confident	71.2	Confident	44 Å²	44	85.5 Å²	85.5	19%	0.191	44%	0.441	C	S	.	.	H	α-helix	trans	-51.4	-54.1	169.3	-79.2	174	-167.6	171.8	0	111.9	A469 E470 K475 L476 C477 L499 L501	A469-K473 WeakPolarHBondContact O-CG 3.3Å; A469-K473 PolarHBondContact O-N 3.22Å; E470-K473 WeakPolarHBondContact O-CB 3.32Å; E470-K473 PolarHBondContact O-N 3.05Å; E470-K473 WeakPolarHBondContact OE1-CD 3.16Å; E470-K473 WeakPolarHBondContact OE2-CD 3.2Å; E470-K473 IonicContact OE2-NZ 2.79Å; E470-K473 PolarHBondContact OE2-NZ 3.2Å; K473-K475 VanDerWaalsContact C-N 3.31Å; K473-K475 PolarHBondContact O-N 3.36Å; K473-L476 PolarHBondContact O-N 2.88Å; K473-C477 WeakPolarHBondContact O-CB 3.37Å; K473-C477 PolarHBondContact O-N 3.24Å; K473-C477 PolarHBondContact O-SG 2.93Å; K473-C477 VanDerWaalsContact O-SG 3.37Å; K473-L499 HydrophobicContact CB-CD2 4.41Å; K473-L499 HydrophobicContact CD-CD2 3.86Å; K473-L499 HydrophobicContact CG-CD2 3.13Å; K473-L501 HydrophobicContact CG-CD2 4.46Å
474	K	83.4	Confident	74	Confident	143 Å²	143	79.2 Å²	79.2	62%	0.622	41%	0.413	S	S	*	.	H	α-helix	trans	-60.4	-41.9	-177.6	-166.5	171.7	-177.1	173	0	111.6	E470 Q472 C477 D478	E470-K474 WeakPolarHBondContact O-CB 3.02Å; E470-K474 PolarHBondContact O-N 3.13Å; Q472-K474 PolarHBondContact O-N 3.07Å; K474-C477 PolarHBondContact O-N 3.44Å; K474-D478 VanDerWaalsContact O-CB 3.27Å; K474-D478 WeakPolarHBondContact O-CB 3.42Å; K474-D478 PolarHBondContact O-N 2.94Å
475	K	84.9	Confident	76.5	Confident	111 Å²	111	76.2 Å²	76.2	48%	0.483	40%	0.395	S	S	.	.	H	α-helix	trans	-62.7	-42.4	175.7	-75	172.2	-178.4	173.5	0	113	V471 Q472 K473 A479 I491	V471-K475 HydrophobicContact CG1-CD 4.27Å; V471-K475 VanDerWaalsContact O-CG 3.29Å; V471-K475 WeakPolarHBondContact O-CG 3.32Å; V471-K475 PolarHBondContact O-N 3.47Å; V471-K475 VanDerWaalsContact O-N 3.09Å; Q472-K475 PolarHBondContact O-N 3.19Å; K473-K475 VanDerWaalsContact C-N 3.31Å; K473-K475 PolarHBondContact O-N 3.36Å; K475-A479 WeakPolarHBondContact O-CB 3.48Å; K475-A479 PolarHBondContact O-N 2.88Å; K475-I491 HydrophobicContact CB-CD1 4.47Å; K475-I491 HydrophobicContact CB-CG2 4.48Å
476	L	85.6	Confident	78.7	Confident	0 Å²	0	71.6 Å²	71.6	0%	0	37%	0.372	C	S	.	.	H	α-helix	trans	-66.7	-47.3	177	-72.4	168.3	0	0	0	111.2	Q472 K473 D478 A479 I480 L488 I491 L492 D496 L507	Q472-L476 HydrophobicContact CG-CD1 4.38Å; Q472-L476 WeakPolarHBondContact O-CG 3.43Å; Q472-L476 PolarHBondContact O-N 2.9Å; K473-L476 PolarHBondContact O-N 2.88Å; L476-D478 VanDerWaalsContact C-N 3.35Å; L476-D478 PolarHBondContact O-N 2.71Å; L476-A479 PolarHBondContact O-N 3.22Å; L476-I480 WeakPolarHBondContact O-CG1 3.49Å; L476-I480 PolarHBondContact O-N 3.37Å; L476-L488 HydrophobicContact CD2-CD1 3.86Å; L476-I491 HydrophobicContact CD2-CB 4.15Å; L476-I491 HydrophobicContact CD2-CG2 3.74Å; L476-I491 HydrophobicContact CG-CG2 4.06Å; L476-L492 HydrophobicContact CD1-CD1 4.45Å; L476-L492 HydrophobicContact CD2-CB 4.19Å; L476-L492 HydrophobicContact CD2-CD1 3.96Å; L476-D496 HydrophobicContact CD1-CB 4.14Å; L476-L507 HydrophobicContact CB-CD2 4.05Å; L476-L507 HydrophobicContact CD1-CD1 4.11Å
477	C	85.9	Confident	80.7	Confident	16 Å²	16	68.2 Å²	68.2	11%	0.108	36%	0.357	C	S	.	.	H	α-helix	trans	-60.4	-42.6	175.4	-70	0	0	0	0	112.1	K473 K474 A479 I480 R481 L501 F510	K473-C477 WeakPolarHBondContact O-CB 3.37Å; K473-C477 PolarHBondContact O-N 3.24Å; K473-C477 PolarHBondContact O-SG 2.93Å; K473-C477 VanDerWaalsContact O-SG 3.37Å; K474-C477 PolarHBondContact O-N 3.44Å; C477-A479 PolarHBondContact O-N 3.13Å; C477-I480 PolarHBondContact O-N 3.23Å; C477-R481 WeakPolarHBondContact O-CB 3.2Å; C477-R481 PolarHBondContact O-N 3.28Å; C477-L501 WeakPolarHBondContact SG-CD2 3.22Å; C477-F510 HydrophobicContact CB-CD1 4.4Å; C477-F510 HydrophobicContact CB-CE1 3.9Å; C477-F510 HydrophobicContact CB-CZ 4.34Å; C477-F510 WeakPolarHBondContact O-CE1 3.44Å
478	D	87.1	Confident	82.3	Confident	47 Å²	47	62.6 Å²	62.6	25%	0.251	33%	0.327	S	S	.	.	H	α-helix	trans	-61.4	-43.7	176	-74.2	-19	0	0	0	111.2	K474 L476 I480 R481 T482	K474-D478 VanDerWaalsContact O-CB 3.27Å; K474-D478 WeakPolarHBondContact O-CB 3.42Å; K474-D478 PolarHBondContact O-N 2.94Å; L476-D478 VanDerWaalsContact C-N 3.35Å; L476-D478 PolarHBondContact O-N 2.71Å; D478-I480 PolarHBondContact O-N 3.24Å; D478-R481 PolarHBondContact O-N 3.15Å; D478-R481 IonicContact OD1-CZ 2.78Å; D478-R481 IonicContact OD1-NH1 3.46Å; D478-R481 PolarHBondContact OD1-NH1 3.48Å; D478-R481 IonicContact OD1-NH2 3.07Å; D478-R481 PolarHBondContact OD1-NH2 2.92Å; D478-T482 WeakPolarHBondContact O-CG2 3.4Å; D478-T482 PolarHBondContact O-N 3.38Å; D478-T482 PolarHBondContact O-OG1 3.22Å
479	A	87.1	Confident	83.3	Confident	1 Å²	1	63 Å²	63	1%	0.008	32%	0.319	C	S	.	.	H	α-helix	trans	-63.2	-39.9	178.4	0	0	0	0	0	112.8	K475 L476 C477 T482 K483 D484 K487 L488	K475-A479 WeakPolarHBondContact O-CB 3.48Å; K475-A479 PolarHBondContact O-N 2.88Å; L476-A479 PolarHBondContact O-N 3.22Å; C477-A479 PolarHBondContact O-N 3.13Å; A479-T482 PolarHBondContact O-OG1 2.93Å; A479-K483 PolarHBondContact O-N 3.17Å; A479-D484 PolarHBondContact O-N 2.93Å; A479-K487 HydrophobicContact CB-CB 4.48Å; A479-K487 HydrophobicContact CB-CG 4.33Å; A479-L488 HydrophobicContact CB-CB 4.22Å; A479-L488 HydrophobicContact CB-CD1 4.44Å
480	I	87.9	Confident	84.2	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.005	34%	0.335	C	S	.	.	H	α-helix	trans	-66	-41.7	174.5	-63.4	170.9	0	0	0	110.4	L476 C477 D478 K483 L488 L507 F510 A511 L514 N516 A519 L523	L476-I480 WeakPolarHBondContact O-CG1 3.49Å; L476-I480 PolarHBondContact O-N 3.37Å; C477-I480 PolarHBondContact O-N 3.23Å; D478-I480 PolarHBondContact O-N 3.24Å; I480-K483 PolarHBondContact O-N 2.99Å; I480-L488 HydrophobicContact CD1-CD1 4.42Å; I480-L488 HydrophobicContact CG1-CD1 3.95Å; I480-L488 HydrophobicContact CG1-CD2 4.08Å; I480-L507 HydrophobicContact CD1-CB 4.34Å; I480-L507 HydrophobicContact CD1-CD2 4.01Å; I480-F510 HydrophobicContact CB-CD1 4.2Å; I480-F510 HydrophobicContact CB-CE1 4.37Å; I480-F510 HydrophobicContact CD1-CD1 4.4Å; I480-F510 HydrophobicContact CG2-CD1 4.01Å; I480-F510 HydrophobicContact CG2-CE1 4.39Å; I480-A511 HydrophobicContact CG2-CB 3.89Å; I480-L514 HydrophobicContact CG2-CD1 3.91Å; I480-N516 PolarHBondContact O-ND2 3.2Å; I480-A519 HydrophobicContact CG1-CB 4.4Å; I480-A519 HydrophobicContact CG2-CB 4.3Å; I480-L523 HydrophobicContact CD1-CD1 4.39Å
481	R	88.6	Confident	84.7	Confident	133 Å²	133	67.2 Å²	67.2	50%	0.502	33%	0.328	S	S	.	.	H	α-helix	trans	-63.7	-42.1	179	-163.6	-171.4	-45.3	125.1	15.9	112.7	C477 D478 K483 L514	C477-R481 WeakPolarHBondContact O-CB 3.2Å; C477-R481 PolarHBondContact O-N 3.28Å; D478-R481 PolarHBondContact O-N 3.15Å; D478-R481 IonicContact OD1-CZ 2.78Å; D478-R481 IonicContact OD1-NH1 3.46Å; D478-R481 PolarHBondContact OD1-NH1 3.48Å; D478-R481 IonicContact OD1-NH2 3.07Å; D478-R481 PolarHBondContact OD1-NH2 2.92Å; R481-K483 PolarHBondContact O-N 2.88Å; R481-L514 HydrophobicContact CB-CD1 4.23Å; R481-L514 HydrophobicContact CG-CD1 4.46Å
482	T	87.8	Confident	85.1	Confident	91 Å²	91	65 Å²	65	56%	0.558	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	0.7	177.8	61.7	0	0	0	0	113.5	D478 A479 D484	D478-T482 WeakPolarHBondContact O-CG2 3.4Å; D478-T482 PolarHBondContact O-N 3.38Å; D478-T482 PolarHBondContact O-OG1 3.22Å; A479-T482 PolarHBondContact O-OG1 2.93Å; T482-D484 PolarHBondContact O-N 2.92Å; T482-D484 VanDerWaalsContact O-N 3.16Å
483	K	85.7	Confident	85.2	Confident	128 Å²	128	67 Å²	67	56%	0.557	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	27.6	-173.8	-55.7	-172.1	176.2	-173.5	0	113.6	A479 I480 R481 T485	A479-K483 PolarHBondContact O-N 3.17Å; I480-K483 PolarHBondContact O-N 2.99Å; R481-K483 PolarHBondContact O-N 2.88Å; K483-T485 PolarHBondContact O-N 3.21Å
484	D	86.6	Confident	84.9	Confident	65 Å²	65	70.6 Å²	70.6	35%	0.348	35%	0.351	S	S	.	.			trans	-88.6	85.7	179.3	-174	-11.1	0	0	0	109.7	A479 T482 A486 K487 L488	A479-D484 PolarHBondContact O-N 2.93Å; T482-D484 PolarHBondContact O-N 2.92Å; T482-D484 VanDerWaalsContact O-N 3.16Å; D484-A486 VanDerWaalsContact C-N 3.3Å; D484-A486 PolarHBondContact O-N 3.29Å; D484-A486 PolarHBondContact OD1-N 3.14Å; D484-K487 HydrophobicContact CB-CB 4.05Å; D484-K487 PolarHBondContact O-N 3.24Å; D484-K487 WeakPolarHBondContact OD1-CB 3.21Å; D484-K487 PolarHBondContact OD1-N 2.93Å; D484-K487 VanDerWaalsContact OD2-CB 3.28Å; D484-K487 WeakPolarHBondContact OD2-CB 3.3Å; D484-L488 PolarHBondContact O-N 3.25Å
485	T	82.6	Confident	84.6	Confident	43 Å²	43	70.9 Å²	70.9	26%	0.264	35%	0.354	S	S	.	.	H	α-helix	trans	-65.3	-33.9	-178.1	55.6	0	0	0	0	112	K483 K487 L488 M489 E518	K483-T485 PolarHBondContact O-N 3.21Å; T485-K487 VanDerWaalsContact C-N 3.34Å; T485-K487 PolarHBondContact O-N 2.85Å; T485-L488 WeakPolarHBondContact O-CB 3.39Å; T485-L488 PolarHBondContact O-N 2.79Å; T485-M489 WeakPolarHBondContact O-CG 3.45Å; T485-M489 PolarHBondContact O-N 3.01Å; T485-E518 HydrophobicContact CG2-CB 3.58Å
486	A	83.8	Confident	84.5	Confident	53 Å²	53	66.4 Å²	66.4	44%	0.438	34%	0.336	S	S	.	.	H	α-helix	trans	-65.9	-38.5	178.5	0	0	0	0	0	111.7	D484 K490	D484-A486 VanDerWaalsContact C-N 3.3Å; D484-A486 PolarHBondContact O-N 3.29Å; D484-A486 PolarHBondContact OD1-N 3.14Å; A486-K490 WeakPolarHBondContact O-CG 3.48Å; A486-K490 PolarHBondContact O-N 3.35Å
487	K	84.3	Confident	84.3	Confident	95 Å²	95	66.7 Å²	66.7	41%	0.413	34%	0.337	S	S	.	.	H	α-helix	trans	-69.8	-39.5	172.9	-172.5	174.8	-179.3	-176	0	111.7	A479 D484 T485 K490 I491	A479-K487 HydrophobicContact CB-CB 4.48Å; A479-K487 HydrophobicContact CB-CG 4.33Å; D484-K487 HydrophobicContact CB-CB 4.05Å; D484-K487 PolarHBondContact O-N 3.24Å; D484-K487 WeakPolarHBondContact OD1-CB 3.21Å; D484-K487 PolarHBondContact OD1-N 2.93Å; D484-K487 VanDerWaalsContact OD2-CB 3.28Å; D484-K487 WeakPolarHBondContact OD2-CB 3.3Å; T485-K487 VanDerWaalsContact C-N 3.34Å; T485-K487 PolarHBondContact O-N 2.85Å; K487-K490 PolarHBondContact O-N 3.34Å; K487-I491 HydrophobicContact CD-CD1 4.43Å; K487-I491 HydrophobicContact CG-CD1 3.6Å; K487-I491 VanDerWaalsContact O-CG1 3.27Å; K487-I491 WeakPolarHBondContact O-CG1 3.34Å; K487-I491 PolarHBondContact O-N 3.31Å
488	L	85.4	Confident	84.2	Confident	1 Å²	1	69 Å²	69	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-59.7	-45.8	173.8	-175.1	64.1	0	0	0	111.7	L476 A479 I480 D484 T485 K490 I491 L492 A519 F522	L476-L488 HydrophobicContact CD2-CD1 3.86Å; A479-L488 HydrophobicContact CB-CB 4.22Å; A479-L488 HydrophobicContact CB-CD1 4.44Å; I480-L488 HydrophobicContact CD1-CD1 4.42Å; I480-L488 HydrophobicContact CG1-CD1 3.95Å; I480-L488 HydrophobicContact CG1-CD2 4.08Å; D484-L488 PolarHBondContact O-N 3.25Å; T485-L488 WeakPolarHBondContact O-CB 3.39Å; T485-L488 PolarHBondContact O-N 2.79Å; L488-K490 PolarHBondContact O-N 2.86Å; L488-I491 PolarHBondContact O-N 2.83Å; L488-L492 VanDerWaalsContact O-CB 3.28Å; L488-L492 WeakPolarHBondContact O-CB 3.46Å; L488-L492 PolarHBondContact O-N 2.89Å; L488-A519 HydrophobicContact CD2-CB 3.85Å; L488-F522 HydrophobicContact CD2-CD1 4.09Å; L488-F522 HydrophobicContact CG-CD1 4.17Å; L488-F522 HydrophobicContact CG-CE1 4.48Å
489	M	82.9	Confident	84	Confident	103 Å²	103	68.4 Å²	68.4	51%	0.507	35%	0.345	S	S	.	.	H	α-helix	trans	-60	-31.9	178.1	-69.7	-178.9	-166.7	0	0	113.5	T485 F522	T485-M489 WeakPolarHBondContact O-CG 3.45Å; T485-M489 PolarHBondContact O-N 3.01Å; M489-F522 HydrophobicContact CB-CE1 4.32Å; M489-F522 HydrophobicContact CB-CE2 4.33Å; M489-F522 HydrophobicContact CB-CZ 3.92Å; M489-F522 HydrophobicContact CE-CD2 3.99Å; M489-F522 HydrophobicContact CE-CE2 4.32Å; M489-F522 HydrophobicContact CG-CD1 4.29Å; M489-F522 HydrophobicContact CG-CD2 3.89Å; M489-F522 HydrophobicContact CG-CE1 3.9Å; M489-F522 HydrophobicContact CG-CE2 3.49Å; M489-F522 VanDerWaalsContact CG-CE2 3.49Å; M489-F522 HydrophobicContact CG-CG 4.29Å; M489-F522 HydrophobicContact CG-CZ 3.49Å; M489-F522 VanDerWaalsContact CG-CZ 3.49Å; M489-F522 HydrophobicContact SD-CE2 4.26Å
490	K	84.1	Confident	83.7	Confident	181 Å²	181	72.3 Å²	72.3	79%	0.787	37%	0.37	S	S	*	.	H	α-helix	trans	-81.6	-28.3	-179.5	-74	178	-178.3	179.1	0	113.4	A486 K487 L488	A486-K490 WeakPolarHBondContact O-CG 3.48Å; A486-K490 PolarHBondContact O-N 3.35Å; K487-K490 PolarHBondContact O-N 3.34Å; L488-K490 PolarHBondContact O-N 2.86Å
491	I	85.5	Confident	83.5	Confident	42 Å²	42	73.2 Å²	73.2	22%	0.215	38%	0.375	C	S	.	.	H	α-helix	trans	-97.6	-32.4	-172	-61.1	172.1	0	0	0	111.3	K475 L476 K487 L488 Q493	K475-I491 HydrophobicContact CB-CD1 4.47Å; K475-I491 HydrophobicContact CB-CG2 4.48Å; L476-I491 HydrophobicContact CD2-CB 4.15Å; L476-I491 HydrophobicContact CD2-CG2 3.74Å; L476-I491 HydrophobicContact CG-CG2 4.06Å; K487-I491 HydrophobicContact CD-CD1 4.43Å; K487-I491 HydrophobicContact CG-CD1 3.6Å; K487-I491 VanDerWaalsContact O-CG1 3.27Å; K487-I491 WeakPolarHBondContact O-CG1 3.34Å; K487-I491 PolarHBondContact O-N 3.31Å; L488-I491 PolarHBondContact O-N 2.83Å; I491-Q493 PolarHBondContact O-N 2.82Å
492	L	85	Confident	82.8	Confident	20 Å²	20	75 Å²	75	11%	0.105	39%	0.39	C	S	.	.			trans	-66.7	118.9	-175.8	-170.9	71.8	0	0	0	111.3	L476 L488 V497 L507 F522 L523 N526	L476-L492 HydrophobicContact CD1-CD1 4.45Å; L476-L492 HydrophobicContact CD2-CB 4.19Å; L476-L492 HydrophobicContact CD2-CD1 3.96Å; L488-L492 VanDerWaalsContact O-CB 3.28Å; L488-L492 WeakPolarHBondContact O-CB 3.46Å; L488-L492 PolarHBondContact O-N 2.89Å; L492-V497 HydrophobicContact CD1-CG2 4.28Å; L492-V497 HydrophobicContact CD2-CG2 4.18Å; L492-V497 HydrophobicContact CG-CG2 4.2Å; L492-L507 HydrophobicContact CD1-CD1 3.98Å; L492-F522 HydrophobicContact CB-CE1 4.27Å; L492-F522 HydrophobicContact CD2-CD1 4.01Å; L492-F522 HydrophobicContact CD2-CE1 3.53Å; L492-F522 HydrophobicContact CD2-CZ 4.46Å; L492-L523 HydrophobicContact CD1-CD2 4.17Å; L492-L523 HydrophobicContact CD2-CD2 3.87Å; L492-N526 HydrophobicContact CD2-CB 4.33Å
493	Q	81.9	Confident	81.8	Confident	90 Å²	90	72.8 Å²	72.8	42%	0.421	38%	0.384	S	S	.	.			trans	-99.6	152.7	169.8	-55.9	-159.4	-34.2	0	0	110.6	I491 Q495 D496	I491-Q493 PolarHBondContact O-N 2.82Å; Q493-Q495 HydrophobicContact CB-CG 4.19Å; Q493-Q495 PolarHBondContact O-N 2.81Å; Q493-Q495 VanDerWaalsContact O-N 3.1Å; Q493-D496 WeakPolarHBondContact CB-OD2 3.41Å; Q493-D496 PolarHBondContact O-N 2.87Å
494	P	77.1	Confident	81.5	Confident	118 Å²	118	67.9 Å²	67.9	77%	0.766	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-56.4	-29.8	-178.7	-26.5	34.7	0	0	0	114.5	D496	P494-D496 VanDerWaalsContact C-N 3.35Å
495	Q	76.8	Confident	81.4	Confident	149 Å²	149	66 Å²	66	70%	0.696	36%	0.36	S	S	*	.	G	3₁₀ helix	trans	-76.6	-17.1	179.3	66.7	-152.2	36.6	0	0	114.3	Q493	Q493-Q495 HydrophobicContact CB-CG 4.19Å; Q493-Q495 PolarHBondContact O-N 2.81Å; Q493-Q495 VanDerWaalsContact O-N 3.1Å
496	D	82.2	Confident	81.7	Confident	17 Å²	17	64.2 Å²	64.2	9%	0.091	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-102.9	-0	-175.6	-52.3	-45.2	0	0	0	113.3	Q472 L476 Q493 P494 D498 L499 L507	Q472-D496 PolarHBondContact NE2-OD2 3.3Å; L476-D496 HydrophobicContact CD1-CB 4.14Å; Q493-D496 WeakPolarHBondContact CB-OD2 3.41Å; Q493-D496 PolarHBondContact O-N 2.87Å; P494-D496 VanDerWaalsContact C-N 3.35Å; D496-D498 VanDerWaalsContact C-N 3.31Å; D496-D498 PolarHBondContact O-N 3.08Å; D496-L499 HydrophobicContact CB-CB 4.45Å; D496-L499 HydrophobicContact CB-CD1 4.46Å; D496-L499 WeakPolarHBondContact O-CB 3.4Å; D496-L499 PolarHBondContact O-N 3.46Å; D496-L507 WeakPolarHBondContact O-CD1 3.34Å
497	V	82.8	Confident	82	Confident	6 Å²	6	61.7 Å²	61.7	4%	0.036	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-39.8	-173.7	-178.5	0	0	0	0	111.8	L492 N526 A528	L492-V497 HydrophobicContact CD1-CG2 4.28Å; L492-V497 HydrophobicContact CD2-CG2 4.18Å; L492-V497 HydrophobicContact CG-CG2 4.2Å; V497-N526 HydrophobicContact CG2-CB 4.17Å; V497-A528 VanDerWaalsContact CG1-CA 3.45Å; V497-A528 HydrophobicContact CG1-CB 3.41Å; V497-A528 VanDerWaalsContact CG1-CB 3.41Å
498	D	84.1	Confident	82.3	Confident	65 Å²	65	57.1 Å²	57.1	35%	0.348	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	22.2	179.8	-75	-20.3	0	0	0	112.4	D496 N529 L532	D496-D498 VanDerWaalsContact C-N 3.31Å; D496-D498 PolarHBondContact O-N 3.08Å; D498-N529 PolarHBondContact OD1-N 3.39Å; D498-N529 WeakPolarHBondContact OD2-CB 3.24Å; D498-L532 HydrophobicContact CB-CD1 3.58Å; D498-L532 WeakPolarHBondContact OD1-CD1 3.45Å
499	L	82	Confident	82.5	Confident	35 Å²	35	57.1 Å²	57.1	18%	0.183	31%	0.308	C	S	.	.			trans	-66.9	128.8	-175.1	-164.6	105.3	0	0	0	111.3	K473 D496	K473-L499 HydrophobicContact CB-CD2 4.41Å; K473-L499 HydrophobicContact CD-CD2 3.86Å; K473-L499 HydrophobicContact CG-CD2 3.13Å; D496-L499 HydrophobicContact CB-CB 4.45Å; D496-L499 HydrophobicContact CB-CD1 4.46Å; D496-L499 WeakPolarHBondContact O-CB 3.4Å; D496-L499 PolarHBondContact O-N 3.46Å
500	P	81.7	Confident	82.9	Confident	82 Å²	82	54.1 Å²	54.1	53%	0.532	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-74	130	176	28.9	-33.6	0	0	0	110.8
501	L	83.4	Confident	83.2	Confident	21 Å²	21	45.5 Å²	45.5	11%	0.11	26%	0.255	C	S	.	.			trans	-87.3	175.7	173.4	-57.3	176.9	0	0	0	110.9	K473 C477 G503 G504 D505 L507 F510	K473-L501 HydrophobicContact CG-CD2 4.46Å; C477-L501 WeakPolarHBondContact SG-CD2 3.22Å; L501-G503 PolarHBondContact O-N 3.44Å; L501-G504 PolarHBondContact O-N 3.16Å; L501-D505 WeakPolarHBondContact CB-O 3.49Å; L501-D505 WeakPolarHBondContact CG-O 3.24Å; L501-D505 PolarHBondContact N-O 3.39Å; L501-L507 HydrophobicContact CD1-CD2 4.37Å; L501-L507 HydrophobicContact CD2-CD2 4.04Å; L501-F510 HydrophobicContact CD1-CB 3.64Å; L501-F510 HydrophobicContact CD1-CD2 4.34Å; L501-F510 HydrophobicContact CD1-CG 3.98Å
502	E	73.8	Confident	83.5	Confident	171 Å²	171	43.5 Å²	43.5	80%	0.799	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	126.9	170.4	-68	-173.6	161.8	0	0	110
503	G	66.1	Low	83.7	Confident	43 Å²	43	46.4 Å²	46.4	44%	0.443	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.1	10.1	-171.9	0	0	0	0	0	114.8	L501 D505 I535	L501-G503 PolarHBondContact O-N 3.44Å; G503-D505 PolarHBondContact O-N 2.95Å; G503-I535 VanDerWaalsContact O-CD1 3.32Å; G503-I535 WeakPolarHBondContact O-CD1 3.29Å; G503-I535 WeakPolarHBondContact O-CG1 3.29Å; G503-I535 WeakPolarHBondContact O-CG2 3.46Å
504	G	79.5	Confident	84	Confident	25 Å²	25	45.2 Å²	45.2	26%	0.258	26%	0.255	S	S	.	.	S	Bend	trans	70.2	9.7	172.4	0	0	0	0	0	116	L501 N534	L501-G504 PolarHBondContact O-N 3.16Å; G504-N534 WeakPolarHBondContact O-CA 3.24Å
505	D	84.7	Confident	84.6	Confident	25 Å²	25	40.7 Å²	40.7	13%	0.134	23%	0.23	C	C	.	.			trans	-68	139.2	168.4	-79.4	-23.9	0	0	0	110.3	L501 G503 H509 M513 N534	L501-D505 WeakPolarHBondContact CB-O 3.49Å; L501-D505 WeakPolarHBondContact CG-O 3.24Å; L501-D505 PolarHBondContact N-O 3.39Å; G503-D505 PolarHBondContact O-N 2.95Å; D505-H509 HydrophobicContact CB-CB 3.86Å; D505-M513 WeakPolarHBondContact OD2-CE 3.48Å; D505-N534 WeakPolarHBondContact OD1-CB 3.35Å; D505-N534 PolarHBondContact OD1-ND2 2.67Å
506	S	89.6	Confident	85.2	Confident	6 Å²	6	33.9 Å²	33.9	4%	0.042	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-80.4	165.9	169.1	75.2	0	0	0	0	111.6	L508 H509 F510	S506-L508 PolarHBondContact O-N 3.48Å; S506-L508 VanDerWaalsContact O-N 3.09Å; S506-L508 PolarHBondContact OG-N 3.29Å; S506-H509 PolarHBondContact N-ND1 3.14Å; S506-H509 VanDerWaalsContact N-ND1 3.14Å; S506-H509 WeakPolarHBondContact O-CB 3.47Å; S506-H509 PolarHBondContact O-N 3.4Å; S506-H509 PolarHBondContact OG-ND1 3.18Å; S506-F510 PolarHBondContact O-N 3.48Å; S506-F510 VanDerWaalsContact O-N 3.08Å
507	L	88.8	Confident	85.6	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-52.5	-32.8	172.2	-69.6	174.5	0	0	0	112.7	L476 I480 L492 D496 L501 F510 A511 L523	L476-L507 HydrophobicContact CB-CD2 4.05Å; L476-L507 HydrophobicContact CD1-CD1 4.11Å; I480-L507 HydrophobicContact CD1-CB 4.34Å; I480-L507 HydrophobicContact CD1-CD2 4.01Å; L492-L507 HydrophobicContact CD1-CD1 3.98Å; D496-L507 WeakPolarHBondContact O-CD1 3.34Å; L501-L507 HydrophobicContact CD1-CD2 4.37Å; L501-L507 HydrophobicContact CD2-CD2 4.04Å; L507-F510 PolarHBondContact O-N 2.79Å; L507-A511 WeakPolarHBondContact O-CB 3.37Å; L507-A511 PolarHBondContact O-N 2.62Å; L507-L523 HydrophobicContact CB-CD1 4.15Å; L507-L523 HydrophobicContact CB-CD2 4.24Å; L507-L523 HydrophobicContact CD1-CD2 4.4Å
508	L	90.4	Very high	86	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-68.6	-41	176.9	-170.1	61.4	0	0	0	112.1	S506 F510 A511 I512 V520 L523 L524 A528 P530 P540 L556	S506-L508 PolarHBondContact O-N 3.48Å; S506-L508 VanDerWaalsContact O-N 3.09Å; S506-L508 PolarHBondContact OG-N 3.29Å; L508-F510 VanDerWaalsContact C-N 3.34Å; L508-A511 PolarHBondContact O-N 2.92Å; L508-I512 HydrophobicContact CG-CD1 4.26Å; L508-I512 WeakPolarHBondContact O-CD1 3.46Å; L508-I512 VanDerWaalsContact O-CG1 3.3Å; L508-I512 WeakPolarHBondContact O-CG1 3.46Å; L508-I512 PolarHBondContact O-N 2.91Å; L508-I512 VanDerWaalsContact O-N 3.14Å; L508-V520 HydrophobicContact CD1-CB 4.42Å; L508-V520 HydrophobicContact CD1-CG1 3.96Å; L508-V520 HydrophobicContact CD1-CG2 4.33Å; L508-L523 HydrophobicContact CD1-CB 4.26Å; L508-L523 HydrophobicContact CD1-CD1 4.41Å; L508-L524 HydrophobicContact CD1-CD2 4.31Å; L508-L524 HydrophobicContact CD1-CG 4.17Å; L508-L524 HydrophobicContact CD2-CD2 3.87Å; L508-A528 HydrophobicContact CD2-CB 4.45Å; L508-P530 HydrophobicContact CD2-CB 4.3Å; L508-P540 HydrophobicContact CB-CG 4.38Å; L508-P540 HydrophobicContact CD2-CB 4.03Å; L508-P540 HydrophobicContact CD2-CG 3.79Å; L508-P540 HydrophobicContact CG-CB 4.1Å; L508-P540 HydrophobicContact CG-CG 4.04Å; L508-L556 HydrophobicContact CD2-CD2 4.19Å
509	H	90.8	Very high	86.2	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-60.7	-44.9	173	-67.2	87.4	0	0	0	111	D505 S506 I512 M513 L532 S538 P540 L543	D505-H509 HydrophobicContact CB-CB 3.86Å; S506-H509 PolarHBondContact N-ND1 3.14Å; S506-H509 VanDerWaalsContact N-ND1 3.14Å; S506-H509 WeakPolarHBondContact O-CB 3.47Å; S506-H509 PolarHBondContact O-N 3.4Å; S506-H509 PolarHBondContact OG-ND1 3.18Å; H509-I512 PolarHBondContact O-N 3.36Å; H509-M513 WeakPolarHBondContact O-CB 3.16Å; H509-M513 PolarHBondContact O-N 3.11Å; H509-L532 PolarHBondContact CE1-O 3.3Å; H509-L532 PolarHBondContact NE2-O 2.96Å; H509-S538 PolarHBondContact NE2-O 3.42Å; H509-P540 VanDerWaalsContact CE1-CD 3.49Å; H509-P540 WeakPolarHBondContact CE1-CD 3.32Å; H509-P540 VanDerWaalsContact NE2-CD 3.28Å; H509-P540 WeakPolarHBondContact NE2-CD 3.36Å; H509-L543 HydrophobicContact CB-CD1 3.61Å; H509-L543 VanDerWaalsContact CD2-CD1 3.42Å; H509-L543 WeakPolarHBondContact CD2-CD1 3.44Å
510	F	90.1	Very high	86.6	Confident	39 Å²	39	36.4 Å²	36.4	17%	0.171	21%	0.206	C	C	.	.	H	α-helix	trans	-64.5	-41.2	179.9	-169	-109.2	0	0	0	112.4	C477 I480 L501 S506 L507 L508 I512 M513 L514	C477-F510 HydrophobicContact CB-CD1 4.4Å; C477-F510 HydrophobicContact CB-CE1 3.9Å; C477-F510 HydrophobicContact CB-CZ 4.34Å; C477-F510 WeakPolarHBondContact O-CE1 3.44Å; I480-F510 HydrophobicContact CB-CD1 4.2Å; I480-F510 HydrophobicContact CB-CE1 4.37Å; I480-F510 HydrophobicContact CD1-CD1 4.4Å; I480-F510 HydrophobicContact CG2-CD1 4.01Å; I480-F510 HydrophobicContact CG2-CE1 4.39Å; L501-F510 HydrophobicContact CD1-CB 3.64Å; L501-F510 HydrophobicContact CD1-CD2 4.34Å; L501-F510 HydrophobicContact CD1-CG 3.98Å; S506-F510 PolarHBondContact O-N 3.48Å; S506-F510 VanDerWaalsContact O-N 3.08Å; L507-F510 PolarHBondContact O-N 2.79Å; L508-F510 VanDerWaalsContact C-N 3.34Å; F510-I512 VanDerWaalsContact C-N 3.33Å; F510-I512 PolarHBondContact O-N 2.93Å; F510-M513 PolarHBondContact O-N 3.31Å; F510-L514 HydrophobicContact CD1-CD1 3.78Å; F510-L514 HydrophobicContact CE1-CD1 3.34Å; F510-L514 HydrophobicContact CE1-CG 4.44Å; F510-L514 HydrophobicContact CE2-CD1 4.3Å; F510-L514 HydrophobicContact CG-CD1 4.42Å; F510-L514 HydrophobicContact CZ-CD1 3.64Å; F510-L514 HydrophobicContact CZ-CG 4.42Å; F510-L514 WeakPolarHBondContact O-CG 2.98Å; F510-L514 PolarHBondContact O-N 3.32Å; F510-L514 VanDerWaalsContact O-N 3.14Å
511	A	90.9	Very high	87	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-63.2	-37.8	176.1	0	0	0	0	0	112.7	I480 L507 L508 G515 N516 A519 V520 L523	I480-A511 HydrophobicContact CG2-CB 3.89Å; L507-A511 WeakPolarHBondContact O-CB 3.37Å; L507-A511 PolarHBondContact O-N 2.62Å; L508-A511 PolarHBondContact O-N 2.92Å; A511-G515 PolarHBondContact O-N 3.47Å; A511-N516 PolarHBondContact O-N 3.23Å; A511-A519 HydrophobicContact CB-CB 4.16Å; A511-V520 HydrophobicContact CB-CG2 3.67Å; A511-L523 HydrophobicContact CB-CD1 4Å
512	I	91.1	Very high	87.2	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-71	-44	175.4	-67.4	161.1	0	0	0	111	L508 H509 F510 L514 G515 V520 P540 L543 A544 Q549 L556	L508-I512 HydrophobicContact CG-CD1 4.26Å; L508-I512 WeakPolarHBondContact O-CD1 3.46Å; L508-I512 VanDerWaalsContact O-CG1 3.3Å; L508-I512 WeakPolarHBondContact O-CG1 3.46Å; L508-I512 PolarHBondContact O-N 2.91Å; L508-I512 VanDerWaalsContact O-N 3.14Å; H509-I512 PolarHBondContact O-N 3.36Å; F510-I512 VanDerWaalsContact C-N 3.33Å; F510-I512 PolarHBondContact O-N 2.93Å; I512-L514 PolarHBondContact O-N 3.01Å; I512-L514 VanDerWaalsContact O-N 3.14Å; I512-G515 PolarHBondContact O-N 3.39Å; I512-V520 HydrophobicContact CG1-CG2 3.78Å; I512-P540 HydrophobicContact CD1-CB 3.45Å; I512-P540 VanDerWaalsContact CD1-CB 3.45Å; I512-P540 WeakPolarHBondContact CD1-O 3.46Å; I512-L543 HydrophobicContact CG2-CB 4.16Å; I512-A544 HydrophobicContact CG2-CB 3.89Å; I512-Q549 PolarHBondContact O-NE2 3.48Å; I512-Q549 VanDerWaalsContact O-NE2 3.13Å; I512-Q549 PolarHBondContact O-OE1 2.75Å; I512-L556 HydrophobicContact CD1-CD1 3.69Å; I512-L556 HydrophobicContact CD1-CD2 4.35Å
513	M	89.5	Confident	87.9	Confident	81 Å²	81	28.7 Å²	28.7	40%	0.399	16%	0.161	S	C	.	.	H	α-helix	trans	-53.7	-37.5	176.7	-172.8	-175.7	-62.2	0	0	111.8	D505 H509 F510	D505-M513 WeakPolarHBondContact OD2-CE 3.48Å; H509-M513 WeakPolarHBondContact O-CB 3.16Å; H509-M513 PolarHBondContact O-N 3.11Å; F510-M513 PolarHBondContact O-N 3.31Å
514	L	88.8	Confident	89	Confident	66 Å²	66	26.9 Å²	26.9	35%	0.346	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-4.8	177.9	-64.9	172.2	0	0	0	114.5	I480 R481 F510 I512 N516	I480-L514 HydrophobicContact CG2-CD1 3.91Å; R481-L514 HydrophobicContact CB-CD1 4.23Å; R481-L514 HydrophobicContact CG-CD1 4.46Å; F510-L514 HydrophobicContact CD1-CD1 3.78Å; F510-L514 HydrophobicContact CE1-CD1 3.34Å; F510-L514 HydrophobicContact CE1-CG 4.44Å; F510-L514 HydrophobicContact CE2-CD1 4.3Å; F510-L514 HydrophobicContact CG-CD1 4.42Å; F510-L514 HydrophobicContact CZ-CD1 3.64Å; F510-L514 HydrophobicContact CZ-CG 4.42Å; F510-L514 WeakPolarHBondContact O-CG 2.98Å; F510-L514 PolarHBondContact O-N 3.32Å; F510-L514 VanDerWaalsContact O-N 3.14Å; I512-L514 PolarHBondContact O-N 3.01Å; I512-L514 VanDerWaalsContact O-N 3.14Å; L514-N516 VanDerWaalsContact C-N 3.34Å; L514-N516 PolarHBondContact O-N 2.96Å
515	G	89.1	Confident	89.5	Confident	22 Å²	22	31.4 Å²	31.4	23%	0.227	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.7	34.2	-177.6	0	0	0	0	0	113.5	A511 I512 E517	A511-G515 PolarHBondContact O-N 3.47Å; I512-G515 PolarHBondContact O-N 3.39Å; G515-E517 PolarHBondContact O-N 3.45Å
516	N	90.1	Very high	89.6	Confident	6 Å²	6	33.1 Å²	33.1	3%	0.032	17%	0.167	C	C	.	.			trans	-93.9	89.3	-177.9	-173	-10.7	0	0	0	111.6	I480 A511 L514 E518 A519 V520	I480-N516 PolarHBondContact O-ND2 3.2Å; A511-N516 PolarHBondContact O-N 3.23Å; L514-N516 VanDerWaalsContact C-N 3.34Å; L514-N516 PolarHBondContact O-N 2.96Å; N516-E518 PolarHBondContact O-N 2.83Å; N516-E518 PolarHBondContact OD1-N 3.5Å; N516-A519 HydrophobicContact CB-CB 4.05Å; N516-A519 VanDerWaalsContact CG-CB 3.41Å; N516-A519 WeakPolarHBondContact ND2-CB 3.27Å; N516-A519 PolarHBondContact O-N 3.44Å; N516-A519 PolarHBondContact OD1-N 2.93Å; N516-A519 VanDerWaalsContact OD1-N 3.17Å; N516-V520 WeakPolarHBondContact O-CG2 3.45Å; N516-V520 PolarHBondContact O-N 3.48Å; N516-V520 VanDerWaalsContact O-N 3.07Å
517	E	91.4	Very high	89.4	Confident	78 Å²	78	37.9 Å²	37.9	36%	0.364	19%	0.192	S	C	.	.	H	α-helix	trans	-58	-42.2	-177.3	-59.1	-176.8	-172.3	0	0	114.4	G515 V520 K521 L552	G515-E517 PolarHBondContact O-N 3.45Å; E517-V520 PolarHBondContact O-N 3.37Å; E517-K521 WeakPolarHBondContact O-CG 3.4Å; E517-K521 PolarHBondContact O-N 3.18Å; E517-L552 HydrophobicContact CB-CD2 4.13Å; E517-L552 HydrophobicContact CG-CD2 3.77Å; E517-L552 HydrophobicContact CG-CG 4.15Å
518	E	89.3	Confident	89.3	Confident	99 Å²	99	38.1 Å²	38.1	46%	0.463	19%	0.194	S	C	.	.	H	α-helix	trans	-72.4	-36.7	-177.1	-64.2	-57.7	130.6	0	0	111.8	T485 N516 K521 F522	T485-E518 HydrophobicContact CG2-CB 3.58Å; N516-E518 PolarHBondContact O-N 2.83Å; N516-E518 PolarHBondContact OD1-N 3.5Å; E518-K521 PolarHBondContact O-N 3.09Å; E518-K521 IonicContact OE1-NZ 2.79Å; E518-K521 PolarHBondContact OE1-NZ 2.86Å; E518-F522 WeakPolarHBondContact O-CB 3.43Å; E518-F522 PolarHBondContact O-N 2.98Å
519	A	88.9	Confident	89.2	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.4	-41	171.8	0	0	0	0	0	111.5	I480 L488 A511 N516 F522 L523	I480-A519 HydrophobicContact CG1-CB 4.4Å; I480-A519 HydrophobicContact CG2-CB 4.3Å; L488-A519 HydrophobicContact CD2-CB 3.85Å; A511-A519 HydrophobicContact CB-CB 4.16Å; N516-A519 HydrophobicContact CB-CB 4.05Å; N516-A519 VanDerWaalsContact CG-CB 3.41Å; N516-A519 WeakPolarHBondContact ND2-CB 3.27Å; N516-A519 PolarHBondContact O-N 3.44Å; N516-A519 PolarHBondContact OD1-N 2.93Å; N516-A519 VanDerWaalsContact OD1-N 3.17Å; A519-F522 PolarHBondContact O-N 3.28Å; A519-L523 WeakPolarHBondContact O-CB 3.33Å; A519-L523 WeakPolarHBondContact O-CG 3.33Å; A519-L523 PolarHBondContact O-N 3.28Å
520	V	90.5	Very high	89.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.8	-46.6	175.9	172	0	0	0	0	111.1	L508 A511 I512 N516 E517 F522 L523 L524 L552 L555	L508-V520 HydrophobicContact CD1-CB 4.42Å; L508-V520 HydrophobicContact CD1-CG1 3.96Å; L508-V520 HydrophobicContact CD1-CG2 4.33Å; A511-V520 HydrophobicContact CB-CG2 3.67Å; I512-V520 HydrophobicContact CG1-CG2 3.78Å; N516-V520 WeakPolarHBondContact O-CG2 3.45Å; N516-V520 PolarHBondContact O-N 3.48Å; N516-V520 VanDerWaalsContact O-N 3.07Å; E517-V520 PolarHBondContact O-N 3.37Å; V520-F522 VanDerWaalsContact C-N 3.33Å; V520-F522 PolarHBondContact O-N 3.26Å; V520-L523 PolarHBondContact O-N 3.03Å; V520-L524 HydrophobicContact CG1-CD1 3.7Å; V520-L524 HydrophobicContact CG1-CG 4.49Å; V520-L524 WeakPolarHBondContact O-CB 3.4Å; V520-L524 WeakPolarHBondContact O-CD1 3.48Å; V520-L524 VanDerWaalsContact O-CG 3.25Å; V520-L524 WeakPolarHBondContact O-CG 3.26Å; V520-L524 PolarHBondContact O-N 3.02Å; V520-L552 HydrophobicContact CB-CD2 4.02Å; V520-L552 HydrophobicContact CG1-CD2 4.18Å; V520-L552 HydrophobicContact CG2-CD2 3.92Å; V520-L555 HydrophobicContact CG1-CD2 4.05Å
521	K	90.3	Very high	89.1	Confident	76 Å²	76	41.5 Å²	41.5	33%	0.33	21%	0.214	S	C	.	.	H	α-helix	trans	-56.1	-48.6	174.2	-74.1	172.3	-166.9	165.3	0	111.6	E517 E518 L524 L525 L555	E517-K521 WeakPolarHBondContact O-CG 3.4Å; E517-K521 PolarHBondContact O-N 3.18Å; E518-K521 PolarHBondContact O-N 3.09Å; E518-K521 IonicContact OE1-NZ 2.79Å; E518-K521 PolarHBondContact OE1-NZ 2.86Å; K521-L524 PolarHBondContact O-N 3.16Å; K521-L525 WeakPolarHBondContact O-CB 3.47Å; K521-L525 VanDerWaalsContact O-CG 3.32Å; K521-L525 WeakPolarHBondContact O-CG 3.44Å; K521-L525 PolarHBondContact O-N 3.19Å; K521-L555 HydrophobicContact CD-CD1 4.07Å; K521-L555 HydrophobicContact CG-CD1 3.39Å; K521-L555 HydrophobicContact CG-CD2 4.25Å; K521-L555 HydrophobicContact CG-CG 4.33Å
522	F	88.3	Confident	89	Confident	36 Å²	36	43.8 Å²	43.8	16%	0.158	23%	0.226	C	C	.	.	H	α-helix	trans	-66.1	-42.8	-176.8	-175.3	-107	0	0	0	112.2	L488 M489 L492 E518 A519 V520 L525 N526	L488-F522 HydrophobicContact CD2-CD1 4.09Å; L488-F522 HydrophobicContact CG-CD1 4.17Å; L488-F522 HydrophobicContact CG-CE1 4.48Å; M489-F522 HydrophobicContact CB-CE1 4.32Å; M489-F522 HydrophobicContact CB-CE2 4.33Å; M489-F522 HydrophobicContact CB-CZ 3.92Å; M489-F522 HydrophobicContact CE-CD2 3.99Å; M489-F522 HydrophobicContact CE-CE2 4.32Å; M489-F522 HydrophobicContact CG-CD1 4.29Å; M489-F522 HydrophobicContact CG-CD2 3.89Å; M489-F522 HydrophobicContact CG-CE1 3.9Å; M489-F522 HydrophobicContact CG-CE2 3.49Å; M489-F522 VanDerWaalsContact CG-CE2 3.49Å; M489-F522 HydrophobicContact CG-CG 4.29Å; M489-F522 HydrophobicContact CG-CZ 3.49Å; M489-F522 VanDerWaalsContact CG-CZ 3.49Å; M489-F522 HydrophobicContact SD-CE2 4.26Å; L492-F522 HydrophobicContact CB-CE1 4.27Å; L492-F522 HydrophobicContact CD2-CD1 4.01Å; L492-F522 HydrophobicContact CD2-CE1 3.53Å; L492-F522 HydrophobicContact CD2-CZ 4.46Å; E518-F522 WeakPolarHBondContact O-CB 3.43Å; E518-F522 PolarHBondContact O-N 2.98Å; A519-F522 PolarHBondContact O-N 3.28Å; V520-F522 VanDerWaalsContact C-N 3.33Å; V520-F522 PolarHBondContact O-N 3.26Å; F522-L525 PolarHBondContact O-N 3.12Å; F522-N526 VanDerWaalsContact CE2-ND2 3.32Å; F522-N526 WeakPolarHBondContact CE2-ND2 3.37Å; F522-N526 WeakPolarHBondContact CZ-ND2 3.32Å; F522-N526 PolarHBondContact O-N 2.89Å; F522-N526 PolarHBondContact O-ND2 3.11Å
523	L	88.8	Confident	89	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-61.7	-45	176.3	-71.6	168.6	0	0	0	111.2	I480 L492 L507 L508 A511 A519 V520 L525 N526 A528	I480-L523 HydrophobicContact CD1-CD1 4.39Å; L492-L523 HydrophobicContact CD1-CD2 4.17Å; L492-L523 HydrophobicContact CD2-CD2 3.87Å; L507-L523 HydrophobicContact CB-CD1 4.15Å; L507-L523 HydrophobicContact CB-CD2 4.24Å; L507-L523 HydrophobicContact CD1-CD2 4.4Å; L508-L523 HydrophobicContact CD1-CB 4.26Å; L508-L523 HydrophobicContact CD1-CD1 4.41Å; A511-L523 HydrophobicContact CB-CD1 4Å; A519-L523 WeakPolarHBondContact O-CB 3.33Å; A519-L523 WeakPolarHBondContact O-CG 3.33Å; A519-L523 PolarHBondContact O-N 3.28Å; V520-L523 PolarHBondContact O-N 3.03Å; L523-L525 VanDerWaalsContact C-N 3.35Å; L523-L525 PolarHBondContact O-N 2.99Å; L523-N526 CarbonylContact O-C 3.51Å; L523-N526 PolarHBondContact O-N 3.25Å; L523-N526 VanDerWaalsContact O-N 3.09Å; L523-A528 HydrophobicContact CB-CB 4.1Å; L523-A528 WeakPolarHBondContact O-CB 3.43Å; L523-A528 PolarHBondContact O-N 3.43Å
524	L	88.6	Confident	88.9	Confident	4 Å²	4	44.1 Å²	44.1	2%	0.021	23%	0.234	C	C	.	.	H	α-helix	trans	-66.5	-34.4	178.2	-66.3	164.9	0	0	0	112.8	L508 V520 K521 N526 D527 P530 L555 L556 W559	L508-L524 HydrophobicContact CD1-CD2 4.31Å; L508-L524 HydrophobicContact CD1-CG 4.17Å; L508-L524 HydrophobicContact CD2-CD2 3.87Å; V520-L524 HydrophobicContact CG1-CD1 3.7Å; V520-L524 HydrophobicContact CG1-CG 4.49Å; V520-L524 WeakPolarHBondContact O-CB 3.4Å; V520-L524 WeakPolarHBondContact O-CD1 3.48Å; V520-L524 VanDerWaalsContact O-CG 3.25Å; V520-L524 WeakPolarHBondContact O-CG 3.26Å; V520-L524 PolarHBondContact O-N 3.02Å; K521-L524 PolarHBondContact O-N 3.16Å; L524-N526 PolarHBondContact O-N 3.27Å; L524-D527 PolarHBondContact O-N 3.29Å; L524-P530 HydrophobicContact CD2-CB 4.25Å; L524-L555 HydrophobicContact CD1-CD2 3.39Å; L524-L556 HydrophobicContact CD1-CD2 3.99Å; L524-L556 HydrophobicContact CD2-CD2 4.27Å; L524-W559 HydrophobicContact CB-CD2 4.13Å; L524-W559 VanDerWaalsContact CB-CE2 3.5Å; L524-W559 HydrophobicContact CB-CH2 4.35Å; L524-W559 HydrophobicContact CB-CZ2 3.63Å; L524-W559 HydrophobicContact CD1-CG 4.46Å; L524-W559 WeakPolarHBondContact O-CH2 3.05Å
525	L	88.6	Confident	88.8	Confident	120 Å²	120	46.3 Å²	46.3	63%	0.628	25%	0.245	S	C	*	.	H	α-helix	trans	-63.7	-25.1	172.2	-78	166.5	0	0	0	113.2	K521 F522 L523 D527 W559	K521-L525 WeakPolarHBondContact O-CB 3.47Å; K521-L525 VanDerWaalsContact O-CG 3.32Å; K521-L525 WeakPolarHBondContact O-CG 3.44Å; K521-L525 PolarHBondContact O-N 3.19Å; F522-L525 PolarHBondContact O-N 3.12Å; L523-L525 VanDerWaalsContact C-N 3.35Å; L523-L525 PolarHBondContact O-N 2.99Å; L525-D527 VanDerWaalsContact C-N 3.31Å; L525-W559 HydrophobicContact CD2-CH2 4.19Å; L525-W559 HydrophobicContact CD2-CZ2 4.31Å; L525-W559 HydrophobicContact CG-CZ2 4.34Å
526	N	87.5	Confident	88.4	Confident	61 Å²	61	50.5 Å²	50.5	33%	0.326	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	30.6	175.8	-70.4	-87.6	0	0	0	112.3	L492 V497 F522 L523 L524 A528	L492-N526 HydrophobicContact CD2-CB 4.33Å; V497-N526 HydrophobicContact CG2-CB 4.17Å; F522-N526 VanDerWaalsContact CE2-ND2 3.32Å; F522-N526 WeakPolarHBondContact CE2-ND2 3.37Å; F522-N526 WeakPolarHBondContact CZ-ND2 3.32Å; F522-N526 PolarHBondContact O-N 2.89Å; F522-N526 PolarHBondContact O-ND2 3.11Å; L523-N526 CarbonylContact O-C 3.51Å; L523-N526 PolarHBondContact O-N 3.25Å; L523-N526 VanDerWaalsContact O-N 3.09Å; L524-N526 PolarHBondContact O-N 3.27Å; N526-A528 VanDerWaalsContact C-N 3.3Å; N526-A528 PolarHBondContact O-N 3.12Å
527	D	86.1	Confident	88.2	Confident	107 Å²	107	51 Å²	51	57%	0.572	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	24.5	176.2	-80.9	-62.4	0	0	0	115.5	L524 L525 N529 R561	L524-D527 PolarHBondContact O-N 3.29Å; L525-D527 VanDerWaalsContact C-N 3.31Å; D527-N529 PolarHBondContact O-N 3.25Å; D527-R561 IonicContact OD1-CZ 3.91Å; D527-R561 IonicContact OD1-NH1 2.9Å; D527-R561 PolarHBondContact OD1-NH1 3.05Å
528	A	87.2	Confident	88.1	Confident	5 Å²	5	47.5 Å²	47.5	4%	0.041	25%	0.245	C	C	.	.			trans	-54.5	134.1	171.8	0	0	0	0	0	111.5	V497 L508 L523 N526 P530	V497-A528 VanDerWaalsContact CG1-CA 3.45Å; V497-A528 HydrophobicContact CG1-CB 3.41Å; V497-A528 VanDerWaalsContact CG1-CB 3.41Å; L508-A528 HydrophobicContact CD2-CB 4.45Å; L523-A528 HydrophobicContact CB-CB 4.1Å; L523-A528 WeakPolarHBondContact O-CB 3.43Å; L523-A528 PolarHBondContact O-N 3.43Å; N526-A528 VanDerWaalsContact C-N 3.3Å; N526-A528 PolarHBondContact O-N 3.12Å; A528-P530 WeakPolarHBondContact O-CD 3.13Å
529	N	88.1	Confident	88.3	Confident	58 Å²	58	43 Å²	43	31%	0.31	22%	0.224	S	C	.	.			trans	-81.2	111.8	-178	-179.5	-0.7	0	0	0	111.2	D498 D527 N531 L532	D498-N529 PolarHBondContact OD1-N 3.39Å; D498-N529 WeakPolarHBondContact OD2-CB 3.24Å; D527-N529 PolarHBondContact O-N 3.25Å; N529-N531 PolarHBondContact O-N 3.32Å; N529-N531 WeakPolarHBondContact OD1-CB 3.15Å; N529-N531 PolarHBondContact OD1-N 3.37Å; N529-L532 HydrophobicContact CB-CD1 3.87Å; N529-L532 HydrophobicContact CB-CG 3.77Å; N529-L532 PolarHBondContact O-N 2.91Å
530	P	88.3	Confident	88.5	Confident	5 Å²	5	43 Å²	43	3%	0.032	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-1.4	-177.2	34.4	-37.6	0	0	0	113.8	L508 L524 A528 P540 L556 R561 T562	L508-P530 HydrophobicContact CD2-CB 4.3Å; L524-P530 HydrophobicContact CD2-CB 4.25Å; A528-P530 WeakPolarHBondContact O-CD 3.13Å; P530-P540 VanDerWaalsContact O-CD 3.31Å; P530-P540 WeakPolarHBondContact O-CD 3.38Å; P530-L556 HydrophobicContact CB-CD2 4.37Å; P530-R561 HydrophobicContact CG-CB 4.49Å; P530-T562 HydrophobicContact CB-CG2 4.4Å; P530-T562 WeakPolarHBondContact CG-OG1 3.44Å
531	N	89.6	Confident	88.7	Confident	47 Å²	47	43.1 Å²	43.1	25%	0.251	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.9	1.8	-178.8	-56.8	-47.2	0	0	0	113.3	N529 P533 R561 N563	N529-N531 PolarHBondContact O-N 3.32Å; N529-N531 WeakPolarHBondContact OD1-CB 3.15Å; N529-N531 PolarHBondContact OD1-N 3.37Å; N531-P533 WeakPolarHBondContact O-CD 3.29Å; N531-R561 PolarHBondContact ND2-O 3.04Å; N531-N563 WeakPolarHBondContact OD1-CB 3.23Å; N531-N563 PolarHBondContact OD1-N 3.06Å
532	L	89.6	Confident	88.8	Confident	48 Å²	48	39.6 Å²	39.6	25%	0.251	21%	0.209	S	C	.	.			trans	-61	125.6	176.3	-74.8	171.6	0	0	0	109	D498 H509 N529 P540	D498-L532 HydrophobicContact CB-CD1 3.58Å; D498-L532 WeakPolarHBondContact OD1-CD1 3.45Å; H509-L532 PolarHBondContact CE1-O 3.3Å; H509-L532 PolarHBondContact NE2-O 2.96Å; N529-L532 HydrophobicContact CB-CD1 3.87Å; N529-L532 HydrophobicContact CB-CG 3.77Å; N529-L532 PolarHBondContact O-N 2.91Å; L532-P540 WeakPolarHBondContact O-CD 3.33Å
533	P	89.8	Confident	89	Confident	77 Å²	77	38 Å²	38	50%	0.5	20%	0.202	S	C	.	.			trans	-81.3	147.1	172	31.3	-31.3	0	0	0	110.4	N531 S538	N531-P533 WeakPolarHBondContact O-CD 3.29Å; P533-S538 WeakPolarHBondContact CA-O 3.29Å
534	N	88.6	Confident	89.2	Confident	11 Å²	11	38 Å²	38	6%	0.059	20%	0.202	C	C	.	.			trans	-81.8	-172.1	163.7	67.2	10	0	0	0	111.8	G504 D505 R536 G537 S538	G504-N534 WeakPolarHBondContact O-CA 3.24Å; D505-N534 WeakPolarHBondContact OD1-CB 3.35Å; D505-N534 PolarHBondContact OD1-ND2 2.67Å; N534-R536 PolarHBondContact O-N 3Å; N534-R536 WeakPolarHBondContact OD1-CA 3.15Å; N534-R536 WeakPolarHBondContact OD1-CB 3.39Å; N534-R536 PolarHBondContact OD1-N 3.48Å; N534-G537 PolarHBondContact O-N 3.32Å; N534-S538 PolarHBondContact N-O 3.34Å; N534-S538 WeakPolarHBondContact OD1-CB 3.45Å; N534-S538 PolarHBondContact OD1-N 3.25Å; N534-S538 PolarHBondContact OD1-O 3.32Å
535	I	85.4	Confident	89.4	Confident	112 Å²	112	37.9 Å²	37.9	57%	0.574	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-18.3	178.5	62.6	177.3	0	0	0	114.4	G503 G537	G503-I535 VanDerWaalsContact O-CD1 3.32Å; G503-I535 WeakPolarHBondContact O-CD1 3.29Å; G503-I535 WeakPolarHBondContact O-CG1 3.29Å; G503-I535 WeakPolarHBondContact O-CG2 3.46Å; I535-G537 VanDerWaalsContact C-N 3.32Å
536	R	81.6	Confident	89.5	Confident	111 Å²	111	34.5 Å²	34.5	42%	0.419	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	10.8	177.2	-59.8	-174.1	-71.1	164.8	4.1	111.9	N534 S538 E546 E569	N534-R536 PolarHBondContact O-N 3Å; N534-R536 WeakPolarHBondContact OD1-CA 3.15Å; N534-R536 WeakPolarHBondContact OD1-CB 3.39Å; N534-R536 PolarHBondContact OD1-N 3.48Å; R536-S538 PolarHBondContact O-N 2.89Å; R536-E546 IonicContact NH2-OE2 3.95Å; R536-E569 VanDerWaalsContact C-CG 3.46Å; R536-E569 WeakPolarHBondContact O-CG 3.46Å; R536-E569 PolarHBondContact O-N 2.96Å
537	G	85.9	Confident	89.6	Confident	16 Å²	16	36.6 Å²	36.6	17%	0.165	19%	0.189	C	C	.	.	S	Bend	trans	68.9	-1.3	-171.6	0	0	0	0	0	114.2	N534 I535 D568	N534-G537 PolarHBondContact O-N 3.32Å; I535-G537 VanDerWaalsContact C-N 3.32Å; G537-D568 WeakPolarHBondContact O-CA 3.42Å
538	S	90.3	Very high	89.8	Confident	5 Å²	5	36.3 Å²	36.3	4%	0.035	18%	0.184	C	C	.	.			trans	-77.1	133.1	-173.7	-61.5	0	0	0	0	110.4	H509 P533 N534 R536	H509-S538 PolarHBondContact NE2-O 3.42Å; P533-S538 WeakPolarHBondContact CA-O 3.29Å; N534-S538 PolarHBondContact N-O 3.34Å; N534-S538 WeakPolarHBondContact OD1-CB 3.45Å; N534-S538 PolarHBondContact OD1-N 3.25Å; N534-S538 PolarHBondContact OD1-O 3.32Å; R536-S538 PolarHBondContact O-N 2.89Å
539	T	93.1	Very high	90	Very high	5 Å²	5	38.1 Å²	38.1	3%	0.031	19%	0.191	C	C	.	.			trans	-87.4	166.3	174	70.6	0	0	0	0	111.6	L541 H542 L543 A566	T539-L541 PolarHBondContact O-N 3.08Å; T539-L541 VanDerWaalsContact O-N 3.08Å; T539-H542 PolarHBondContact N-ND1 3.02Å; T539-H542 VanDerWaalsContact N-ND1 3.19Å; T539-H542 WeakPolarHBondContact O-CA 3.44Å; T539-H542 VanDerWaalsContact O-CB 3.31Å; T539-H542 WeakPolarHBondContact O-CB 3.22Å; T539-H542 PolarHBondContact O-N 3.16Å; T539-H542 PolarHBondContact OG1-ND1 3.19Å; T539-L543 PolarHBondContact O-N 3.19Å; T539-A566 HydrophobicContact CG2-CB 3.67Å
540	P	92.6	Very high	90.2	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-49	-36.4	172.4	-33.4	39	0	0	0	113.8	L508 H509 I512 P530 L532 L543 A544 L556	L508-P540 HydrophobicContact CB-CG 4.38Å; L508-P540 HydrophobicContact CD2-CB 4.03Å; L508-P540 HydrophobicContact CD2-CG 3.79Å; L508-P540 HydrophobicContact CG-CB 4.1Å; L508-P540 HydrophobicContact CG-CG 4.04Å; H509-P540 VanDerWaalsContact CE1-CD 3.49Å; H509-P540 WeakPolarHBondContact CE1-CD 3.32Å; H509-P540 VanDerWaalsContact NE2-CD 3.28Å; H509-P540 WeakPolarHBondContact NE2-CD 3.36Å; I512-P540 HydrophobicContact CD1-CB 3.45Å; I512-P540 VanDerWaalsContact CD1-CB 3.45Å; I512-P540 WeakPolarHBondContact CD1-O 3.46Å; P530-P540 VanDerWaalsContact O-CD 3.31Å; P530-P540 WeakPolarHBondContact O-CD 3.38Å; L532-P540 WeakPolarHBondContact O-CD 3.33Å; P540-L543 PolarHBondContact O-N 3.16Å; P540-A544 PolarHBondContact O-N 2.8Å; P540-L556 HydrophobicContact CB-CD1 4.31Å; P540-L556 HydrophobicContact CB-CD2 4.36Å
541	L	94.1	Very high	90.4	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-69.6	-33.3	177.5	-175.8	61.3	0	0	0	113	T539 T545 A553 L556 L557 T562 P574 L590	T539-L541 PolarHBondContact O-N 3.08Å; T539-L541 VanDerWaalsContact O-N 3.08Å; L541-T545 WeakPolarHBondContact O-CB 3.43Å; L541-T545 PolarHBondContact O-N 3.26Å; L541-T545 VanDerWaalsContact O-N 3.11Å; L541-T545 PolarHBondContact O-OG1 3.46Å; L541-A553 HydrophobicContact CD1-CB 4.07Å; L541-L556 HydrophobicContact CD1-CD1 4.48Å; L541-L557 HydrophobicContact CD1-CD1 4.29Å; L541-L557 HydrophobicContact CD1-CD2 4.13Å; L541-L557 HydrophobicContact CD1-CG 3.97Å; L541-L557 HydrophobicContact CD2-CD2 3.69Å; L541-L557 HydrophobicContact CD2-CG 4.43Å; L541-T562 HydrophobicContact CD2-CG2 4.14Å; L541-P574 HydrophobicContact CB-CG 4.39Å; L541-P574 HydrophobicContact CD2-CB 4.23Å; L541-P574 HydrophobicContact CD2-CG 3.77Å; L541-P574 HydrophobicContact CG-CB 4.05Å; L541-P574 HydrophobicContact CG-CG 3.82Å; L541-L590 HydrophobicContact CD1-CD2 4.41Å; L541-L590 HydrophobicContact CD2-CD2 4.29Å
542	H	93.5	Very high	90.5	Very high	2 Å²	2	42.6 Å²	42.6	1%	0.009	21%	0.21	C	C	.	.	H	α-helix	trans	-63	-48.5	172.2	-69.6	85.9	0	0	0	110.3	T539 A544 T545 E546 A566 Y572 P574 W577	T539-H542 PolarHBondContact N-ND1 3.02Å; T539-H542 VanDerWaalsContact N-ND1 3.19Å; T539-H542 WeakPolarHBondContact O-CA 3.44Å; T539-H542 VanDerWaalsContact O-CB 3.31Å; T539-H542 WeakPolarHBondContact O-CB 3.22Å; T539-H542 PolarHBondContact O-N 3.16Å; T539-H542 PolarHBondContact OG1-ND1 3.19Å; H542-A544 PolarHBondContact O-N 3.26Å; H542-T545 CarbonylContact O-C 3.42Å; H542-T545 WeakPolarHBondContact O-CB 3.39Å; H542-T545 PolarHBondContact O-N 2.98Å; H542-T545 VanDerWaalsContact O-N 3.11Å; H542-E546 WeakPolarHBondContact O-CB 3.43Å; H542-E546 PolarHBondContact O-N 3.46Å; H542-A566 PolarHBondContact CE1-O 2.87Å; H542-A566 PolarHBondContact NE2-O 3.28Å; H542-Y572 PolarHBondContact NE2-O 2.93Å; H542-P574 WeakPolarHBondContact NE2-CD 3.07Å; H542-W577 AromaticContact CD2-CD1 3.59Å; H542-W577 AromaticContact CD2-NE1 3.81Å
543	L	91.9	Very high	90.6	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-61.4	-42.5	177.9	-69.8	-174.1	0	0	0	112.6	H509 I512 T539 P540 T545 E546 K547	H509-L543 HydrophobicContact CB-CD1 3.61Å; H509-L543 VanDerWaalsContact CD2-CD1 3.42Å; H509-L543 WeakPolarHBondContact CD2-CD1 3.44Å; I512-L543 HydrophobicContact CG2-CB 4.16Å; T539-L543 PolarHBondContact O-N 3.19Å; P540-L543 PolarHBondContact O-N 3.16Å; L543-T545 PolarHBondContact O-N 2.61Å; L543-E546 WeakPolarHBondContact CD2-OE2 3.26Å; L543-E546 PolarHBondContact O-N 2.84Å; L543-K547 WeakPolarHBondContact O-CB 3.24Å; L543-K547 WeakPolarHBondContact O-CG 3.41Å; L543-K547 PolarHBondContact O-N 3.09Å
544	A	93.8	Very high	90.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.9	-34.6	176.8	0	0	0	0	0	111.7	I512 P540 H542 H548 Q549 A553 L556	I512-A544 HydrophobicContact CG2-CB 3.89Å; P540-A544 PolarHBondContact O-N 2.8Å; H542-A544 PolarHBondContact O-N 3.26Å; A544-H548 PolarHBondContact O-N 3.39Å; A544-Q549 PolarHBondContact O-N 3.27Å; A544-A553 HydrophobicContact CB-CB 4.07Å; A544-L556 HydrophobicContact CB-CD1 4.07Å
545	T	93.1	Very high	90.9	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-76.1	-42.3	176.6	-54.6	0	0	0	0	112.4	L541 H542 L543 K547 H548 P574 W577 A578 N581 M586	L541-T545 WeakPolarHBondContact O-CB 3.43Å; L541-T545 PolarHBondContact O-N 3.26Å; L541-T545 VanDerWaalsContact O-N 3.11Å; L541-T545 PolarHBondContact O-OG1 3.46Å; H542-T545 CarbonylContact O-C 3.42Å; H542-T545 WeakPolarHBondContact O-CB 3.39Å; H542-T545 PolarHBondContact O-N 2.98Å; H542-T545 VanDerWaalsContact O-N 3.11Å; L543-T545 PolarHBondContact O-N 2.61Å; T545-K547 VanDerWaalsContact C-N 3.28Å; T545-K547 PolarHBondContact O-N 2.87Å; T545-H548 PolarHBondContact O-N 2.87Å; T545-P574 WeakPolarHBondContact CG2-O 3.48Å; T545-W577 HydrophobicContact CG2-CB 3.82Å; T545-A578 HydrophobicContact CG2-CB 3.77Å; T545-N581 PolarHBondContact O-ND2 3.18Å; T545-M586 HydrophobicContact CG2-CG 3.92Å
546	E	90.7	Very high	91.1	Very high	50 Å²	50	36 Å²	36	23%	0.234	17%	0.169	C	C	.	.	H	α-helix	trans	-59.1	-40	175.4	-173.4	-171.4	171	0	0	111.2	R536 H542 L543 H548 W577	R536-E546 IonicContact NH2-OE2 3.95Å; H542-E546 WeakPolarHBondContact O-CB 3.43Å; H542-E546 PolarHBondContact O-N 3.46Å; L543-E546 WeakPolarHBondContact CD2-OE2 3.26Å; L543-E546 PolarHBondContact O-N 2.84Å; E546-H548 VanDerWaalsContact C-N 3.34Å; E546-H548 PolarHBondContact O-CD2 3.27Å; E546-W577 HydrophobicContact CB-CE3 4.36Å; E546-W577 HydrophobicContact CG-CE3 4.23Å; E546-W577 HydrophobicContact CG-CZ3 3.99Å
547	K	89.3	Confident	91.6	Very high	105 Å²	105	31.5 Å²	31.5	46%	0.457	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	4.2	179.7	-61.9	-61.7	-178.1	-173.1	0	114.5	L543 T545 Q549	L543-K547 WeakPolarHBondContact O-CB 3.24Å; L543-K547 WeakPolarHBondContact O-CG 3.41Å; L543-K547 PolarHBondContact O-N 3.09Å; T545-K547 VanDerWaalsContact C-N 3.28Å; T545-K547 PolarHBondContact O-N 2.87Å; K547-Q549 HydrophobicContact CB-CG 3.99Å; K547-Q549 PolarHBondContact O-N 3.14Å
548	H	90.6	Very high	91.6	Very high	100 Å²	100	33.4 Å²	33.4	46%	0.463	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	30.9	-179.1	-53.9	-95.3	0	0	0	114.4	A544 T545 E546 K550 D583	A544-H548 PolarHBondContact O-N 3.39Å; T545-H548 PolarHBondContact O-N 2.87Å; E546-H548 VanDerWaalsContact C-N 3.34Å; E546-H548 PolarHBondContact O-CD2 3.27Å; H548-K550 PolarHBondContact O-N 2.97Å; H548-D583 IonicContact ND1-OD2 3.99Å
549	Q	91.5	Very high	91.3	Very high	43 Å²	43	37.7 Å²	37.7	20%	0.201	19%	0.189	C	C	.	.			trans	-93.8	76.2	-176.1	-68.2	172.4	-10.5	0	0	111	I512 A544 K547 L551 L552 A553	I512-Q549 PolarHBondContact O-NE2 3.48Å; I512-Q549 VanDerWaalsContact O-NE2 3.13Å; I512-Q549 PolarHBondContact O-OE1 2.75Å; A544-Q549 PolarHBondContact O-N 3.27Å; K547-Q549 HydrophobicContact CB-CG 3.99Å; K547-Q549 PolarHBondContact O-N 3.14Å; Q549-L551 VanDerWaalsContact C-N 3.32Å; Q549-L551 PolarHBondContact O-N 2.99Å; Q549-L552 HydrophobicContact CB-CB 4.11Å; Q549-L552 HydrophobicContact CB-CD1 4.12Å; Q549-L552 HydrophobicContact CB-CG 4.5Å; Q549-L552 HydrophobicContact CG-CD1 4.35Å; Q549-L552 PolarHBondContact O-N 3.49Å; Q549-A553 PolarHBondContact O-N 3.05Å
550	K	91.8	Very high	90.5	Very high	92 Å²	92	49.7 Å²	49.7	40%	0.4	23%	0.234	S	C	.	.	H	α-helix	trans	-52.1	-44.6	-178.2	-174.6	-172.3	173.1	-171.6	0	113.8	H548 L552 A553 E554 A585 M586 L589	H548-K550 PolarHBondContact O-N 2.97Å; K550-L552 VanDerWaalsContact C-N 3.35Å; K550-L552 PolarHBondContact O-N 3.05Å; K550-A553 PolarHBondContact O-N 2.84Å; K550-E554 VanDerWaalsContact O-CB 3.32Å; K550-E554 WeakPolarHBondContact O-CB 3.23Å; K550-E554 PolarHBondContact O-N 3.48Å; K550-A585 HydrophobicContact CD-CB 4.05Å; K550-M586 HydrophobicContact CB-CE 4.28Å; K550-L589 HydrophobicContact CG-CD2 4.08Å
551	L	91.4	Very high	90	Very high	108 Å²	108	57.9 Å²	57.9	57%	0.565	26%	0.264	S	S	*	.	H	α-helix	trans	-62.7	-41.9	-177.6	-67.3	174.4	0	0	0	112	Q549 E554 L555	Q549-L551 VanDerWaalsContact C-N 3.32Å; Q549-L551 PolarHBondContact O-N 2.99Å; L551-E554 PolarHBondContact O-N 2.9Å; L551-L555 WeakPolarHBondContact O-CB 3.28Å; L551-L555 PolarHBondContact O-N 3.09Å
552	L	91.6	Very high	89.8	Confident	4 Å²	4	58.6 Å²	58.6	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-70.6	-40.2	178	-74	172.6	0	0	0	111.9	E517 V520 Q549 K550 E554 L555 L556	E517-L552 HydrophobicContact CB-CD2 4.13Å; E517-L552 HydrophobicContact CG-CD2 3.77Å; E517-L552 HydrophobicContact CG-CG 4.15Å; V520-L552 HydrophobicContact CB-CD2 4.02Å; V520-L552 HydrophobicContact CG1-CD2 4.18Å; V520-L552 HydrophobicContact CG2-CD2 3.92Å; Q549-L552 HydrophobicContact CB-CB 4.11Å; Q549-L552 HydrophobicContact CB-CD1 4.12Å; Q549-L552 HydrophobicContact CB-CG 4.5Å; Q549-L552 HydrophobicContact CG-CD1 4.35Å; Q549-L552 PolarHBondContact O-N 3.49Å; K550-L552 VanDerWaalsContact C-N 3.35Å; K550-L552 PolarHBondContact O-N 3.05Å; L552-E554 VanDerWaalsContact C-N 3.34Å; L552-L555 WeakPolarHBondContact O-CB 3.38Å; L552-L555 PolarHBondContact O-N 3.11Å; L552-L556 WeakPolarHBondContact O-CG 3.43Å; L552-L556 PolarHBondContact O-N 2.8Å
553	A	92.5	Very high	89.6	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.4	-41.9	172.3	0	0	0	0	0	111.7	L541 A544 Q549 K550 L555 L556 L557 M586 L589	L541-A553 HydrophobicContact CD1-CB 4.07Å; A544-A553 HydrophobicContact CB-CB 4.07Å; Q549-A553 PolarHBondContact O-N 3.05Å; K550-A553 PolarHBondContact O-N 2.84Å; A553-L555 VanDerWaalsContact C-N 3.27Å; A553-L555 PolarHBondContact O-N 3.43Å; A553-L556 PolarHBondContact O-N 2.8Å; A553-L557 VanDerWaalsContact O-CB 3.3Å; A553-L557 WeakPolarHBondContact O-CB 3.34Å; A553-L557 WeakPolarHBondContact O-CD1 3.38Å; A553-L557 WeakPolarHBondContact O-CG 3.25Å; A553-L557 PolarHBondContact O-N 3.44Å; A553-M586 HydrophobicContact CB-CE 3.5Å; A553-M586 VanDerWaalsContact CB-CE 3.5Å; A553-M586 HydrophobicContact CB-SD 3.42Å; A553-M586 WeakPolarHBondContact CB-SD 3.07Å; A553-L589 HydrophobicContact CB-CD2 4.3Å
554	E	92.5	Very high	89.7	Confident	76 Å²	76	62.8 Å²	62.8	36%	0.355	29%	0.292	S	S	.	.	H	α-helix	trans	-61.4	-39.1	176.8	178	158.3	-152.1	0	0	112	K550 L551 L552 G558 L589 R593	K550-E554 VanDerWaalsContact O-CB 3.32Å; K550-E554 WeakPolarHBondContact O-CB 3.23Å; K550-E554 PolarHBondContact O-N 3.48Å; L551-E554 PolarHBondContact O-N 2.9Å; L552-E554 VanDerWaalsContact C-N 3.34Å; E554-G558 PolarHBondContact O-N 2.98Å; E554-L589 HydrophobicContact CB-CD1 4.28Å; E554-L589 HydrophobicContact CB-CD2 3.82Å; E554-L589 HydrophobicContact CG-CD1 4.27Å; E554-R593 PolarHBondContact O-NH1 3.25Å; E554-R593 IonicContact OE1-NH2 3.25Å; E554-R593 PolarHBondContact OE1-NH2 3.25Å
555	L	91.1	Very high	89.7	Confident	34 Å²	34	64.8 Å²	64.8	18%	0.178	30%	0.303	C	S	.	.	H	α-helix	trans	-64.8	-50.6	175.9	-159.5	155.1	0	0	0	111.1	V520 K521 L524 L551 L552 A553 L557 G558 W559	V520-L555 HydrophobicContact CG1-CD2 4.05Å; K521-L555 HydrophobicContact CD-CD1 4.07Å; K521-L555 HydrophobicContact CG-CD1 3.39Å; K521-L555 HydrophobicContact CG-CD2 4.25Å; K521-L555 HydrophobicContact CG-CG 4.33Å; L524-L555 HydrophobicContact CD1-CD2 3.39Å; L551-L555 WeakPolarHBondContact O-CB 3.28Å; L551-L555 PolarHBondContact O-N 3.09Å; L552-L555 WeakPolarHBondContact O-CB 3.38Å; L552-L555 PolarHBondContact O-N 3.11Å; A553-L555 VanDerWaalsContact C-N 3.27Å; A553-L555 PolarHBondContact O-N 3.43Å; L555-L557 VanDerWaalsContact C-N 3.33Å; L555-L557 PolarHBondContact O-N 2.93Å; L555-G558 PolarHBondContact O-N 2.85Å; L555-W559 VanDerWaalsContact O-CD1 3.26Å
556	L	91.3	Very high	89.6	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-58	-44.8	175.9	-70.2	165.6	0	0	0	111.8	L508 I512 L524 P530 P540 L541 A544 L552 A553 G558 W559 T562	L508-L556 HydrophobicContact CD2-CD2 4.19Å; I512-L556 HydrophobicContact CD1-CD1 3.69Å; I512-L556 HydrophobicContact CD1-CD2 4.35Å; L524-L556 HydrophobicContact CD1-CD2 3.99Å; L524-L556 HydrophobicContact CD2-CD2 4.27Å; P530-L556 HydrophobicContact CB-CD2 4.37Å; P540-L556 HydrophobicContact CB-CD1 4.31Å; P540-L556 HydrophobicContact CB-CD2 4.36Å; L541-L556 HydrophobicContact CD1-CD1 4.48Å; A544-L556 HydrophobicContact CB-CD1 4.07Å; L552-L556 WeakPolarHBondContact O-CG 3.43Å; L552-L556 PolarHBondContact O-N 2.8Å; A553-L556 PolarHBondContact O-N 2.8Å; L556-G558 PolarHBondContact O-N 2.95Å; L556-W559 PolarHBondContact O-N 2.8Å; L556-W559 VanDerWaalsContact O-N 3.16Å; L556-T562 WeakPolarHBondContact O-CB 3.49Å; L556-T562 PolarHBondContact O-OG1 3.33Å
557	L	90.9	Very high	89.7	Confident	17 Å²	17	66 Å²	66	9%	0.089	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-13.2	178.3	-67.1	168.4	0	0	0	113.2	L541 A553 L555 W559 T562 V564 L589 L590 R593	L541-L557 HydrophobicContact CD1-CD1 4.29Å; L541-L557 HydrophobicContact CD1-CD2 4.13Å; L541-L557 HydrophobicContact CD1-CG 3.97Å; L541-L557 HydrophobicContact CD2-CD2 3.69Å; L541-L557 HydrophobicContact CD2-CG 4.43Å; A553-L557 VanDerWaalsContact O-CB 3.3Å; A553-L557 WeakPolarHBondContact O-CB 3.34Å; A553-L557 WeakPolarHBondContact O-CD1 3.38Å; A553-L557 WeakPolarHBondContact O-CG 3.25Å; A553-L557 PolarHBondContact O-N 3.44Å; L555-L557 VanDerWaalsContact C-N 3.33Å; L555-L557 PolarHBondContact O-N 2.93Å; L557-W559 VanDerWaalsContact C-N 3.28Å; L557-T562 HydrophobicContact CD2-CG2 4.48Å; L557-V564 HydrophobicContact CD2-CB 4.19Å; L557-V564 HydrophobicContact CD2-CG1 3.93Å; L557-V564 HydrophobicContact CD2-CG2 3.5Å; L557-V564 VanDerWaalsContact CD2-CG2 3.5Å; L557-L589 HydrophobicContact CD1-CD2 4.04Å; L557-L589 HydrophobicContact CD1-CG 3.86Å; L557-L590 HydrophobicContact CD1-CD2 3.89Å; L557-L590 HydrophobicContact CD2-CD2 4.39Å; L557-R593 VanDerWaalsContact C-NH1 3.34Å; L557-R593 HydrophobicContact CB-CB 4.45Å; L557-R593 HydrophobicContact CB-CG 4.03Å; L557-R593 VanDerWaalsContact CB-NH1 3.33Å; L557-R593 HydrophobicContact CD1-CB 4.36Å; L557-R593 HydrophobicContact CD1-CG 4.09Å; L557-R593 HydrophobicContact CD2-CB 4.31Å; L557-R593 PolarHBondContact O-NH1 2.84Å
558	G	85.6	Confident	89.8	Confident	56 Å²	56	61.3 Å²	61.3	58%	0.577	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-20.2	171.4	0	0	0	0	0	112.7	E554 L555 L556	E554-G558 PolarHBondContact O-N 2.98Å; L555-G558 PolarHBondContact O-N 2.85Å; L556-G558 PolarHBondContact O-N 2.95Å
559	W	85.5	Confident	89.8	Confident	94 Å²	94	63 Å²	63	36%	0.356	30%	0.296	S	S	.	.	S	Bend	trans	-85.2	124.9	177.1	-74.5	85.8	0	0	0	111.2	L524 L525 L555 L556 L557 R561 T562	L524-W559 HydrophobicContact CB-CD2 4.13Å; L524-W559 VanDerWaalsContact CB-CE2 3.5Å; L524-W559 HydrophobicContact CB-CH2 4.35Å; L524-W559 HydrophobicContact CB-CZ2 3.63Å; L524-W559 HydrophobicContact CD1-CG 4.46Å; L524-W559 WeakPolarHBondContact O-CH2 3.05Å; L525-W559 HydrophobicContact CD2-CH2 4.19Å; L525-W559 HydrophobicContact CD2-CZ2 4.31Å; L525-W559 HydrophobicContact CG-CZ2 4.34Å; L555-W559 VanDerWaalsContact O-CD1 3.26Å; L556-W559 PolarHBondContact O-N 2.8Å; L556-W559 VanDerWaalsContact O-N 3.16Å; L557-W559 VanDerWaalsContact C-N 3.28Å; W559-R561 PolarHBondContact O-N 3.13Å; W559-T562 PolarHBondContact O-N 3.03Å; W559-T562 VanDerWaalsContact O-N 3.12Å; W559-T562 PolarHBondContact O-OG1 3.43Å
560	R	75.8	Confident	89.6	Confident	258 Å²	258	66.5 Å²	66.5	97%	0.974	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-21.1	-175.1	-73.6	-171.3	-176.9	-127.9	2.6	114.9
561	R	82.4	Confident	89.6	Confident	171 Å²	171	66.1 Å²	66.1	65%	0.645	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-10.4	-178.1	-70.3	-176.2	176.2	157.5	2.3	113.3	D527 P530 N531 W559 N563	D527-R561 IonicContact OD1-CZ 3.91Å; D527-R561 IonicContact OD1-NH1 2.9Å; D527-R561 PolarHBondContact OD1-NH1 3.05Å; P530-R561 HydrophobicContact CG-CB 4.49Å; N531-R561 PolarHBondContact ND2-O 3.04Å; W559-R561 PolarHBondContact O-N 3.13Å; R561-N563 PolarHBondContact O-N 3.39Å
562	T	88.4	Confident	89.7	Confident	17 Å²	17	62 Å²	62	10%	0.104	29%	0.294	C	S	.	.			trans	-74.8	125.4	-175.2	-54.5	0	0	0	0	111.7	P530 L541 L556 L557 W559 V564	P530-T562 HydrophobicContact CB-CG2 4.4Å; P530-T562 WeakPolarHBondContact CG-OG1 3.44Å; L541-T562 HydrophobicContact CD2-CG2 4.14Å; L556-T562 WeakPolarHBondContact O-CB 3.49Å; L556-T562 PolarHBondContact O-OG1 3.33Å; L557-T562 HydrophobicContact CD2-CG2 4.48Å; W559-T562 PolarHBondContact O-N 3.03Å; W559-T562 VanDerWaalsContact O-N 3.12Å; W559-T562 PolarHBondContact O-OG1 3.43Å; T562-V564 PolarHBondContact O-N 2.99Å
563	N	90.6	Very high	89.9	Confident	77 Å²	77	61.8 Å²	61.8	41%	0.412	29%	0.293	S	S	.	.			trans	-85.8	104.9	174.9	-177	5.1	0	0	0	110.3	N531 R561 N565 A566	N531-N563 WeakPolarHBondContact OD1-CB 3.23Å; N531-N563 PolarHBondContact OD1-N 3.06Å; R561-N563 PolarHBondContact O-N 3.39Å; N563-N565 PolarHBondContact O-N 2.89Å; N563-N565 PolarHBondContact OD1-N 3.1Å; N563-A566 HydrophobicContact CB-CB 4.31Å; N563-A566 PolarHBondContact O-N 2.79Å; N563-A566 PolarHBondContact OD1-N 2.93Å
564	V	93.1	Very high	90	Very high	17 Å²	17	61.8 Å²	61.8	10%	0.103	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-25.5	179	-166	0	0	0	0	112.4	L557 T562 P574 L590 A595	L557-V564 HydrophobicContact CD2-CB 4.19Å; L557-V564 HydrophobicContact CD2-CG1 3.93Å; L557-V564 HydrophobicContact CD2-CG2 3.5Å; L557-V564 VanDerWaalsContact CD2-CG2 3.5Å; T562-V564 PolarHBondContact O-N 2.99Å; V564-P574 WeakPolarHBondContact O-CD 3.46Å; V564-L590 HydrophobicContact CG1-CD2 3.86Å; V564-A595 HydrophobicContact CG1-CB 3.7Å
565	N	93.3	Very high	90.2	Very high	42 Å²	42	58.2 Å²	58.2	23%	0.225	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.1	22.8	-176.9	-55.6	-53.5	0	0	0	111.8	N563 A595 T596	N563-N565 PolarHBondContact O-N 2.89Å; N563-N565 PolarHBondContact OD1-N 3.1Å; N565-A595 WeakPolarHBondContact OD1-CA 3.5Å; N565-T596 PolarHBondContact OD1-N 3.28Å; N565-T596 PolarHBondContact OD1-OG1 3.09Å
566	A	92.6	Very high	90.4	Very high	8 Å²	8	56.6 Å²	56.6	7%	0.066	27%	0.267	C	S	.	.			trans	-55.3	144.3	171.7	0	0	0	0	0	109.7	T539 H542 N563 T573 P574	T539-A566 HydrophobicContact CG2-CB 3.67Å; H542-A566 PolarHBondContact CE1-O 2.87Å; H542-A566 PolarHBondContact NE2-O 3.28Å; N563-A566 HydrophobicContact CB-CB 4.31Å; N563-A566 PolarHBondContact O-N 2.79Å; N563-A566 PolarHBondContact OD1-N 2.93Å; A566-T573 WeakPolarHBondContact O-CA 3.36Å; A566-P574 WeakPolarHBondContact O-CD 3.48Å
567	K	92.8	Very high	90.5	Very high	67 Å²	67	58.8 Å²	58.8	29%	0.291	28%	0.276	S	S	.	.			trans	-113.8	132.2	-179.3	-73	-170	-176.6	-167.6	0	109.2	Q571 Y572 T573 E599 T600	K567-Q571 HydrophobicContact CD-CB 4.12Å; K567-Y572 VanDerWaalsContact CA-O 3.31Å; K567-Y572 WeakPolarHBondContact CA-O 3.41Å; K567-T573 HydrophobicContact CG-CG2 3.97Å; K567-E599 VanDerWaalsContact CE-OE2 3.25Å; K567-E599 WeakPolarHBondContact CE-OE2 3.39Å; K567-E599 IonicContact NZ-OE2 2.72Å; K567-E599 PolarHBondContact NZ-OE2 3.43Å; K567-T600 PolarHBondContact NZ-O 3.38Å; K567-T600 VanDerWaalsContact NZ-O 3.12Å
568	D	91.7	Very high	90.8	Very high	7 Å²	7	58 Å²	58	4%	0.037	27%	0.271	C	S	.	.			trans	-79.3	-171.5	170.8	67.2	16.7	0	0	0	111.9	G537 D570 Q571 Y572 W577	G537-D568 WeakPolarHBondContact O-CA 3.42Å; D568-D570 VanDerWaalsContact C-N 3.27Å; D568-D570 PolarHBondContact O-N 3.49Å; D568-D570 PolarHBondContact OD1-N 2.97Å; D568-Q571 WeakPolarHBondContact O-CA 3.41Å; D568-Q571 PolarHBondContact O-N 3.15Å; D568-Q571 PolarHBondContact OD1-N 2.94Å; D568-Y572 PolarHBondContact N-O 3.33Å; D568-Y572 WeakPolarHBondContact OD1-CA 3.43Å; D568-Y572 WeakPolarHBondContact OD1-CB 3.48Å; D568-Y572 PolarHBondContact OD1-N 3.02Å; D568-Y572 WeakPolarHBondContact OD2-CB 3.4Å; D568-W577 PolarHBondContact OD2-NE1 3.4Å
569	E	90.1	Very high	91.2	Very high	134 Å²	134	55.3 Å²	55.3	63%	0.626	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-36.7	179.7	-80	-177.1	156.7	0	0	113.5	R536 Q571	R536-E569 VanDerWaalsContact C-CG 3.46Å; R536-E569 WeakPolarHBondContact O-CG 3.46Å; R536-E569 PolarHBondContact O-N 2.96Å; E569-Q571 PolarHBondContact O-N 2.93Å
570	D	87	Confident	91.6	Very high	118 Å²	118	53.1 Å²	53.1	63%	0.631	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	5.4	177.1	-72.5	-43.9	0	0	0	112.7	D568 Y572 G602	D568-D570 VanDerWaalsContact C-N 3.27Å; D568-D570 PolarHBondContact O-N 3.49Å; D568-D570 PolarHBondContact OD1-N 2.97Å; D570-Y572 HydrophobicContact CB-CD2 3.95Å; D570-Y572 HydrophobicContact CB-CE2 4.46Å; D570-Y572 PolarHBondContact O-N 3.46Å; D570-G602 PolarHBondContact O-N 3.11Å; D570-G602 VanDerWaalsContact O-N 3.09Å
571	Q	92.1	Very high	92.4	Very high	84 Å²	84	42.9 Å²	42.9	39%	0.393	20%	0.202	S	C	.	.			trans	62	20.9	-171.5	-56.2	-69	-60.6	0	0	113.6	K567 D568 E569 D601	K567-Q571 HydrophobicContact CD-CB 4.12Å; D568-Q571 WeakPolarHBondContact O-CA 3.41Å; D568-Q571 PolarHBondContact O-N 3.15Å; D568-Q571 PolarHBondContact OD1-N 2.94Å; E569-Q571 PolarHBondContact O-N 2.93Å; Q571-D601 WeakPolarHBondContact O-CA 3.34Å
572	Y	93.6	Very high	92.8	Very high	21 Å²	21	35.8 Å²	35.8	8%	0.082	18%	0.182	C	C	.	.			trans	-71.8	139.3	173	-91.9	-132.9	0	0	0	109.7	H542 K567 D568 D570 H576 W577 D601 R605	H542-Y572 PolarHBondContact NE2-O 2.93Å; K567-Y572 VanDerWaalsContact CA-O 3.31Å; K567-Y572 WeakPolarHBondContact CA-O 3.41Å; D568-Y572 PolarHBondContact N-O 3.33Å; D568-Y572 WeakPolarHBondContact OD1-CA 3.43Å; D568-Y572 WeakPolarHBondContact OD1-CB 3.48Å; D568-Y572 PolarHBondContact OD1-N 3.02Å; D568-Y572 WeakPolarHBondContact OD2-CB 3.4Å; D570-Y572 HydrophobicContact CB-CD2 3.95Å; D570-Y572 HydrophobicContact CB-CE2 4.46Å; D570-Y572 PolarHBondContact O-N 3.46Å; Y572-H576 HydrophobicContact CD1-CB 3.46Å; Y572-H576 VanDerWaalsContact CD1-CB 3.46Å; Y572-H576 HydrophobicContact CE1-CB 4.01Å; Y572-H576 HydrophobicContact CG-CB 3.85Å; Y572-W577 HydrophobicContact CD1-CG 4.47Å; Y572-W577 AromaticContact CD1-NE1 3.99Å; Y572-D601 HydrophobicContact CD2-CB 3.79Å; Y572-D601 HydrophobicContact CE2-CB 3.98Å; Y572-D601 VanDerWaalsContact CE2-OD2 3.29Å; Y572-D601 WeakPolarHBondContact CE2-OD2 3.39Å; Y572-R605 VanDerWaalsContact CE2-NH2 3.33Å; Y572-R605 PolarHBondContact OH-NH2 3.47Å
573	T	95.1	Very high	93.1	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.183	C	C	.	.			trans	-95.4	165.1	168.5	68.7	0	0	0	0	110.2	A566 K567 L575 H576 W577 E599	A566-T573 WeakPolarHBondContact O-CA 3.36Å; K567-T573 HydrophobicContact CG-CG2 3.97Å; T573-L575 PolarHBondContact O-N 3.34Å; T573-L575 VanDerWaalsContact O-N 3.1Å; T573-L575 PolarHBondContact OG1-N 3.06Å; T573-H576 PolarHBondContact N-ND1 3.45Å; T573-H576 WeakPolarHBondContact O-CA 3.24Å; T573-H576 WeakPolarHBondContact O-CB 3.41Å; T573-H576 PolarHBondContact O-N 2.99Å; T573-H576 PolarHBondContact OG1-N 2.81Å; T573-H576 PolarHBondContact OG1-ND1 2.75Å; T573-W577 PolarHBondContact O-N 2.99Å; T573-E599 HydrophobicContact CG2-CB 4.27Å
574	P	94.9	Very high	93.3	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-54.2	-32.6	172.1	-26.9	35.7	0	0	0	112.4	L541 H542 T545 V564 A566 H576 W577 A578 L590	L541-P574 HydrophobicContact CB-CG 4.39Å; L541-P574 HydrophobicContact CD2-CB 4.23Å; L541-P574 HydrophobicContact CD2-CG 3.77Å; L541-P574 HydrophobicContact CG-CB 4.05Å; L541-P574 HydrophobicContact CG-CG 3.82Å; H542-P574 WeakPolarHBondContact NE2-CD 3.07Å; T545-P574 WeakPolarHBondContact CG2-O 3.48Å; V564-P574 WeakPolarHBondContact O-CD 3.46Å; A566-P574 WeakPolarHBondContact O-CD 3.48Å; P574-H576 PolarHBondContact O-N 3.03Å; P574-W577 PolarHBondContact O-N 3.38Å; P574-A578 PolarHBondContact O-N 2.85Å; P574-L590 HydrophobicContact CB-CD1 4.07Å; P574-L590 HydrophobicContact CB-CD2 4.03Å
575	L	96.1	Very high	93.3	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-67.4	-33.7	175.8	-171.7	61.4	0	0	0	112.7	T573 A579 T587 L590 L591 A595 P607 L623	T573-L575 PolarHBondContact O-N 3.34Å; T573-L575 VanDerWaalsContact O-N 3.1Å; T573-L575 PolarHBondContact OG1-N 3.06Å; L575-A579 WeakPolarHBondContact O-CB 3.49Å; L575-A579 PolarHBondContact O-N 3.4Å; L575-T587 HydrophobicContact CD1-CG2 3.9Å; L575-L590 HydrophobicContact CB-CD1 4.48Å; L575-L590 HydrophobicContact CD1-CB 4.3Å; L575-L590 HydrophobicContact CD1-CD1 4.41Å; L575-L591 HydrophobicContact CD1-CD2 4.23Å; L575-L591 HydrophobicContact CD1-CG 4.19Å; L575-L591 HydrophobicContact CD2-CD2 3.71Å; L575-A595 HydrophobicContact CB-CB 4.46Å; L575-A595 HydrophobicContact CD2-CB 4.13Å; L575-P607 HydrophobicContact CB-CG 4.27Å; L575-P607 HydrophobicContact CD2-CB 4.26Å; L575-P607 HydrophobicContact CD2-CG 3.85Å; L575-P607 HydrophobicContact CG-CB 3.95Å; L575-P607 HydrophobicContact CG-CG 3.83Å; L575-L623 HydrophobicContact CD2-CD2 4.48Å
576	H	95.4	Very high	93.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-65.1	-42.8	172.1	-70.5	88.3	0	0	0	111.5	Y572 T573 P574 A579 Q580 E599 R605 P607	Y572-H576 HydrophobicContact CD1-CB 3.46Å; Y572-H576 VanDerWaalsContact CD1-CB 3.46Å; Y572-H576 HydrophobicContact CE1-CB 4.01Å; Y572-H576 HydrophobicContact CG-CB 3.85Å; T573-H576 PolarHBondContact N-ND1 3.45Å; T573-H576 WeakPolarHBondContact O-CA 3.24Å; T573-H576 WeakPolarHBondContact O-CB 3.41Å; T573-H576 PolarHBondContact O-N 2.99Å; T573-H576 PolarHBondContact OG1-N 2.81Å; T573-H576 PolarHBondContact OG1-ND1 2.75Å; P574-H576 PolarHBondContact O-N 3.03Å; H576-A579 PolarHBondContact O-N 2.9Å; H576-Q580 WeakPolarHBondContact O-CB 3.43Å; H576-Q580 PolarHBondContact O-N 3.44Å; H576-E599 PolarHBondContact CE1-O 2.79Å; H576-E599 PolarHBondContact NE2-O 2.84Å; H576-R605 PolarHBondContact NE2-O 2.95Å; H576-P607 WeakPolarHBondContact NE2-CD 3.27Å
577	W	94.6	Very high	93.5	Very high	45 Å²	45	33.8 Å²	33.8	17%	0.17	17%	0.173	C	C	.	.	H	α-helix	trans	-62.5	-47.3	175.2	-80.1	95.5	0	0	0	112	H542 T545 E546 D568 Y572 T573 P574 A579 Q580 N581	H542-W577 AromaticContact CD2-CD1 3.59Å; H542-W577 AromaticContact CD2-NE1 3.81Å; T545-W577 HydrophobicContact CG2-CB 3.82Å; E546-W577 HydrophobicContact CB-CE3 4.36Å; E546-W577 HydrophobicContact CG-CE3 4.23Å; E546-W577 HydrophobicContact CG-CZ3 3.99Å; D568-W577 PolarHBondContact OD2-NE1 3.4Å; Y572-W577 HydrophobicContact CD1-CG 4.47Å; Y572-W577 AromaticContact CD1-NE1 3.99Å; T573-W577 PolarHBondContact O-N 2.99Å; P574-W577 PolarHBondContact O-N 3.38Å; W577-A579 PolarHBondContact O-N 3.49Å; W577-Q580 PolarHBondContact O-N 3.39Å; W577-N581 VanDerWaalsContact O-CB 3.25Å; W577-N581 WeakPolarHBondContact O-CB 3.18Å; W577-N581 PolarHBondContact O-N 3.23Å
578	A	95.3	Very high	93.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-58.6	-39.9	175.2	0	0	0	0	0	111.6	T545 P574 N581 G582 D583 M586 L590	T545-A578 HydrophobicContact CG2-CB 3.77Å; P574-A578 PolarHBondContact O-N 2.85Å; A578-N581 PolarHBondContact O-N 2.91Å; A578-G582 PolarHBondContact O-N 3Å; A578-D583 PolarHBondContact O-N 3.08Å; A578-D583 VanDerWaalsContact O-N 3.14Å; A578-M586 HydrophobicContact CB-CB 4.31Å; A578-M586 HydrophobicContact CB-CG 4.09Å; A578-L590 HydrophobicContact CB-CD1 3.96Å
579	A	95.1	Very high	93.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-69.3	-35.9	178.4	0	0	0	0	0	113.9	L575 H576 W577 P607 A611 Q616 V619	L575-A579 WeakPolarHBondContact O-CB 3.49Å; L575-A579 PolarHBondContact O-N 3.4Å; H576-A579 PolarHBondContact O-N 2.9Å; W577-A579 PolarHBondContact O-N 3.49Å; A579-P607 HydrophobicContact CB-CB 4.04Å; A579-P607 WeakPolarHBondContact CB-O 3.5Å; A579-A611 HydrophobicContact CB-CB 4.04Å; A579-Q616 WeakPolarHBondContact O-CG 3.27Å; A579-V619 HydrophobicContact CB-CG1 4.03Å
580	Q	94.6	Very high	94	Very high	48 Å²	48	30.3 Å²	30.3	22%	0.224	15%	0.153	C	C	.	.	H	α-helix	trans	-66.4	-45.4	173.1	-179.2	167.4	-56.7	0	0	111.5	H576 W577 G582 V610 Q616	H576-Q580 WeakPolarHBondContact O-CB 3.43Å; H576-Q580 PolarHBondContact O-N 3.44Å; W577-Q580 PolarHBondContact O-N 3.39Å; Q580-G582 VanDerWaalsContact C-N 3.3Å; Q580-G582 PolarHBondContact O-N 3.24Å; Q580-V610 HydrophobicContact CB-CG1 3.66Å; Q580-V610 HydrophobicContact CG-CG1 4.36Å; Q580-Q616 PolarHBondContact O-NE2 3.04Å
581	N	91	Very high	94.3	Very high	43 Å²	43	25.4 Å²	25.4	23%	0.23	13%	0.127	C	C	.	.	H	α-helix	trans	-73.7	-18.6	-175.3	-79.2	1.1	0	0	0	113.8	T545 W577 A578 D583	T545-N581 PolarHBondContact O-ND2 3.18Å; W577-N581 VanDerWaalsContact O-CB 3.25Å; W577-N581 WeakPolarHBondContact O-CB 3.18Å; W577-N581 PolarHBondContact O-N 3.23Å; A578-N581 PolarHBondContact O-N 2.91Å; N581-D583 VanDerWaalsContact C-N 3.32Å
582	G	92.5	Very high	94.4	Very high	22 Å²	22	26.1 Å²	26.1	23%	0.227	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	15.8	-177	0	0	0	0	0	114.1	A578 Q580 E584	A578-G582 PolarHBondContact O-N 3Å; Q580-G582 VanDerWaalsContact C-N 3.3Å; Q580-G582 PolarHBondContact O-N 3.24Å; G582-E584 PolarHBondContact O-N 3.14Å
583	D	92.9	Very high	94.3	Very high	24 Å²	24	29.3 Å²	29.3	13%	0.128	15%	0.145	C	C	.	.			trans	-79.8	91.8	-177.4	-169	-22.7	0	0	0	110.6	H548 A578 N581 A585 M586 T587	H548-D583 IonicContact ND1-OD2 3.99Å; A578-D583 PolarHBondContact O-N 3.08Å; A578-D583 VanDerWaalsContact O-N 3.14Å; N581-D583 VanDerWaalsContact C-N 3.32Å; D583-A585 VanDerWaalsContact C-N 3.3Å; D583-A585 PolarHBondContact O-N 2.85Å; D583-A585 PolarHBondContact OD1-N 3.26Å; D583-A585 VanDerWaalsContact OD1-N 3.12Å; D583-M586 HydrophobicContact CB-CB 3.88Å; D583-M586 WeakPolarHBondContact OD1-CB 3.48Å; D583-M586 PolarHBondContact OD1-N 3.37Å; D583-M586 WeakPolarHBondContact OD2-CB 3.31Å; D583-T587 VanDerWaalsContact O-CB 3.31Å; D583-T587 WeakPolarHBondContact O-CB 3.43Å; D583-T587 PolarHBondContact O-N 3.29Å; D583-T587 PolarHBondContact O-OG1 2.96Å
584	E	94.8	Very high	94	Very high	55 Å²	55	31.6 Å²	31.6	26%	0.257	17%	0.168	S	C	.	.	H	α-helix	trans	-60.4	-39.5	178.7	-172	-175.8	172.3	0	0	112.4	G582 T587 R588 N618 V622	G582-E584 PolarHBondContact O-N 3.14Å; E584-T587 PolarHBondContact O-N 3.39Å; E584-R588 WeakPolarHBondContact O-CG 3.16Å; E584-R588 PolarHBondContact O-N 3.13Å; E584-R588 IonicContact OE1-CZ 2.74Å; E584-R588 IonicContact OE1-NE 3.15Å; E584-R588 PolarHBondContact OE1-NE 2.82Å; E584-R588 IonicContact OE1-NH2 2.66Å; E584-R588 PolarHBondContact OE1-NH2 2.79Å; E584-N618 HydrophobicContact CB-CB 4.39Å; E584-N618 HydrophobicContact CG-CB 4.37Å; E584-V622 HydrophobicContact CG-CG2 3.66Å
585	A	93.8	Very high	93.9	Very high	41 Å²	41	32 Å²	32	34%	0.339	17%	0.172	S	C	.	.	H	α-helix	trans	-71.6	-41.5	-175.5	0	0	0	0	0	111.2	K550 D583 L589	K550-A585 HydrophobicContact CD-CB 4.05Å; D583-A585 VanDerWaalsContact C-N 3.3Å; D583-A585 PolarHBondContact O-N 2.85Å; D583-A585 PolarHBondContact OD1-N 3.26Å; D583-A585 VanDerWaalsContact OD1-N 3.12Å; A585-L589 WeakPolarHBondContact O-CB 3.42Å; A585-L589 PolarHBondContact O-N 2.79Å; A585-L589 VanDerWaalsContact O-N 3.09Å
586	M	94.3	Very high	93.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.5	-42.6	172.4	-171.8	66.5	73.3	0	0	111.5	T545 K550 A553 A578 D583 R588 L589 L590	T545-M586 HydrophobicContact CG2-CG 3.92Å; K550-M586 HydrophobicContact CB-CE 4.28Å; A553-M586 HydrophobicContact CB-CE 3.5Å; A553-M586 VanDerWaalsContact CB-CE 3.5Å; A553-M586 HydrophobicContact CB-SD 3.42Å; A553-M586 WeakPolarHBondContact CB-SD 3.07Å; A578-M586 HydrophobicContact CB-CB 4.31Å; A578-M586 HydrophobicContact CB-CG 4.09Å; D583-M586 HydrophobicContact CB-CB 3.88Å; D583-M586 WeakPolarHBondContact OD1-CB 3.48Å; D583-M586 PolarHBondContact OD1-N 3.37Å; D583-M586 WeakPolarHBondContact OD2-CB 3.31Å; M586-R588 VanDerWaalsContact C-N 3.34Å; M586-R588 PolarHBondContact O-N 3.25Å; M586-L589 WeakPolarHBondContact O-CB 3.31Å; M586-L589 PolarHBondContact O-N 3.27Å; M586-L589 HydrophobicContact SD-CD2 4.11Å; M586-L590 HydrophobicContact CG-CD1 3.89Å; M586-L590 HydrophobicContact CG-CG 4.28Å; M586-L590 WeakPolarHBondContact O-CB 3.4Å; M586-L590 WeakPolarHBondContact O-CG 3.34Å; M586-L590 PolarHBondContact O-N 3.45Å; M586-L590 HydrophobicContact SD-CG 4.47Å
587	T	95.6	Very high	93.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-56.1	-48.7	176.6	-60.9	0	0	0	0	110.8	L575 D583 E584 L589 L590 L591 V619 V622 L623	L575-T587 HydrophobicContact CD1-CG2 3.9Å; D583-T587 VanDerWaalsContact O-CB 3.31Å; D583-T587 WeakPolarHBondContact O-CB 3.43Å; D583-T587 PolarHBondContact O-N 3.29Å; D583-T587 PolarHBondContact O-OG1 2.96Å; E584-T587 PolarHBondContact O-N 3.39Å; T587-L589 PolarHBondContact O-N 3.04Å; T587-L590 PolarHBondContact O-N 3.48Å; T587-L591 HydrophobicContact CG2-CD1 3.92Å; T587-L591 WeakPolarHBondContact O-CB 3.49Å; T587-L591 WeakPolarHBondContact O-CG 3.29Å; T587-L591 PolarHBondContact O-N 3.37Å; T587-V619 HydrophobicContact CG2-CG1 4.04Å; T587-V622 HydrophobicContact CG2-CB 4.48Å; T587-V622 HydrophobicContact CG2-CG1 4Å; T587-L623 HydrophobicContact CG2-CD2 4.34Å
588	R	95.4	Very high	93.6	Very high	123 Å²	123	37.2 Å²	37.2	46%	0.464	20%	0.204	S	C	.	.	H	α-helix	trans	-60.5	-46.5	176.5	-71.5	177.1	-174.3	178.1	-2.5	111.9	E584 M586 L590 L591 D592 V622	E584-R588 WeakPolarHBondContact O-CG 3.16Å; E584-R588 PolarHBondContact O-N 3.13Å; E584-R588 IonicContact OE1-CZ 2.74Å; E584-R588 IonicContact OE1-NE 3.15Å; E584-R588 PolarHBondContact OE1-NE 2.82Å; E584-R588 IonicContact OE1-NH2 2.66Å; E584-R588 PolarHBondContact OE1-NH2 2.79Å; M586-R588 VanDerWaalsContact C-N 3.34Å; M586-R588 PolarHBondContact O-N 3.25Å; R588-L590 PolarHBondContact O-N 3.28Å; R588-L591 PolarHBondContact O-N 2.78Å; R588-D592 WeakPolarHBondContact O-CB 3.24Å; R588-D592 PolarHBondContact O-N 3.23Å; R588-V622 HydrophobicContact CG-CG1 3.71Å; R588-V622 HydrophobicContact CG-CG2 4.01Å
589	L	94.3	Very high	93.5	Very high	12 Å²	12	40.4 Å²	40.4	6%	0.063	22%	0.219	C	C	.	.	H	α-helix	trans	-58.3	-48.1	179.1	175.8	66.5	0	0	0	111.7	K550 A553 E554 L557 A585 M586 T587 L591 D592 R593	K550-L589 HydrophobicContact CG-CD2 4.08Å; A553-L589 HydrophobicContact CB-CD2 4.3Å; E554-L589 HydrophobicContact CB-CD1 4.28Å; E554-L589 HydrophobicContact CB-CD2 3.82Å; E554-L589 HydrophobicContact CG-CD1 4.27Å; L557-L589 HydrophobicContact CD1-CD2 4.04Å; L557-L589 HydrophobicContact CD1-CG 3.86Å; A585-L589 WeakPolarHBondContact O-CB 3.42Å; A585-L589 PolarHBondContact O-N 2.79Å; A585-L589 VanDerWaalsContact O-N 3.09Å; M586-L589 WeakPolarHBondContact O-CB 3.31Å; M586-L589 PolarHBondContact O-N 3.27Å; M586-L589 HydrophobicContact SD-CD2 4.11Å; T587-L589 PolarHBondContact O-N 3.04Å; L589-L591 PolarHBondContact O-N 3.26Å; L589-D592 PolarHBondContact O-N 3.21Å; L589-R593 HydrophobicContact CD1-CG 4.3Å; L589-R593 WeakPolarHBondContact O-CG 3.35Å; L589-R593 PolarHBondContact O-N 3.18Å; L589-R593 VanDerWaalsContact O-N 3.1Å
590	L	94.6	Very high	93.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-61.1	-45.3	178.7	-72	168.9	0	0	0	111.2	L541 L557 V564 P574 L575 A578 M586 T587 R588 D592 R593 G594 A595	L541-L590 HydrophobicContact CD1-CD2 4.41Å; L541-L590 HydrophobicContact CD2-CD2 4.29Å; L557-L590 HydrophobicContact CD1-CD2 3.89Å; L557-L590 HydrophobicContact CD2-CD2 4.39Å; V564-L590 HydrophobicContact CG1-CD2 3.86Å; P574-L590 HydrophobicContact CB-CD1 4.07Å; P574-L590 HydrophobicContact CB-CD2 4.03Å; L575-L590 HydrophobicContact CB-CD1 4.48Å; L575-L590 HydrophobicContact CD1-CB 4.3Å; L575-L590 HydrophobicContact CD1-CD1 4.41Å; A578-L590 HydrophobicContact CB-CD1 3.96Å; M586-L590 HydrophobicContact CG-CD1 3.89Å; M586-L590 HydrophobicContact CG-CG 4.28Å; M586-L590 WeakPolarHBondContact O-CB 3.4Å; M586-L590 WeakPolarHBondContact O-CG 3.34Å; M586-L590 PolarHBondContact O-N 3.45Å; M586-L590 HydrophobicContact SD-CG 4.47Å; T587-L590 PolarHBondContact O-N 3.48Å; R588-L590 PolarHBondContact O-N 3.28Å; L590-D592 PolarHBondContact O-N 2.99Å; L590-R593 CarbonylContact O-C 3.51Å; L590-R593 PolarHBondContact O-N 2.9Å; L590-G594 PolarHBondContact O-N 2.87Å; L590-A595 VanDerWaalsContact C-CB 3.46Å; L590-A595 HydrophobicContact CB-CB 3.94Å; L590-A595 WeakPolarHBondContact O-CB 3.38Å; L590-A595 PolarHBondContact O-N 3.04Å
591	L	94.5	Very high	93.3	Very high	15 Å²	15	40.9 Å²	40.9	8%	0.079	23%	0.225	C	C	.	.	H	α-helix	trans	-64.3	-39.4	177.8	-67.7	174.5	0	0	0	112.8	L575 T587 R588 L589 R593 G594 A595 I597 V622 L623 R626	L575-L591 HydrophobicContact CD1-CD2 4.23Å; L575-L591 HydrophobicContact CD1-CG 4.19Å; L575-L591 HydrophobicContact CD2-CD2 3.71Å; T587-L591 HydrophobicContact CG2-CD1 3.92Å; T587-L591 WeakPolarHBondContact O-CB 3.49Å; T587-L591 WeakPolarHBondContact O-CG 3.29Å; T587-L591 PolarHBondContact O-N 3.37Å; R588-L591 PolarHBondContact O-N 2.78Å; L589-L591 PolarHBondContact O-N 3.26Å; L591-R593 PolarHBondContact O-N 3.46Å; L591-G594 PolarHBondContact O-N 3.45Å; L591-A595 HydrophobicContact CD2-CB 4.39Å; L591-I597 HydrophobicContact CD2-CD1 4.27Å; L591-I597 HydrophobicContact CD2-CG1 3.45Å; L591-I597 VanDerWaalsContact CD2-CG1 3.45Å; L591-V622 HydrophobicContact CD1-CG1 3.84Å; L591-L623 HydrophobicContact CD1-CD2 4.09Å; L591-R626 HydrophobicContact CD1-CG 4.1Å
592	D	93.1	Very high	93.1	Very high	98 Å²	98	41.1 Å²	41.1	52%	0.524	24%	0.238	S	C	.	.	H	α-helix	trans	-65.9	-25.7	176	-69.1	-17.7	0	0	0	112.4	R588 L589 L590 G594 R626	R588-D592 WeakPolarHBondContact O-CB 3.24Å; R588-D592 PolarHBondContact O-N 3.23Å; L589-D592 PolarHBondContact O-N 3.21Å; L590-D592 PolarHBondContact O-N 2.99Å; D592-G594 VanDerWaalsContact C-N 3.34Å; D592-R626 IonicContact OD1-CZ 2.73Å; D592-R626 IonicContact OD1-NH1 3.19Å; D592-R626 PolarHBondContact OD1-NH1 3.46Å; D592-R626 IonicContact OD1-NH2 2.67Å; D592-R626 PolarHBondContact OD1-NH2 3.44Å
593	R	92	Very high	92.9	Very high	88 Å²	88	44.3 Å²	44.3	33%	0.332	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	14.2	177.2	-58.7	-68	174.7	81	8	113	E554 L557 L589 L590 L591	E554-R593 PolarHBondContact O-NH1 3.25Å; E554-R593 IonicContact OE1-NH2 3.25Å; E554-R593 PolarHBondContact OE1-NH2 3.25Å; L557-R593 VanDerWaalsContact C-NH1 3.34Å; L557-R593 HydrophobicContact CB-CB 4.45Å; L557-R593 HydrophobicContact CB-CG 4.03Å; L557-R593 VanDerWaalsContact CB-NH1 3.33Å; L557-R593 HydrophobicContact CD1-CB 4.36Å; L557-R593 HydrophobicContact CD1-CG 4.09Å; L557-R593 HydrophobicContact CD2-CB 4.31Å; L557-R593 PolarHBondContact O-NH1 2.84Å; L589-R593 HydrophobicContact CD1-CG 4.3Å; L589-R593 WeakPolarHBondContact O-CG 3.35Å; L589-R593 PolarHBondContact O-N 3.18Å; L589-R593 VanDerWaalsContact O-N 3.1Å; L590-R593 CarbonylContact O-C 3.51Å; L590-R593 PolarHBondContact O-N 2.9Å; L591-R593 PolarHBondContact O-N 3.46Å
594	G	89.3	Confident	92.7	Very high	48 Å²	48	44.1 Å²	44.1	50%	0.495	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.9	23.3	173	0	0	0	0	0	114.9	L590 L591 D592 T596	L590-G594 PolarHBondContact O-N 2.87Å; L591-G594 PolarHBondContact O-N 3.45Å; D592-G594 VanDerWaalsContact C-N 3.34Å; G594-T596 PolarHBondContact O-N 2.95Å
595	A	93.4	Very high	92.7	Very high	8 Å²	8	43.3 Å²	43.3	7%	0.066	25%	0.246	C	C	.	.			trans	-59.3	134.6	168.2	0	0	0	0	0	110.5	V564 N565 L575 L590 L591 I597	V564-A595 HydrophobicContact CG1-CB 3.7Å; N565-A595 WeakPolarHBondContact OD1-CA 3.5Å; L575-A595 HydrophobicContact CB-CB 4.46Å; L575-A595 HydrophobicContact CD2-CB 4.13Å; L590-A595 VanDerWaalsContact C-CB 3.46Å; L590-A595 HydrophobicContact CB-CB 3.94Å; L590-A595 WeakPolarHBondContact O-CB 3.38Å; L590-A595 PolarHBondContact O-N 3.04Å; L591-A595 HydrophobicContact CD2-CB 4.39Å; A595-I597 PolarHBondContact O-N 3.26Å
596	T	93.8	Very high	92.7	Very high	49 Å²	49	41.3 Å²	41.3	30%	0.301	23%	0.23	S	C	.	.			trans	-77.8	118.6	-179.9	42.1	0	0	0	0	109.8	N565 G594 N598 E599	N565-T596 PolarHBondContact OD1-N 3.28Å; N565-T596 PolarHBondContact OD1-OG1 3.09Å; G594-T596 PolarHBondContact O-N 2.95Å; T596-N598 PolarHBondContact O-N 3.07Å; T596-E599 HydrophobicContact CG2-CG 4.47Å; T596-E599 WeakPolarHBondContact OG1-CG 3.38Å
597	I	93.2	Very high	92.8	Very high	41 Å²	41	41.3 Å²	41.3	21%	0.21	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70	-34.8	-168.2	-62.2	167.1	0	0	0	112.5	L591 A595 P607 L623 R626 A628	L591-I597 HydrophobicContact CD2-CD1 4.27Å; L591-I597 HydrophobicContact CD2-CG1 3.45Å; L591-I597 VanDerWaalsContact CD2-CG1 3.45Å; A595-I597 PolarHBondContact O-N 3.26Å; I597-P607 WeakPolarHBondContact O-CD 3.42Å; I597-L623 HydrophobicContact CG2-CD2 4.25Å; I597-R626 HydrophobicContact CD1-CB 3.72Å; I597-R626 WeakPolarHBondContact CD1-O 3.22Å; I597-A628 HydrophobicContact CG2-CB 3.36Å
598	N	91.6	Very high	92.8	Very high	66 Å²	66	41.4 Å²	41.4	35%	0.353	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	17.6	-170.9	-60.3	-32.1	0	0	0	112.9	T596 D629	T596-N598 PolarHBondContact O-N 3.07Å; N598-D629 PolarHBondContact OD1-N 3.46Å
599	E	93.1	Very high	92.7	Very high	67 Å²	67	35.5 Å²	35.5	31%	0.313	21%	0.208	S	C	.	.			trans	-60.1	144.9	172	-82.5	-64.5	140	0	0	110.7	K567 T573 H576 T596 T606 P607	K567-E599 VanDerWaalsContact CE-OE2 3.25Å; K567-E599 WeakPolarHBondContact CE-OE2 3.39Å; K567-E599 IonicContact NZ-OE2 2.72Å; K567-E599 PolarHBondContact NZ-OE2 3.43Å; T573-E599 HydrophobicContact CG2-CB 4.27Å; H576-E599 PolarHBondContact CE1-O 2.79Å; H576-E599 PolarHBondContact NE2-O 2.84Å; T596-E599 HydrophobicContact CG2-CG 4.47Å; T596-E599 WeakPolarHBondContact OG1-CG 3.38Å; E599-T606 WeakPolarHBondContact O-CA 3.36Å; E599-P607 WeakPolarHBondContact O-CD 3.48Å
600	T	93.4	Very high	92.8	Very high	51 Å²	51	35 Å²	35	31%	0.313	21%	0.205	S	C	.	.			trans	-107.9	142.2	179.4	58	0	0	0	0	111.7	K567 G604 R605 T606 V632	K567-T600 PolarHBondContact NZ-O 3.38Å; K567-T600 VanDerWaalsContact NZ-O 3.12Å; T600-G604 WeakPolarHBondContact CG2-O 3.49Å; T600-R605 CarbonylContact C-O 3.51Å; T600-R605 VanDerWaalsContact CA-O 3.29Å; T600-R605 WeakPolarHBondContact CA-O 3.45Å; T600-T606 HydrophobicContact CG2-CG2 3.95Å; T600-V632 HydrophobicContact CG2-CG1 4.38Å
601	D	91.9	Very high	92.8	Very high	7 Å²	7	35 Å²	35	4%	0.037	21%	0.205	C	C	.	.			trans	-74.9	-175.6	167.8	78	-2.8	0	0	0	112.5	Q571 Y572 Q603 G604 R605	Q571-D601 WeakPolarHBondContact O-CA 3.34Å; Y572-D601 HydrophobicContact CD2-CB 3.79Å; Y572-D601 HydrophobicContact CE2-CB 3.98Å; Y572-D601 VanDerWaalsContact CE2-OD2 3.29Å; Y572-D601 WeakPolarHBondContact CE2-OD2 3.39Å; D601-Q603 PolarHBondContact O-N 3.35Å; D601-Q603 VanDerWaalsContact O-N 3.11Å; D601-Q603 VanDerWaalsContact OD1-C 3.27Å; D601-Q603 VanDerWaalsContact OD1-CA 3.32Å; D601-Q603 WeakPolarHBondContact OD1-CA 3.07Å; D601-Q603 PolarHBondContact OD1-N 3.33Å; D601-G604 PolarHBondContact O-N 3.37Å; D601-G604 PolarHBondContact OD1-N 3.18Å; D601-G604 VanDerWaalsContact OD1-N 3.07Å; D601-R605 PolarHBondContact N-O 3.38Å; D601-R605 WeakPolarHBondContact OD1-CB 3.38Å; D601-R605 PolarHBondContact OD1-N 2.94Å; D601-R605 IonicContact OD1-NE 3.68Å; D601-R605 IonicContact OD2-CZ 3.44Å; D601-R605 IonicContact OD2-NE 2.57Å; D601-R605 PolarHBondContact OD2-NE 2.67Å; D601-R605 IonicContact OD2-NH2 2.81Å; D601-R605 PolarHBondContact OD2-NH2 2.72Å
602	G	87.6	Confident	92.8	Very high	49 Å²	49	34.2 Å²	34.2	51%	0.505	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-10.7	-178.2	0	0	0	0	0	114	D570	D570-G602 PolarHBondContact O-N 3.11Å; D570-G602 VanDerWaalsContact O-N 3.09Å
603	Q	87.4	Confident	92.9	Very high	88 Å²	88	32 Å²	32	41%	0.411	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106	12.1	173.9	-54	-58.9	-36.9	0	0	111.9	D601 R605 K635	D601-Q603 PolarHBondContact O-N 3.35Å; D601-Q603 VanDerWaalsContact O-N 3.11Å; D601-Q603 VanDerWaalsContact OD1-C 3.27Å; D601-Q603 VanDerWaalsContact OD1-CA 3.32Å; D601-Q603 WeakPolarHBondContact OD1-CA 3.07Å; D601-Q603 PolarHBondContact OD1-N 3.33Å; Q603-R605 HydrophobicContact CB-CG 4.26Å; Q603-R605 PolarHBondContact O-N 3.01Å; Q603-K635 WeakPolarHBondContact O-CB 3.32Å; Q603-K635 PolarHBondContact O-N 3.31Å
604	G	90.2	Very high	92.9	Very high	21 Å²	21	31.6 Å²	31.6	22%	0.216	19%	0.189	C	C	.	.	S	Bend	trans	72.5	10.6	-178.8	0	0	0	0	0	114	T600 D601 G634	T600-G604 WeakPolarHBondContact CG2-O 3.49Å; D601-G604 PolarHBondContact O-N 3.37Å; D601-G604 PolarHBondContact OD1-N 3.18Å; D601-G604 VanDerWaalsContact OD1-N 3.07Å; G604-G634 WeakPolarHBondContact O-CA 3.46Å
605	R	93.5	Very high	93.1	Very high	37 Å²	37	30.4 Å²	30.4	14%	0.14	18%	0.177	C	C	.	.			trans	-84.4	135.8	-178.8	-61.3	179.6	-62.7	169.8	-0.3	109.5	Y572 H576 T600 D601 Q603 H609 V610 F643	Y572-R605 VanDerWaalsContact CE2-NH2 3.33Å; Y572-R605 PolarHBondContact OH-NH2 3.47Å; H576-R605 PolarHBondContact NE2-O 2.95Å; T600-R605 CarbonylContact C-O 3.51Å; T600-R605 VanDerWaalsContact CA-O 3.29Å; T600-R605 WeakPolarHBondContact CA-O 3.45Å; D601-R605 PolarHBondContact N-O 3.38Å; D601-R605 WeakPolarHBondContact OD1-CB 3.38Å; D601-R605 PolarHBondContact OD1-N 2.94Å; D601-R605 IonicContact OD1-NE 3.68Å; D601-R605 IonicContact OD2-CZ 3.44Å; D601-R605 IonicContact OD2-NE 2.57Å; D601-R605 PolarHBondContact OD2-NE 2.67Å; D601-R605 IonicContact OD2-NH2 2.81Å; D601-R605 PolarHBondContact OD2-NH2 2.72Å; Q603-R605 HydrophobicContact CB-CG 4.26Å; Q603-R605 PolarHBondContact O-N 3.01Å; R605-H609 HydrophobicContact CB-CB 3.84Å; R605-H609 HydrophobicContact CG-CB 4.31Å; R605-V610 HydrophobicContact CB-CG2 4.41Å; R605-F643 HydrophobicContact CG-CZ 4.32Å
606	T	95.2	Very high	93.2	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.186	C	C	.	.			trans	-86.7	167.9	170.1	70.3	0	0	0	0	111.3	E599 T600 A608 H609 V610 V632	E599-T606 WeakPolarHBondContact O-CA 3.36Å; T600-T606 HydrophobicContact CG2-CG2 3.95Å; T606-A608 PolarHBondContact O-N 2.95Å; T606-A608 VanDerWaalsContact O-N 3.14Å; T606-A608 PolarHBondContact OG1-N 3.43Å; T606-H609 PolarHBondContact N-ND1 3.37Å; T606-H609 WeakPolarHBondContact O-CA 3.38Å; T606-H609 VanDerWaalsContact O-CB 3.32Å; T606-H609 WeakPolarHBondContact O-CB 3.42Å; T606-H609 PolarHBondContact O-N 3.37Å; T606-H609 PolarHBondContact OG1-ND1 3.27Å; T606-V610 PolarHBondContact O-N 3.4Å; T606-V610 VanDerWaalsContact O-N 3.17Å; T606-V632 HydrophobicContact CG2-CB 3.9Å; T606-V632 HydrophobicContact CG2-CG1 3.66Å; T606-V632 HydrophobicContact CG2-CG2 4.18Å
607	P	95.4	Very high	93.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-54.9	-33.5	173.7	-27.2	35.1	0	0	0	113	L575 H576 A579 I597 E599 V610 A611 L623	L575-P607 HydrophobicContact CB-CG 4.27Å; L575-P607 HydrophobicContact CD2-CB 4.26Å; L575-P607 HydrophobicContact CD2-CG 3.85Å; L575-P607 HydrophobicContact CG-CB 3.95Å; L575-P607 HydrophobicContact CG-CG 3.83Å; H576-P607 WeakPolarHBondContact NE2-CD 3.27Å; A579-P607 HydrophobicContact CB-CB 4.04Å; A579-P607 WeakPolarHBondContact CB-O 3.5Å; I597-P607 WeakPolarHBondContact O-CD 3.42Å; E599-P607 WeakPolarHBondContact O-CD 3.48Å; P607-V610 PolarHBondContact O-N 3.39Å; P607-A611 WeakPolarHBondContact O-CB 3.36Å; P607-A611 PolarHBondContact O-N 3.35Å; P607-L623 HydrophobicContact CB-CD1 4.35Å
608	A	95.2	Very high	93.3	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.008	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-39.9	174.3	0	0	0	0	0	112.2	T606 A611 C612 I620 L623	T606-A608 PolarHBondContact O-N 2.95Å; T606-A608 VanDerWaalsContact O-N 3.14Å; T606-A608 PolarHBondContact OG1-N 3.43Å; A608-A611 PolarHBondContact O-N 3.02Å; A608-C612 WeakPolarHBondContact O-CB 3.36Å; A608-C612 PolarHBondContact O-N 3.46Å; A608-C612 PolarHBondContact O-SG 3.05Å; A608-I620 HydrophobicContact CB-CD1 4.3Å; A608-I620 WeakPolarHBondContact O-CD1 3.36Å; A608-L623 HydrophobicContact CB-CD1 4.22Å
609	H	94.8	Very high	93.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-61.1	-45.7	174.4	-68.3	89.4	0	0	0	111.5	R605 T606 C612 Q613 V632 W638 T639 A640 F643	R605-H609 HydrophobicContact CB-CB 3.84Å; R605-H609 HydrophobicContact CG-CB 4.31Å; T606-H609 PolarHBondContact N-ND1 3.37Å; T606-H609 WeakPolarHBondContact O-CA 3.38Å; T606-H609 VanDerWaalsContact O-CB 3.32Å; T606-H609 WeakPolarHBondContact O-CB 3.42Å; T606-H609 PolarHBondContact O-N 3.37Å; T606-H609 PolarHBondContact OG1-ND1 3.27Å; H609-C612 PolarHBondContact O-N 3.3Å; H609-Q613 WeakPolarHBondContact O-CB 3.28Å; H609-Q613 PolarHBondContact O-N 2.95Å; H609-V632 PolarHBondContact CE1-O 2.95Å; H609-V632 PolarHBondContact NE2-O 2.91Å; H609-W638 PolarHBondContact NE2-O 3.26Å; H609-T639 VanDerWaalsContact CD2-C 3.44Å; H609-T639 WeakPolarHBondContact NE2-CA 3.42Å; H609-A640 PolarHBondContact CD2-N 2.88Å; H609-A640 VanDerWaalsContact CD2-N 3.27Å; H609-A640 PolarHBondContact NE2-N 3.12Å; H609-F643 HydrophobicContact CB-CD2 4.21Å; H609-F643 HydrophobicContact CB-CE2 4.23Å; H609-F643 AromaticContact CD2-CD2 3.7Å; H609-F643 AromaticContact CD2-CE2 3.64Å
610	V	94.9	Very high	93.6	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.3	-46.8	179.9	178.8	0	0	0	0	110.8	Q580 R605 T606 P607 C612 Q613 H614	Q580-V610 HydrophobicContact CB-CG1 3.66Å; Q580-V610 HydrophobicContact CG-CG1 4.36Å; R605-V610 HydrophobicContact CB-CG2 4.41Å; T606-V610 PolarHBondContact O-N 3.4Å; T606-V610 VanDerWaalsContact O-N 3.17Å; P607-V610 PolarHBondContact O-N 3.39Å; V610-C612 VanDerWaalsContact C-N 3.31Å; V610-C612 PolarHBondContact O-N 3.4Å; V610-Q613 WeakPolarHBondContact O-CB 3.31Å; V610-Q613 PolarHBondContact O-N 2.99Å; V610-Q613 VanDerWaalsContact O-N 3.13Å; V610-H614 PolarHBondContact O-CD2 3.05Å; V610-H614 VanDerWaalsContact O-CD2 3.29Å; V610-H614 PolarHBondContact O-N 3.07Å
611	A	95.8	Very high	93.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.3	-38.3	175.3	0	0	0	0	0	112.6	A579 P607 A608 H614 G615 Q616 V619 I620	A579-A611 HydrophobicContact CB-CB 4.04Å; P607-A611 WeakPolarHBondContact O-CB 3.36Å; P607-A611 PolarHBondContact O-N 3.35Å; A608-A611 PolarHBondContact O-N 3.02Å; A611-H614 PolarHBondContact O-N 2.66Å; A611-G615 PolarHBondContact O-N 3.3Å; A611-Q616 HydrophobicContact CB-CB 4.18Å; A611-Q616 PolarHBondContact O-N 3.2Å; A611-V619 HydrophobicContact CB-CB 4.33Å; A611-V619 HydrophobicContact CB-CG1 3.96Å; A611-I620 HydrophobicContact CB-CD1 3.47Å; A611-I620 VanDerWaalsContact CB-CD1 3.47Å; A611-I620 HydrophobicContact CB-CG1 3.85Å
612	C	94.8	Very high	93.8	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66.2	-36	173.6	-72.3	0	0	0	0	113.1	A608 H609 V610 I620 A640 F643 A644 H649 I652	A608-C612 WeakPolarHBondContact O-CB 3.36Å; A608-C612 PolarHBondContact O-N 3.46Å; A608-C612 PolarHBondContact O-SG 3.05Å; H609-C612 PolarHBondContact O-N 3.3Å; V610-C612 VanDerWaalsContact C-N 3.31Å; V610-C612 PolarHBondContact O-N 3.4Å; C612-I620 WeakPolarHBondContact SG-CD1 3.38Å; C612-A640 HydrophobicContact CB-CB 4.44Å; C612-A640 WeakPolarHBondContact CB-O 3.5Å; C612-F643 HydrophobicContact CB-CB 4.27Å; C612-A644 HydrophobicContact CB-CB 4.2Å; C612-H649 PolarHBondContact O-CD2 3.08Å; C612-I652 HydrophobicContact CB-CG2 4.32Å; C612-I652 WeakPolarHBondContact SG-CG2 3.28Å
613	Q	94.2	Very high	94.1	Very high	51 Å²	51	30.5 Å²	30.5	24%	0.238	15%	0.151	C	C	.	.	H	α-helix	trans	-67.2	-38.9	175.9	-179.2	177.6	-10.7	0	0	111.7	H609 V610 F643 Q647 H649	H609-Q613 WeakPolarHBondContact O-CB 3.28Å; H609-Q613 PolarHBondContact O-N 2.95Å; V610-Q613 WeakPolarHBondContact O-CB 3.31Å; V610-Q613 PolarHBondContact O-N 2.99Å; V610-Q613 VanDerWaalsContact O-N 3.13Å; Q613-F643 HydrophobicContact CB-CB 4.29Å; Q613-F643 HydrophobicContact CB-CD1 4.12Å; Q613-F643 HydrophobicContact CB-CG 4.4Å; Q613-F643 HydrophobicContact CG-CD1 4.26Å; Q613-Q647 WeakPolarHBondContact O-CG 3.31Å; Q613-H649 PolarHBondContact O-NE2 2.99Å
614	H	92.6	Very high	94.3	Very high	79 Å²	79	27.4 Å²	27.4	37%	0.366	14%	0.137	S	C	.	.	H	α-helix	trans	-91.3	-3.9	-176.9	-73.4	-83.9	0	0	0	114.8	V610 A611 Q616	V610-H614 PolarHBondContact O-CD2 3.05Å; V610-H614 VanDerWaalsContact O-CD2 3.29Å; V610-H614 PolarHBondContact O-N 3.07Å; A611-H614 PolarHBondContact O-N 2.66Å; H614-Q616 HydrophobicContact CB-CG 4.02Å
615	G	93.3	Very high	94.4	Very high	23 Å²	23	30.3 Å²	30.3	24%	0.237	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	20.9	175.8	0	0	0	0	0	114.6	A611 E617 H649 I652	A611-G615 PolarHBondContact O-N 3.3Å; G615-E617 PolarHBondContact O-N 3.23Å; G615-H649 VanDerWaalsContact CA-CD2 3.43Å; G615-H649 WeakPolarHBondContact CA-CD2 3.41Å; G615-H649 VanDerWaalsContact CA-CE1 3.46Å; G615-H649 WeakPolarHBondContact CA-CE1 3.3Å; G615-H649 VanDerWaalsContact CA-NE2 3.34Å; G615-H649 WeakPolarHBondContact CA-NE2 3.44Å; G615-H649 PolarHBondContact N-NE2 3.05Å; G615-I652 VanDerWaalsContact C-CD1 3.49Å
616	Q	95.9	Very high	94.3	Very high	56 Å²	56	32.9 Å²	32.9	26%	0.262	16%	0.164	S	C	.	.			trans	-83.7	79.3	-173.6	-53.5	-62.4	4.2	0	0	112.1	A579 Q580 A611 H614 N618 V619 I620	A579-Q616 WeakPolarHBondContact O-CG 3.27Å; Q580-Q616 PolarHBondContact O-NE2 3.04Å; A611-Q616 HydrophobicContact CB-CB 4.18Å; A611-Q616 PolarHBondContact O-N 3.2Å; H614-Q616 HydrophobicContact CB-CG 4.02Å; Q616-N618 PolarHBondContact O-N 3.29Å; Q616-V619 HydrophobicContact CB-CB 4.11Å; Q616-V619 HydrophobicContact CB-CG2 4.12Å; Q616-V619 PolarHBondContact O-N 3.38Å; Q616-I620 WeakPolarHBondContact O-CG1 3.47Å; Q616-I620 PolarHBondContact O-N 3.41Å; Q616-I620 VanDerWaalsContact O-N 3.14Å
617	E	94.3	Very high	94	Very high	67 Å²	67	39.2 Å²	39.2	31%	0.313	20%	0.198	S	C	.	.	H	α-helix	trans	-59.5	-43.3	-174.7	-169.1	-178.8	139.5	0	0	113.4	G615 V619 I620 R621 G651 I652 L655	G615-E617 PolarHBondContact O-N 3.23Å; E617-V619 PolarHBondContact O-N 3.21Å; E617-I620 PolarHBondContact O-N 2.96Å; E617-R621 WeakPolarHBondContact O-CG 3.34Å; E617-R621 PolarHBondContact O-N 2.98Å; E617-R621 IonicContact OE1-CZ 2.69Å; E617-R621 IonicContact OE1-NE 2.81Å; E617-R621 PolarHBondContact OE1-NE 3.02Å; E617-R621 VanDerWaalsContact OE1-NE 3.12Å; E617-R621 IonicContact OE1-NH2 3.82Å; E617-R621 PolarHBondContact OE1-NH2 3.24Å; E617-G651 WeakPolarHBondContact OE2-CA 3.41Å; E617-I652 HydrophobicContact CB-CG1 4.18Å; E617-I652 HydrophobicContact CG-CG1 4.38Å; E617-L655 HydrophobicContact CG-CD1 3.57Å
618	N	95	Very high	93.7	Very high	88 Å²	88	39.5 Å²	39.5	47%	0.471	20%	0.2	S	C	.	.	H	α-helix	trans	-65.2	-40.7	-177.8	-68.6	-17.6	0	0	0	112.2	E584 Q616 R621 V622	E584-N618 HydrophobicContact CB-CB 4.39Å; E584-N618 HydrophobicContact CG-CB 4.37Å; Q616-N618 PolarHBondContact O-N 3.29Å; N618-R621 WeakPolarHBondContact O-CB 3.37Å; N618-R621 PolarHBondContact O-N 3.44Å; N618-V622 PolarHBondContact O-N 3.1Å; N618-V622 VanDerWaalsContact O-N 3.08Å
619	V	95.5	Very high	93.3	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-62.2	-45.5	174.4	175.2	0	0	0	0	110.3	A579 T587 A611 Q616 E617 R621 V622 L623	A579-V619 HydrophobicContact CB-CG1 4.03Å; T587-V619 HydrophobicContact CG2-CG1 4.04Å; A611-V619 HydrophobicContact CB-CB 4.33Å; A611-V619 HydrophobicContact CB-CG1 3.96Å; Q616-V619 HydrophobicContact CB-CB 4.11Å; Q616-V619 HydrophobicContact CB-CG2 4.12Å; Q616-V619 PolarHBondContact O-N 3.38Å; E617-V619 PolarHBondContact O-N 3.21Å; V619-R621 VanDerWaalsContact C-N 3.29Å; V619-R621 PolarHBondContact O-N 3.34Å; V619-V622 PolarHBondContact O-N 2.72Å; V619-V622 VanDerWaalsContact O-N 3.11Å; V619-L623 HydrophobicContact CG1-CD1 3.82Å; V619-L623 HydrophobicContact CG1-CG 4.19Å; V619-L623 WeakPolarHBondContact O-CG 3.49Å; V619-L623 PolarHBondContact O-N 2.87Å
620	I	95.3	Very high	92.9	Very high	2 Å²	2	43.3 Å²	43.3	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-59.1	-41.1	176.8	-67.5	-61.9	0	0	0	111.4	A608 A611 C612 Q616 E617 V622 L623 L624 I652 L656	A608-I620 HydrophobicContact CB-CD1 4.3Å; A608-I620 WeakPolarHBondContact O-CD1 3.36Å; A611-I620 HydrophobicContact CB-CD1 3.47Å; A611-I620 VanDerWaalsContact CB-CD1 3.47Å; A611-I620 HydrophobicContact CB-CG1 3.85Å; C612-I620 WeakPolarHBondContact SG-CD1 3.38Å; Q616-I620 WeakPolarHBondContact O-CG1 3.47Å; Q616-I620 PolarHBondContact O-N 3.41Å; Q616-I620 VanDerWaalsContact O-N 3.14Å; E617-I620 PolarHBondContact O-N 2.96Å; I620-V622 VanDerWaalsContact C-N 3.33Å; I620-V622 PolarHBondContact O-N 3.17Å; I620-L623 HydrophobicContact CD1-CD1 4.43Å; I620-L623 PolarHBondContact O-N 2.91Å; I620-L624 HydrophobicContact CG2-CD1 3.67Å; I620-L624 HydrophobicContact CG2-CG 4.09Å; I620-L624 WeakPolarHBondContact O-CB 3.46Å; I620-L624 VanDerWaalsContact O-CG 3.25Å; I620-L624 WeakPolarHBondContact O-CG 3.34Å; I620-L624 PolarHBondContact O-N 3.48Å; I620-I652 HydrophobicContact CG1-CD1 4.24Å; I620-I652 HydrophobicContact CG1-CG2 4.33Å; I620-L656 HydrophobicContact CG2-CD2 4.38Å
621	R	94.5	Very high	92.4	Very high	119 Å²	119	45.8 Å²	45.8	45%	0.449	23%	0.232	S	C	.	.	H	α-helix	trans	-59.7	-43.6	175	-70.5	173.9	-179.8	-81.5	1.2	111.8	E617 N618 V619 S625 L655	E617-R621 WeakPolarHBondContact O-CG 3.34Å; E617-R621 PolarHBondContact O-N 2.98Å; E617-R621 IonicContact OE1-CZ 2.69Å; E617-R621 IonicContact OE1-NE 2.81Å; E617-R621 PolarHBondContact OE1-NE 3.02Å; E617-R621 VanDerWaalsContact OE1-NE 3.12Å; E617-R621 IonicContact OE1-NH2 3.82Å; E617-R621 PolarHBondContact OE1-NH2 3.24Å; N618-R621 WeakPolarHBondContact O-CB 3.37Å; N618-R621 PolarHBondContact O-N 3.44Å; V619-R621 VanDerWaalsContact C-N 3.29Å; V619-R621 PolarHBondContact O-N 3.34Å; R621-S625 WeakPolarHBondContact O-CB 3.44Å; R621-S625 PolarHBondContact O-N 2.98Å; R621-L655 HydrophobicContact CG-CD1 3.69Å
622	V	95.3	Very high	92.1	Very high	6 Å²	6	47.3 Å²	47.3	4%	0.036	24%	0.242	C	C	.	.	H	α-helix	trans	-64.1	-47.7	176.3	172.5	0	0	0	0	111	E584 T587 R588 L591 N618 V619 I620 L624 S625 R626	E584-V622 HydrophobicContact CG-CG2 3.66Å; T587-V622 HydrophobicContact CG2-CB 4.48Å; T587-V622 HydrophobicContact CG2-CG1 4Å; R588-V622 HydrophobicContact CG-CG1 3.71Å; R588-V622 HydrophobicContact CG-CG2 4.01Å; L591-V622 HydrophobicContact CD1-CG1 3.84Å; N618-V622 PolarHBondContact O-N 3.1Å; N618-V622 VanDerWaalsContact O-N 3.08Å; V619-V622 PolarHBondContact O-N 2.72Å; V619-V622 VanDerWaalsContact O-N 3.11Å; I620-V622 VanDerWaalsContact C-N 3.33Å; I620-V622 PolarHBondContact O-N 3.17Å; V622-L624 PolarHBondContact O-N 2.98Å; V622-S625 WeakPolarHBondContact O-CB 3.34Å; V622-S625 PolarHBondContact O-N 3.5Å; V622-S625 VanDerWaalsContact O-N 3.15Å; V622-S625 PolarHBondContact O-OG 2.82Å; V622-R626 PolarHBondContact O-N 3.24Å
623	L	94.1	Very high	91.9	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-60.8	-45.7	179.8	-70.2	172.8	0	0	0	111.5	L575 T587 L591 I597 P607 A608 V619 I620 S625 R626 N627 A628	L575-L623 HydrophobicContact CD2-CD2 4.48Å; T587-L623 HydrophobicContact CG2-CD2 4.34Å; L591-L623 HydrophobicContact CD1-CD2 4.09Å; I597-L623 HydrophobicContact CG2-CD2 4.25Å; P607-L623 HydrophobicContact CB-CD1 4.35Å; A608-L623 HydrophobicContact CB-CD1 4.22Å; V619-L623 HydrophobicContact CG1-CD1 3.82Å; V619-L623 HydrophobicContact CG1-CG 4.19Å; V619-L623 WeakPolarHBondContact O-CG 3.49Å; V619-L623 PolarHBondContact O-N 2.87Å; I620-L623 HydrophobicContact CD1-CD1 4.43Å; I620-L623 PolarHBondContact O-N 2.91Å; L623-S625 VanDerWaalsContact C-N 3.32Å; L623-S625 PolarHBondContact O-N 3.22Å; L623-R626 CarbonylContact O-C 3.59Å; L623-R626 PolarHBondContact O-N 3.27Å; L623-R626 VanDerWaalsContact O-N 3.11Å; L623-N627 PolarHBondContact O-N 2.81Å; L623-A628 HydrophobicContact CB-CB 3.88Å; L623-A628 WeakPolarHBondContact O-CB 3.2Å; L623-A628 PolarHBondContact O-N 2.89Å
624	L	91.6	Very high	91.7	Very high	23 Å²	23	50.8 Å²	50.8	12%	0.12	26%	0.258	C	S	.	.	H	α-helix	trans	-63.2	-36.5	175.3	-71.5	175.2	0	0	0	112.3	I620 V622 R626 N627 V630 L655 Q659	I620-L624 HydrophobicContact CG2-CD1 3.67Å; I620-L624 HydrophobicContact CG2-CG 4.09Å; I620-L624 WeakPolarHBondContact O-CB 3.46Å; I620-L624 VanDerWaalsContact O-CG 3.25Å; I620-L624 WeakPolarHBondContact O-CG 3.34Å; I620-L624 PolarHBondContact O-N 3.48Å; V622-L624 PolarHBondContact O-N 2.98Å; L624-R626 PolarHBondContact O-N 3.12Å; L624-N627 PolarHBondContact O-N 3.41Å; L624-V630 HydrophobicContact CD2-CG1 3.66Å; L624-L655 HydrophobicContact CD1-CB 4.3Å; L624-Q659 HydrophobicContact CD2-CG 4.26Å
625	S	91.6	Very high	91.6	Very high	82 Å²	82	52.8 Å²	52.8	57%	0.573	27%	0.266	S	S	*	.	H	α-helix	trans	-64.1	-22	175.9	80.7	0	0	0	0	113.2	R621 V622 L623	R621-S625 WeakPolarHBondContact O-CB 3.44Å; R621-S625 PolarHBondContact O-N 2.98Å; V622-S625 WeakPolarHBondContact O-CB 3.34Å; V622-S625 PolarHBondContact O-N 3.5Å; V622-S625 VanDerWaalsContact O-N 3.15Å; V622-S625 PolarHBondContact O-OG 2.82Å; L623-S625 VanDerWaalsContact C-N 3.32Å; L623-S625 PolarHBondContact O-N 3.22Å
626	R	91.3	Very high	91.4	Very high	92 Å²	92	55.6 Å²	55.6	35%	0.347	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.7	18.9	175.8	-60.5	-65.7	-179.6	95.7	1.3	112.7	L591 D592 I597 V622 L623 L624 A628	L591-R626 HydrophobicContact CD1-CG 4.1Å; D592-R626 IonicContact OD1-CZ 2.73Å; D592-R626 IonicContact OD1-NH1 3.19Å; D592-R626 PolarHBondContact OD1-NH1 3.46Å; D592-R626 IonicContact OD1-NH2 2.67Å; D592-R626 PolarHBondContact OD1-NH2 3.44Å; I597-R626 HydrophobicContact CD1-CB 3.72Å; I597-R626 WeakPolarHBondContact CD1-O 3.22Å; V622-R626 PolarHBondContact O-N 3.24Å; L623-R626 CarbonylContact O-C 3.59Å; L623-R626 PolarHBondContact O-N 3.27Å; L623-R626 VanDerWaalsContact O-N 3.11Å; L624-R626 PolarHBondContact O-N 3.12Å; R626-A628 PolarHBondContact O-N 3.33Å
627	N	87.8	Confident	91.3	Very high	132 Å²	132	56.1 Å²	56.1	71%	0.706	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.9	38.1	177.8	-58.7	88.9	0	0	0	114.2	L623 L624 D629	L623-N627 PolarHBondContact O-N 2.81Å; L624-N627 PolarHBondContact O-N 3.41Å; N627-D629 PolarHBondContact O-N 3.07Å
628	A	89.2	Confident	91.3	Very high	6 Å²	6	55.1 Å²	55.1	5%	0.05	27%	0.273	C	S	.	.			trans	-55.7	137	169.7	0	0	0	0	0	111.8	I597 L623 R626 V630	I597-A628 HydrophobicContact CG2-CB 3.36Å; L623-A628 HydrophobicContact CB-CB 3.88Å; L623-A628 WeakPolarHBondContact O-CB 3.2Å; L623-A628 PolarHBondContact O-N 2.89Å; R626-A628 PolarHBondContact O-N 3.33Å; A628-V630 PolarHBondContact O-N 3.3Å
629	D	87.4	Confident	91.2	Very high	71 Å²	71	51 Å²	51	38%	0.38	25%	0.251	S	S	.	.			trans	-84.6	113.5	176.4	-174.3	0.6	0	0	0	109.8	N598 N627 Q631 V632	N598-D629 PolarHBondContact OD1-N 3.46Å; N627-D629 PolarHBondContact O-N 3.07Å; D629-Q631 WeakPolarHBondContact OD1-CB 3.19Å; D629-Q631 PolarHBondContact OD1-N 2.78Å; D629-V632 HydrophobicContact CB-CG2 3.85Å
630	V	86.1	Confident	91.1	Very high	10 Å²	10	50.9 Å²	50.9	6%	0.061	25%	0.251	C	S	.	.	S	Bend	trans	-94.6	-2.5	-179.2	-62.8	0	0	0	0	113.1	L624 A628 A640 L656 V662	L624-V630 HydrophobicContact CD2-CG1 3.66Å; A628-V630 PolarHBondContact O-N 3.3Å; V630-A640 HydrophobicContact CB-CB 4.41Å; V630-L656 HydrophobicContact CB-CD2 4.08Å; V630-L656 HydrophobicContact CG1-CD2 3.66Å; V630-L656 HydrophobicContact CG2-CD2 4.5Å; V630-V662 HydrophobicContact CG2-CG2 3.5Å; V630-V662 VanDerWaalsContact CG2-CG2 3.5Å
631	Q	85.6	Confident	91.1	Very high	52 Å²	52	51 Å²	51	24%	0.243	25%	0.251	C	S	.	.			trans	-94.8	-4.4	175.8	-65.7	-58.6	-67.2	0	0	113	D629 K633	D629-Q631 WeakPolarHBondContact OD1-CB 3.19Å; D629-Q631 PolarHBondContact OD1-N 2.78Å; Q631-K633 PolarHBondContact O-N 3.39Å
632	V	89	Confident	91.2	Very high	33 Å²	33	45.3 Å²	45.3	20%	0.2	23%	0.229	C	C	.	.			trans	-53.1	131.7	170.5	-179	0	0	0	0	108.6	T600 T606 H609 D629	T600-V632 HydrophobicContact CG2-CG1 4.38Å; T606-V632 HydrophobicContact CG2-CB 3.9Å; T606-V632 HydrophobicContact CG2-CG1 3.66Å; T606-V632 HydrophobicContact CG2-CG2 4.18Å; H609-V632 PolarHBondContact CE1-O 2.95Å; H609-V632 PolarHBondContact NE2-O 2.91Å; D629-V632 HydrophobicContact CB-CG2 3.85Å
633	K	90.9	Very high	91.2	Very high	116 Å²	116	46.2 Å²	46.2	50%	0.504	23%	0.233	S	C	.	.			trans	-99.8	116.4	-179.8	-72.8	-178.3	-178.2	-175.1	0	108.3	Q631 N637 T639	Q631-K633 PolarHBondContact O-N 3.39Å; K633-N637 HydrophobicContact CD-CB 4.06Å; K633-T639 HydrophobicContact CG-CG2 4.16Å
634	G	89.7	Confident	91.2	Very high	8 Å²	8	46.2 Å²	46.2	8%	0.082	23%	0.233	C	C	.	.			trans	-77.6	-163	169	0	0	0	0	0	112	G604 N636 N637 W638	G604-G634 WeakPolarHBondContact O-CA 3.46Å; G634-N636 PolarHBondContact O-N 3.39Å; G634-N637 WeakPolarHBondContact O-CA 3.45Å; G634-N637 PolarHBondContact O-N 2.95Å; G634-N637 VanDerWaalsContact O-N 3.07Å; G634-W638 PolarHBondContact N-O 3.44Å
635	K	89.7	Confident	91.4	Very high	121 Å²	121	45.1 Å²	45.1	53%	0.526	23%	0.227	S	C	.	.	G	3₁₀ helix	trans	-52.4	142.6	175	-172.6	170.3	-176.8	176.6	0	111.3	Q603 N637 W638	Q603-K635 WeakPolarHBondContact O-CB 3.32Å; Q603-K635 PolarHBondContact O-N 3.31Å; K635-N637 PolarHBondContact O-N 2.93Å; K635-W638 PolarHBondContact O-N 3.4Å
636	N	90.4	Very high	91.6	Very high	82 Å²	82	44 Å²	44	44%	0.439	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	57.5	25.7	-176.6	-58.4	-10.3	0	0	0	114	G634 W638 T668 T669	G634-N636 PolarHBondContact O-N 3.39Å; N636-W638 PolarHBondContact O-N 3Å; N636-T668 WeakPolarHBondContact O-CA 3.29Å; N636-T668 WeakPolarHBondContact O-CB 3.36Å; N636-T669 HydrophobicContact CB-CG2 4.28Å; N636-T669 WeakPolarHBondContact CB-OG1 3.18Å; N636-T669 PolarHBondContact O-N 2.83Å; N636-T669 PolarHBondContact O-OG1 2.87Å
637	N	92.9	Very high	91.7	Very high	66 Å²	66	42.8 Å²	42.8	35%	0.353	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	59.4	27.1	-176.6	-66.5	-36.3	0	0	0	114.5	K633 G634 K635 T669	K633-N637 HydrophobicContact CD-CB 4.06Å; G634-N637 WeakPolarHBondContact O-CA 3.45Å; G634-N637 PolarHBondContact O-N 2.95Å; G634-N637 VanDerWaalsContact O-N 3.07Å; K635-N637 PolarHBondContact O-N 2.93Å; N637-T669 HydrophobicContact CB-CG2 4.42Å
638	W	93.8	Very high	92	Very high	47 Å²	47	37.4 Å²	37.4	18%	0.178	19%	0.185	C	C	.	.			trans	-71.5	133.2	175.8	-79.6	54.3	0	0	0	110.8	H609 G634 K635 N636 H642 F643 W646 T668 L677	H609-W638 PolarHBondContact NE2-O 3.26Å; G634-W638 PolarHBondContact N-O 3.44Å; K635-W638 PolarHBondContact O-N 3.4Å; N636-W638 PolarHBondContact O-N 3Å; W638-H642 HydrophobicContact CD2-CB 4.29Å; W638-H642 HydrophobicContact CE3-CB 3.89Å; W638-H642 HydrophobicContact CZ3-CB 4.43Å; W638-F643 HydrophobicContact CB-CD2 4.45Å; W638-F643 HydrophobicContact CB-CE2 3.68Å; W638-F643 HydrophobicContact CB-CZ 4.02Å; W638-F643 HydrophobicContact CD2-CE1 4.48Å; W638-F643 HydrophobicContact CD2-CE2 4.47Å; W638-F643 HydrophobicContact CD2-CZ 4.23Å; W638-F643 AromaticContact CE3-CD1 3.78Å; W638-F643 HydrophobicContact CE3-CD1 3.78Å; W638-F643 HydrophobicContact CE3-CD2 4.05Å; W638-F643 AromaticContact CE3-CE1 3.62Å; W638-F643 HydrophobicContact CE3-CE1 3.62Å; W638-F643 AromaticContact CE3-CE2 3.92Å; W638-F643 HydrophobicContact CE3-CE2 3.92Å; W638-F643 AromaticContact CE3-CG 4Å; W638-F643 HydrophobicContact CE3-CG 4Å; W638-F643 AromaticContact CE3-CZ 3.7Å; W638-F643 HydrophobicContact CE3-CZ 3.7Å; W638-F643 HydrophobicContact CG-CE2 4.43Å; W638-F643 HydrophobicContact CG-CZ 4.39Å; W638-F643 AromaticContact CZ3-CD1 3.95Å; W638-F643 HydrophobicContact CZ3-CD1 3.95Å; W638-F643 HydrophobicContact CZ3-CE1 4.02Å; W638-F643 HydrophobicContact CZ3-CG 4.41Å; W638-W646 HydrophobicContact CH2-CD2 4.3Å; W638-W646 HydrophobicContact CH2-CE3 4.46Å; W638-W646 HydrophobicContact CH2-CG 4.34Å; W638-W646 HydrophobicContact CZ3-CB 4.29Å; W638-W646 HydrophobicContact CZ3-CG 4.44Å; W638-T668 HydrophobicContact CD2-CG2 4.5Å; W638-T668 HydrophobicContact CG-CG2 4.22Å; W638-L677 HydrophobicContact CE3-CD1 4.48Å; W638-L677 HydrophobicContact CH2-CD1 3.82Å; W638-L677 HydrophobicContact CH2-CD2 4.44Å; W638-L677 HydrophobicContact CZ2-CD1 4.14Å; W638-L677 HydrophobicContact CZ2-CD2 4.42Å; W638-L677 HydrophobicContact CZ3-CD1 4Å
639	T	94	Very high	92.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.194	C	C	.	.			trans	-104.6	166.9	173.5	68.4	0	0	0	0	110.6	H609 K633 L641 H642 F643	H609-T639 VanDerWaalsContact CD2-C 3.44Å; H609-T639 WeakPolarHBondContact NE2-CA 3.42Å; K633-T639 HydrophobicContact CG-CG2 4.16Å; T639-L641 PolarHBondContact O-N 3.39Å; T639-H642 PolarHBondContact N-ND1 3.22Å; T639-H642 WeakPolarHBondContact O-CB 3.26Å; T639-H642 PolarHBondContact O-N 2.98Å; T639-H642 PolarHBondContact OG1-ND1 3.39Å; T639-F643 WeakPolarHBondContact O-CD2 3.46Å; T639-F643 PolarHBondContact O-N 2.89Å
640	A	93.9	Very high	92.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-55.4	-35.5	176.8	0	0	0	0	0	112.7	H609 C612 V630 H642 F643 A644 L656	H609-A640 PolarHBondContact CD2-N 2.88Å; H609-A640 VanDerWaalsContact CD2-N 3.27Å; H609-A640 PolarHBondContact NE2-N 3.12Å; C612-A640 HydrophobicContact CB-CB 4.44Å; C612-A640 WeakPolarHBondContact CB-O 3.5Å; V630-A640 HydrophobicContact CB-CB 4.41Å; A640-H642 PolarHBondContact O-N 3.34Å; A640-F643 PolarHBondContact O-N 3.5Å; A640-A644 PolarHBondContact O-N 3.24Å; A640-A644 VanDerWaalsContact O-N 3.08Å; A640-L656 HydrophobicContact CB-CD1 4.24Å
641	L	95.1	Very high	92.9	Very high	3 Å²	3	38.5 Å²	38.5	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-65.1	-37.6	176.9	-174.8	62.7	0	0	0	112.4	T639 A644 A645 V653 L656 V657 V662 V664 A674 L690	T639-L641 PolarHBondContact O-N 3.39Å; L641-A644 PolarHBondContact O-N 2.93Å; L641-A645 VanDerWaalsContact O-CB 3.24Å; L641-A645 WeakPolarHBondContact O-CB 3.29Å; L641-A645 PolarHBondContact O-N 2.71Å; L641-V653 HydrophobicContact CD1-CB 4.47Å; L641-V653 HydrophobicContact CD1-CG1 4.09Å; L641-V653 HydrophobicContact CD1-CG2 4.32Å; L641-L656 HydrophobicContact CB-CD1 4.3Å; L641-L656 HydrophobicContact CD1-CB 4.27Å; L641-L656 HydrophobicContact CD1-CD1 4.24Å; L641-V657 HydrophobicContact CD1-CG2 3.78Å; L641-V657 HydrophobicContact CD2-CG2 4.1Å; L641-V662 HydrophobicContact CD2-CG1 4.42Å; L641-V664 HydrophobicContact CD2-CG1 4.34Å; L641-A674 HydrophobicContact CD2-CB 4.06Å; L641-A674 HydrophobicContact CG-CB 3.87Å; L641-L690 HydrophobicContact CD1-CD2 4.23Å; L641-L690 HydrophobicContact CD2-CD2 4.44Å
642	H	95.6	Very high	93.3	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-62.2	-45.3	176.5	-70.7	101.6	0	0	0	111.6	W638 T639 A640 A645 W646 S666 R672 A674 L677	W638-H642 HydrophobicContact CD2-CB 4.29Å; W638-H642 HydrophobicContact CE3-CB 3.89Å; W638-H642 HydrophobicContact CZ3-CB 4.43Å; T639-H642 PolarHBondContact N-ND1 3.22Å; T639-H642 WeakPolarHBondContact O-CB 3.26Å; T639-H642 PolarHBondContact O-N 2.98Å; T639-H642 PolarHBondContact OG1-ND1 3.39Å; A640-H642 PolarHBondContact O-N 3.34Å; H642-A645 PolarHBondContact O-N 3.43Å; H642-W646 VanDerWaalsContact O-CB 3.31Å; H642-W646 WeakPolarHBondContact O-CB 3.21Å; H642-W646 PolarHBondContact O-N 2.93Å; H642-S666 PolarHBondContact CE1-O 3.4Å; H642-S666 PolarHBondContact CE1-OG 2.87Å; H642-S666 PolarHBondContact NE2-O 3.32Å; H642-R672 PolarHBondContact NE2-O 3.41Å; H642-A674 PolarHBondContact CD2-N 2.94Å; H642-A674 PolarHBondContact NE2-N 3.1Å; H642-L677 HydrophobicContact CB-CD1 3.64Å
643	F	94.9	Very high	93.6	Very high	26 Å²	26	34.6 Å²	34.6	11%	0.114	17%	0.172	C	C	.	.	H	α-helix	trans	-63.4	-45.8	176.4	-73	-76.1	0	0	0	112.1	R605 H609 C612 Q613 W638 T639 A640 A645 W646 Q647	R605-F643 HydrophobicContact CG-CZ 4.32Å; H609-F643 HydrophobicContact CB-CD2 4.21Å; H609-F643 HydrophobicContact CB-CE2 4.23Å; H609-F643 AromaticContact CD2-CD2 3.7Å; H609-F643 AromaticContact CD2-CE2 3.64Å; C612-F643 HydrophobicContact CB-CB 4.27Å; Q613-F643 HydrophobicContact CB-CB 4.29Å; Q613-F643 HydrophobicContact CB-CD1 4.12Å; Q613-F643 HydrophobicContact CB-CG 4.4Å; Q613-F643 HydrophobicContact CG-CD1 4.26Å; W638-F643 HydrophobicContact CB-CD2 4.45Å; W638-F643 HydrophobicContact CB-CE2 3.68Å; W638-F643 HydrophobicContact CB-CZ 4.02Å; W638-F643 HydrophobicContact CD2-CE1 4.48Å; W638-F643 HydrophobicContact CD2-CE2 4.47Å; W638-F643 HydrophobicContact CD2-CZ 4.23Å; W638-F643 AromaticContact CE3-CD1 3.78Å; W638-F643 HydrophobicContact CE3-CD1 3.78Å; W638-F643 HydrophobicContact CE3-CD2 4.05Å; W638-F643 AromaticContact CE3-CE1 3.62Å; W638-F643 HydrophobicContact CE3-CE1 3.62Å; W638-F643 AromaticContact CE3-CE2 3.92Å; W638-F643 HydrophobicContact CE3-CE2 3.92Å; W638-F643 AromaticContact CE3-CG 4Å; W638-F643 HydrophobicContact CE3-CG 4Å; W638-F643 AromaticContact CE3-CZ 3.7Å; W638-F643 HydrophobicContact CE3-CZ 3.7Å; W638-F643 HydrophobicContact CG-CE2 4.43Å; W638-F643 HydrophobicContact CG-CZ 4.39Å; W638-F643 AromaticContact CZ3-CD1 3.95Å; W638-F643 HydrophobicContact CZ3-CD1 3.95Å; W638-F643 HydrophobicContact CZ3-CE1 4.02Å; W638-F643 HydrophobicContact CZ3-CG 4.41Å; T639-F643 WeakPolarHBondContact O-CD2 3.46Å; T639-F643 PolarHBondContact O-N 2.89Å; A640-F643 PolarHBondContact O-N 3.5Å; F643-A645 VanDerWaalsContact C-N 3.3Å; F643-A645 PolarHBondContact O-N 2.98Å; F643-W646 PolarHBondContact O-N 2.57Å; F643-Q647 WeakPolarHBondContact O-CG 3.38Å; F643-Q647 PolarHBondContact O-N 3.14Å; F643-Q647 VanDerWaalsContact O-N 3.12Å
644	A	95.6	Very high	93.7	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-61.6	-39.8	177.9	0	0	0	0	0	111.8	C612 A640 L641 G648 H649 I652 V653 L656	C612-A644 HydrophobicContact CB-CB 4.2Å; A640-A644 PolarHBondContact O-N 3.24Å; A640-A644 VanDerWaalsContact O-N 3.08Å; L641-A644 PolarHBondContact O-N 2.93Å; A644-G648 PolarHBondContact O-N 3.43Å; A644-G648 VanDerWaalsContact O-N 3.12Å; A644-H649 PolarHBondContact O-N 3.02Å; A644-I652 HydrophobicContact CB-CB 4.28Å; A644-I652 HydrophobicContact CB-CG2 3.75Å; A644-V653 HydrophobicContact CB-CG2 3.79Å; A644-L656 HydrophobicContact CB-CD1 4.22Å
645	A	95.6	Very high	93.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-70.4	-42.5	179.2	0	0	0	0	0	113	L641 H642 F643 Q647 G648 A674 A678 V686 L690	L641-A645 VanDerWaalsContact O-CB 3.24Å; L641-A645 WeakPolarHBondContact O-CB 3.29Å; L641-A645 PolarHBondContact O-N 2.71Å; H642-A645 PolarHBondContact O-N 3.43Å; F643-A645 VanDerWaalsContact C-N 3.3Å; F643-A645 PolarHBondContact O-N 2.98Å; A645-Q647 VanDerWaalsContact C-N 3.32Å; A645-Q647 PolarHBondContact O-N 3.11Å; A645-G648 PolarHBondContact O-N 2.82Å; A645-A674 HydrophobicContact CB-CB 3.9Å; A645-A674 WeakPolarHBondContact CB-O 3.46Å; A645-A678 HydrophobicContact CB-CB 4.4Å; A645-V686 HydrophobicContact CB-CG1 4.18Å; A645-L690 HydrophobicContact CB-CD1 4.28Å
646	W	95.1	Very high	93.9	Very high	59 Å²	59	28.6 Å²	28.6	22%	0.223	15%	0.145	C	C	.	.	H	α-helix	trans	-60.8	-39.6	176.8	179.4	-97.7	0	0	0	112.8	W638 H642 F643 L677 Q680 R681	W638-W646 HydrophobicContact CH2-CD2 4.3Å; W638-W646 HydrophobicContact CH2-CE3 4.46Å; W638-W646 HydrophobicContact CH2-CG 4.34Å; W638-W646 HydrophobicContact CZ3-CB 4.29Å; W638-W646 HydrophobicContact CZ3-CG 4.44Å; H642-W646 VanDerWaalsContact O-CB 3.31Å; H642-W646 WeakPolarHBondContact O-CB 3.21Å; H642-W646 PolarHBondContact O-N 2.93Å; F643-W646 PolarHBondContact O-N 2.57Å; W646-L677 HydrophobicContact CE3-CB 3.99Å; W646-L677 HydrophobicContact CE3-CD2 3.89Å; W646-L677 HydrophobicContact CE3-CG 4.38Å; W646-L677 HydrophobicContact CZ3-CD2 4.08Å; W646-Q680 HydrophobicContact CZ3-CB 4.25Å; W646-Q680 HydrophobicContact CZ3-CG 4.25Å; W646-R681 HydrophobicContact CD2-CG 3.73Å; W646-R681 HydrophobicContact CE3-CG 3.61Å; W646-R681 HydrophobicContact CG-CG 4.4Å; W646-R681 HydrophobicContact CH2-CG 4.02Å; W646-R681 HydrophobicContact CZ2-CG 4.1Å; W646-R681 HydrophobicContact CZ3-CG 3.77Å
647	Q	94.1	Very high	93.8	Very high	67 Å²	67	25.6 Å²	25.6	31%	0.313	13%	0.13	S	C	.	.	H	α-helix	trans	-87.3	-11.9	-177.8	-61.7	-67.1	-1	0	0	113.7	Q613 F643 A645 H649	Q613-Q647 WeakPolarHBondContact O-CG 3.31Å; F643-Q647 WeakPolarHBondContact O-CG 3.38Å; F643-Q647 PolarHBondContact O-N 3.14Å; F643-Q647 VanDerWaalsContact O-N 3.12Å; A645-Q647 VanDerWaalsContact C-N 3.32Å; A645-Q647 PolarHBondContact O-N 3.11Å; Q647-H649 WeakPolarHBondContact CB-CD2 3.17Å; Q647-H649 WeakPolarHBondContact CB-NE2 3.5Å
648	G	93.1	Very high	93.5	Very high	19 Å²	19	30.1 Å²	30.1	20%	0.196	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.3	16.7	177.5	0	0	0	0	0	115	A644 A645 L650 Q683	A644-G648 PolarHBondContact O-N 3.43Å; A644-G648 VanDerWaalsContact O-N 3.12Å; A645-G648 PolarHBondContact O-N 2.82Å; G648-L650 PolarHBondContact O-N 3.31Å; G648-Q683 VanDerWaalsContact CA-CD 3.47Å
649	H	95.1	Very high	93.1	Very high	53 Å²	53	31.2 Å²	31.2	25%	0.245	15%	0.154	C	C	.	.			trans	-78.4	81.1	-173.8	-64.3	-47.5	0	0	0	112.3	C612 Q613 G615 A644 Q647 G651 I652 V653	C612-H649 PolarHBondContact O-CD2 3.08Å; Q613-H649 PolarHBondContact O-NE2 2.99Å; G615-H649 VanDerWaalsContact CA-CD2 3.43Å; G615-H649 WeakPolarHBondContact CA-CD2 3.41Å; G615-H649 VanDerWaalsContact CA-CE1 3.46Å; G615-H649 WeakPolarHBondContact CA-CE1 3.3Å; G615-H649 VanDerWaalsContact CA-NE2 3.34Å; G615-H649 WeakPolarHBondContact CA-NE2 3.44Å; G615-H649 PolarHBondContact N-NE2 3.05Å; A644-H649 PolarHBondContact O-N 3.02Å; Q647-H649 WeakPolarHBondContact CB-CD2 3.17Å; Q647-H649 WeakPolarHBondContact CB-NE2 3.5Å; H649-G651 PolarHBondContact O-N 2.89Å; H649-I652 HydrophobicContact CB-CB 4.2Å; H649-I652 HydrophobicContact CB-CD1 4.1Å; H649-I652 HydrophobicContact CB-CG1 4.32Å; H649-I652 PolarHBondContact O-N 3.44Å; H649-V653 WeakPolarHBondContact O-CG2 3.49Å; H649-V653 PolarHBondContact O-N 2.95Å
650	L	93	Very high	92.1	Very high	33 Å²	33	35.8 Å²	35.8	17%	0.173	19%	0.191	C	C	.	.	H	α-helix	trans	-57.3	-41.6	-172.3	179	62.9	0	0	0	114.4	G648 I652 V653 K654 R685 V686 I689	G648-L650 PolarHBondContact O-N 3.31Å; L650-I652 VanDerWaalsContact C-N 3.34Å; L650-V653 PolarHBondContact O-N 3.26Å; L650-K654 WeakPolarHBondContact O-CG 3.46Å; L650-K654 PolarHBondContact O-N 3.2Å; L650-K654 VanDerWaalsContact O-N 3.12Å; L650-R685 HydrophobicContact CD2-CB 4.3Å; L650-V686 HydrophobicContact CB-CG2 4.31Å; L650-V686 HydrophobicContact CD1-CG2 4.38Å; L650-I689 HydrophobicContact CD1-CB 3.89Å; L650-I689 HydrophobicContact CD1-CG1 3.84Å; L650-I689 HydrophobicContact CD1-CG2 4.1Å
651	G	93.1	Very high	91	Very high	23 Å²	23	39.2 Å²	39.2	24%	0.237	23%	0.227	C	C	.	.	H	α-helix	trans	-61	-44.7	-180	0	0	0	0	0	111.8	E617 H649 K654 L655	E617-G651 WeakPolarHBondContact OE2-CA 3.41Å; H649-G651 PolarHBondContact O-N 2.89Å; G651-K654 PolarHBondContact O-N 3.47Å; G651-L655 WeakPolarHBondContact O-CG 3.49Å; G651-L655 PolarHBondContact O-N 2.84Å; G651-L655 VanDerWaalsContact O-N 3.17Å
652	I	94.7	Very high	90.6	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.015	23%	0.233	C	C	.	.	H	α-helix	trans	-65.6	-45.5	177.7	-62.7	-178.8	0	0	0	111.3	C612 G615 E617 I620 A644 H649 L650 K654 L655 L656	C612-I652 HydrophobicContact CB-CG2 4.32Å; C612-I652 WeakPolarHBondContact SG-CG2 3.28Å; G615-I652 VanDerWaalsContact C-CD1 3.49Å; E617-I652 HydrophobicContact CB-CG1 4.18Å; E617-I652 HydrophobicContact CG-CG1 4.38Å; I620-I652 HydrophobicContact CG1-CD1 4.24Å; I620-I652 HydrophobicContact CG1-CG2 4.33Å; A644-I652 HydrophobicContact CB-CB 4.28Å; A644-I652 HydrophobicContact CB-CG2 3.75Å; H649-I652 HydrophobicContact CB-CB 4.2Å; H649-I652 HydrophobicContact CB-CD1 4.1Å; H649-I652 HydrophobicContact CB-CG1 4.32Å; H649-I652 PolarHBondContact O-N 3.44Å; L650-I652 VanDerWaalsContact C-N 3.34Å; I652-K654 VanDerWaalsContact C-N 3.28Å; I652-K654 PolarHBondContact O-N 3.17Å; I652-L655 WeakPolarHBondContact O-CB 3.39Å; I652-L655 PolarHBondContact O-N 2.94Å; I652-L656 HydrophobicContact CG2-CD1 3.78Å; I652-L656 HydrophobicContact CG2-CG 4.02Å; I652-L656 WeakPolarHBondContact O-CG 3.4Å; I652-L656 PolarHBondContact O-N 3.24Å
653	V	94.8	Very high	90.2	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-56	-44.8	177.6	171.1	0	0	0	0	111.1	L641 A644 H649 L650 L655 L656 V657 V686 I689 L690	L641-V653 HydrophobicContact CD1-CB 4.47Å; L641-V653 HydrophobicContact CD1-CG1 4.09Å; L641-V653 HydrophobicContact CD1-CG2 4.32Å; A644-V653 HydrophobicContact CB-CG2 3.79Å; H649-V653 WeakPolarHBondContact O-CG2 3.49Å; H649-V653 PolarHBondContact O-N 2.95Å; L650-V653 PolarHBondContact O-N 3.26Å; V653-L655 VanDerWaalsContact C-N 3.3Å; V653-L655 PolarHBondContact O-N 3.41Å; V653-L656 PolarHBondContact O-N 3.01Å; V653-V657 HydrophobicContact CG1-CG2 4.29Å; V653-V657 VanDerWaalsContact O-CG2 3.31Å; V653-V657 WeakPolarHBondContact O-CG2 3.04Å; V653-V657 PolarHBondContact O-N 3Å; V653-V686 HydrophobicContact CG1-CG1 4.37Å; V653-V686 HydrophobicContact CG2-CG1 3.96Å; V653-I689 HydrophobicContact CG1-CG2 4.4Å; V653-L690 HydrophobicContact CG1-CD2 3.7Å; V653-L690 HydrophobicContact CG1-CG 4.09Å
654	K	93.1	Very high	90	Very high	84 Å²	84	43.8 Å²	43.8	37%	0.365	25%	0.254	S	S	.	.	H	α-helix	trans	-62.4	-35.7	176.6	-72.3	177.4	179	-177.7	0	113	L650 G651 I652 K658 I689	L650-K654 WeakPolarHBondContact O-CG 3.46Å; L650-K654 PolarHBondContact O-N 3.2Å; L650-K654 VanDerWaalsContact O-N 3.12Å; G651-K654 PolarHBondContact O-N 3.47Å; I652-K654 VanDerWaalsContact C-N 3.28Å; I652-K654 PolarHBondContact O-N 3.17Å; K654-K658 WeakPolarHBondContact O-CB 3.25Å; K654-K658 WeakPolarHBondContact O-CD 3.37Å; K654-K658 WeakPolarHBondContact O-CG 3.17Å; K654-I689 HydrophobicContact CG-CG2 3.8Å
655	L	92.2	Very high	89.9	Confident	33 Å²	33	45.8 Å²	45.8	17%	0.173	27%	0.265	C	S	.	.	H	α-helix	trans	-72.1	-45.8	178.6	-69.3	171.6	0	0	0	111.5	E617 R621 L624 G651 I652 V653 K658	E617-L655 HydrophobicContact CG-CD1 3.57Å; R621-L655 HydrophobicContact CG-CD1 3.69Å; L624-L655 HydrophobicContact CD1-CB 4.3Å; G651-L655 WeakPolarHBondContact O-CG 3.49Å; G651-L655 PolarHBondContact O-N 2.84Å; G651-L655 VanDerWaalsContact O-N 3.17Å; I652-L655 WeakPolarHBondContact O-CB 3.39Å; I652-L655 PolarHBondContact O-N 2.94Å; V653-L655 VanDerWaalsContact C-N 3.3Å; V653-L655 PolarHBondContact O-N 3.41Å; L655-K658 PolarHBondContact O-N 3.42Å
656	L	91.8	Very high	89.8	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.01	27%	0.267	C	S	.	.	H	α-helix	trans	-64.5	-47.9	-178.6	-67.9	177.6	0	0	0	111.9	I620 V630 A640 L641 A644 I652 V653 K658 Q659 V662	I620-L656 HydrophobicContact CG2-CD2 4.38Å; V630-L656 HydrophobicContact CB-CD2 4.08Å; V630-L656 HydrophobicContact CG1-CD2 3.66Å; V630-L656 HydrophobicContact CG2-CD2 4.5Å; A640-L656 HydrophobicContact CB-CD1 4.24Å; L641-L656 HydrophobicContact CB-CD1 4.3Å; L641-L656 HydrophobicContact CD1-CB 4.27Å; L641-L656 HydrophobicContact CD1-CD1 4.24Å; A644-L656 HydrophobicContact CB-CD1 4.22Å; I652-L656 HydrophobicContact CG2-CD1 3.78Å; I652-L656 HydrophobicContact CG2-CG 4.02Å; I652-L656 WeakPolarHBondContact O-CG 3.4Å; I652-L656 PolarHBondContact O-N 3.24Å; V653-L656 PolarHBondContact O-N 3.01Å; L656-K658 PolarHBondContact O-N 3.4Å; L656-Q659 VanDerWaalsContact O-CB 3.27Å; L656-Q659 WeakPolarHBondContact O-CB 3.42Å; L656-Q659 PolarHBondContact O-N 3.14Å; L656-V662 WeakPolarHBondContact O-CG2 3.47Å
657	V	88.5	Confident	89.7	Confident	20 Å²	20	47.2 Å²	47.2	12%	0.121	28%	0.275	C	S	.	.	H	α-helix	trans	-68.7	-25.8	-176.5	177.6	0	0	0	0	112.3	L641 V653 Q659 V664 L690 L693	L641-V657 HydrophobicContact CD1-CG2 3.78Å; L641-V657 HydrophobicContact CD2-CG2 4.1Å; V653-V657 HydrophobicContact CG1-CG2 4.29Å; V653-V657 VanDerWaalsContact O-CG2 3.31Å; V653-V657 WeakPolarHBondContact O-CG2 3.04Å; V653-V657 PolarHBondContact O-N 3Å; V657-Q659 PolarHBondContact O-N 3.3Å; V657-V664 HydrophobicContact CB-CG2 4.48Å; V657-V664 HydrophobicContact CG1-CG2 3.62Å; V657-V664 HydrophobicContact CG2-CG2 4.2Å; V657-L690 HydrophobicContact CG2-CD2 4.24Å; V657-L693 HydrophobicContact CB-CD1 3.81Å; V657-L693 HydrophobicContact CG1-CB 3.54Å; V657-L693 HydrophobicContact CG1-CD1 3.7Å; V657-L693 HydrophobicContact CG1-CG 4.18Å; V657-L693 HydrophobicContact CG2-CD1 4.43Å
658	K	86.4	Confident	89.8	Confident	160 Å²	160	44.4 Å²	44.4	70%	0.696	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-15.1	173.3	-77.1	180	-179.6	-171.1	0	113.5	K654 L655 L656	K654-K658 WeakPolarHBondContact O-CB 3.25Å; K654-K658 WeakPolarHBondContact O-CD 3.37Å; K654-K658 WeakPolarHBondContact O-CG 3.17Å; L655-K658 PolarHBondContact O-N 3.42Å; L656-K658 PolarHBondContact O-N 3.4Å
659	Q	85.5	Confident	89.8	Confident	70 Å²	70	46.9 Å²	46.9	33%	0.327	27%	0.274	S	S	.	.	S	Bend	trans	-73.8	134.7	-179.2	-170.6	68.5	-16.4	0	0	110.4	L624 L656 V657 G661 V662	L624-Q659 HydrophobicContact CD2-CG 4.26Å; L656-Q659 VanDerWaalsContact O-CB 3.27Å; L656-Q659 WeakPolarHBondContact O-CB 3.42Å; L656-Q659 PolarHBondContact O-N 3.14Å; V657-Q659 PolarHBondContact O-N 3.3Å; Q659-G661 PolarHBondContact O-N 3.45Å; Q659-V662 HydrophobicContact CB-CG2 3.93Å; Q659-V662 HydrophobicContact CG-CG2 4.45Å; Q659-V662 PolarHBondContact O-N 3.08Å
660	A	72.3	Confident	89.6	Confident	96 Å²	96	48 Å²	48	79%	0.793	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	132.2	179.5	0	0	0	0	0	111
661	G	72.1	Confident	89.6	Confident	73 Å²	73	46.9 Å²	46.9	75%	0.753	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	88	2.6	176.9	0	0	0	0	0	115.9	Q659 N663	Q659-G661 PolarHBondContact O-N 3.45Å; G661-N663 PolarHBondContact O-N 3.49Å
662	V	85.6	Confident	89.7	Confident	23 Å²	23	48.3 Å²	48.3	14%	0.139	28%	0.276	C	S	.	.			trans	-76.7	119.6	176.1	172	0	0	0	0	111.2	V630 L641 L656 Q659 V664	V630-V662 HydrophobicContact CG2-CG2 3.5Å; V630-V662 VanDerWaalsContact CG2-CG2 3.5Å; L641-V662 HydrophobicContact CD2-CG1 4.42Å; L656-V662 WeakPolarHBondContact O-CG2 3.47Å; Q659-V662 HydrophobicContact CB-CG2 3.93Å; Q659-V662 HydrophobicContact CG-CG2 4.45Å; Q659-V662 PolarHBondContact O-N 3.08Å; V662-V664 PolarHBondContact O-N 3.45Å
663	N	88	Confident	89.8	Confident	84 Å²	84	48.2 Å²	48.2	45%	0.449	28%	0.276	S	S	.	.			trans	-83.9	105	171.3	-175.5	3.9	0	0	0	110.6	G661 D665 S666	G661-N663 PolarHBondContact O-N 3.49Å; N663-D665 PolarHBondContact O-N 3.31Å; N663-D665 PolarHBondContact OD1-N 3.24Å; N663-S666 WeakPolarHBondContact O-CB 3.41Å; N663-S666 PolarHBondContact O-N 2.95Å; N663-S666 PolarHBondContact O-OG 3.11Å; N663-S666 PolarHBondContact OD1-N 2.93Å
664	V	91.1	Very high	89.8	Confident	17 Å²	17	48.2 Å²	48.2	10%	0.103	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-32.5	178.9	-173.8	0	0	0	0	111.8	L641 V657 V662 S666 L690 A695	L641-V664 HydrophobicContact CD2-CG1 4.34Å; V657-V664 HydrophobicContact CB-CG2 4.48Å; V657-V664 HydrophobicContact CG1-CG2 3.62Å; V657-V664 HydrophobicContact CG2-CG2 4.2Å; V662-V664 PolarHBondContact O-N 3.45Å; V664-S666 VanDerWaalsContact C-N 3.31Å; V664-S666 PolarHBondContact O-N 3.3Å; V664-L690 HydrophobicContact CG1-CD2 4.05Å; V664-A695 HydrophobicContact CG1-CB 3.63Å
665	D	92.4	Very high	90	Very high	42 Å²	42	44.3 Å²	44.3	23%	0.225	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	20.6	-179.5	-58.7	-44.9	0	0	0	112.5	N663 Q667 T673 D696 V699	N663-D665 PolarHBondContact O-N 3.31Å; N663-D665 PolarHBondContact OD1-N 3.24Å; D665-Q667 PolarHBondContact O-N 3.24Å; D665-T673 HydrophobicContact CB-CG2 4.48Å; D665-D696 PolarHBondContact OD1-N 3.02Å; D665-D696 PolarHBondContact OD2-N 2.68Å; D665-V699 HydrophobicContact CB-CG2 4.36Å
666	S	93.3	Very high	90.3	Very high	8 Å²	8	42.9 Å²	42.9	6%	0.056	25%	0.251	C	S	.	.			trans	-55.5	137.7	168.4	53.4	0	0	0	0	110.2	H642 N663 V664 T673	H642-S666 PolarHBondContact CE1-O 3.4Å; H642-S666 PolarHBondContact CE1-OG 2.87Å; H642-S666 PolarHBondContact NE2-O 3.32Å; N663-S666 WeakPolarHBondContact O-CB 3.41Å; N663-S666 PolarHBondContact O-N 2.95Å; N663-S666 PolarHBondContact O-OG 3.11Å; N663-S666 PolarHBondContact OD1-N 2.93Å; V664-S666 VanDerWaalsContact C-N 3.31Å; V664-S666 PolarHBondContact O-N 3.3Å; S666-T673 WeakPolarHBondContact O-CA 3.47Å
667	Q	94.4	Very high	90.5	Very high	82 Å²	82	42.9 Å²	42.9	38%	0.383	25%	0.251	S	S	.	.			trans	-109.5	141.1	-176.5	-68	-179	-56.7	0	0	111.4	D665 G671 R672 T673 V699 K700	D665-Q667 PolarHBondContact O-N 3.24Å; Q667-G671 PolarHBondContact NE2-O 3.49Å; Q667-R672 WeakPolarHBondContact CA-O 3.49Å; Q667-T673 HydrophobicContact CG-CG2 3.88Å; Q667-V699 HydrophobicContact CG-CG1 4.45Å; Q667-K700 PolarHBondContact NE2-O 3.13Å
668	T	94.9	Very high	90.9	Very high	7 Å²	7	42 Å²	42	4%	0.043	25%	0.245	C	C	.	.			trans	-70.1	176.1	165.6	66.9	0	0	0	0	111	N636 W638 D670 G671 R672	N636-T668 WeakPolarHBondContact O-CA 3.29Å; N636-T668 WeakPolarHBondContact O-CB 3.36Å; W638-T668 HydrophobicContact CD2-CG2 4.5Å; W638-T668 HydrophobicContact CG-CG2 4.22Å; T668-D670 PolarHBondContact O-N 3.43Å; T668-D670 PolarHBondContact OG1-N 3.43Å; T668-G671 PolarHBondContact O-N 3.47Å; T668-R672 PolarHBondContact N-O 3.39Å; T668-R672 PolarHBondContact OG1-N 3.24Å; T668-R672 PolarHBondContact OG1-O 2.92Å
669	T	93.3	Very high	91.3	Very high	72 Å²	72	34.3 Å²	34.3	44%	0.442	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-32.6	172.9	46.4	0	0	0	0	113.3	N636 N637 G671	N636-T669 HydrophobicContact CB-CG2 4.28Å; N636-T669 WeakPolarHBondContact CB-OG1 3.18Å; N636-T669 PolarHBondContact O-N 2.83Å; N636-T669 PolarHBondContact O-OG1 2.87Å; N637-T669 HydrophobicContact CB-CG2 4.42Å; T669-G671 PolarHBondContact O-N 2.82Å
670	D	91.4	Very high	91.8	Very high	76 Å²	76	33.5 Å²	33.5	41%	0.406	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	5	-178.9	-46.9	-26.7	0	0	0	111.8	T668 R672 S701 S702	T668-D670 PolarHBondContact O-N 3.43Å; T668-D670 PolarHBondContact OG1-N 3.43Å; D670-R672 VanDerWaalsContact C-N 3.28Å; D670-R672 HydrophobicContact CB-CG 4.42Å; D670-R672 PolarHBondContact O-N 2.94Å; D670-S701 WeakPolarHBondContact O-CB 3.27Å; D670-S702 VanDerWaalsContact O-CB 3.31Å; D670-S702 WeakPolarHBondContact O-CB 3.29Å; D670-S702 PolarHBondContact O-N 3.11Å; D670-S702 PolarHBondContact O-OG 3.3Å
671	G	93	Very high	92.8	Very high	9 Å²	9	34.7 Å²	34.7	9%	0.093	19%	0.192	C	C	.	.	S	Bend	trans	76.8	8.1	-176.6	0	0	0	0	0	114.2	Q667 T668 T669 S701	Q667-G671 PolarHBondContact NE2-O 3.49Å; T668-G671 PolarHBondContact O-N 3.47Å; T669-G671 PolarHBondContact O-N 2.82Å; G671-S701 WeakPolarHBondContact O-CA 3.26Å
672	R	95.3	Very high	93.8	Very high	54 Å²	54	32.3 Å²	32.3	20%	0.204	17%	0.167	C	C	.	.			trans	-82.1	134.8	-177.2	-66.8	-176.8	178.8	175.8	5.3	110.5	H642 Q667 T668 D670 H676 L677	H642-R672 PolarHBondContact NE2-O 3.41Å; Q667-R672 WeakPolarHBondContact CA-O 3.49Å; T668-R672 PolarHBondContact N-O 3.39Å; T668-R672 PolarHBondContact OG1-N 3.24Å; T668-R672 PolarHBondContact OG1-O 2.92Å; D670-R672 VanDerWaalsContact C-N 3.28Å; D670-R672 HydrophobicContact CB-CG 4.42Å; D670-R672 PolarHBondContact O-N 2.94Å; R672-H676 HydrophobicContact CB-CB 3.96Å; R672-H676 HydrophobicContact CG-CB 4.25Å; R672-L677 HydrophobicContact CB-CD2 4.32Å
673	T	96.4	Very high	94.2	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.006	17%	0.173	C	C	.	.			trans	-91.7	171.5	171.2	67.2	0	0	0	0	111.6	D665 S666 Q667 L675 H676 L677 V699	D665-T673 HydrophobicContact CB-CG2 4.48Å; S666-T673 WeakPolarHBondContact O-CA 3.47Å; Q667-T673 HydrophobicContact CG-CG2 3.88Å; T673-L675 PolarHBondContact O-N 3.1Å; T673-L675 PolarHBondContact OG1-N 2.92Å; T673-H676 PolarHBondContact N-ND1 2.98Å; T673-H676 WeakPolarHBondContact O-CB 3.42Å; T673-H676 PolarHBondContact O-N 3Å; T673-H676 PolarHBondContact OG1-ND1 3.34Å; T673-L677 PolarHBondContact O-N 3.34Å; T673-L677 VanDerWaalsContact O-N 3.14Å; T673-V699 HydrophobicContact CG2-CB 4.06Å; T673-V699 HydrophobicContact CG2-CG1 3.59Å; T673-V699 HydrophobicContact CG2-CG2 4.43Å
674	A	95.9	Very high	94.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-54.1	-34.7	172.3	0	0	0	0	0	112.9	L641 H642 A645 L677 A678 L690	L641-A674 HydrophobicContact CD2-CB 4.06Å; L641-A674 HydrophobicContact CG-CB 3.87Å; H642-A674 PolarHBondContact CD2-N 2.94Å; H642-A674 PolarHBondContact NE2-N 3.1Å; A645-A674 HydrophobicContact CB-CB 3.9Å; A645-A674 WeakPolarHBondContact CB-O 3.46Å; A674-L677 PolarHBondContact O-N 3.08Å; A674-A678 WeakPolarHBondContact O-CB 3.46Å; A674-A678 PolarHBondContact O-N 2.96Å; A674-L690 HydrophobicContact CB-CD1 4.09Å; A674-L690 HydrophobicContact CB-CD2 4.39Å
675	L	96.9	Very high	94.8	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-68	-37.5	176.5	-175.2	61.4	0	0	0	112.3	T673 S679 A687 L690 I691 A695 V697 A707 L723	T673-L675 PolarHBondContact O-N 3.1Å; T673-L675 PolarHBondContact OG1-N 2.92Å; L675-S679 VanDerWaalsContact O-CB 3.23Å; L675-S679 WeakPolarHBondContact O-CB 3.29Å; L675-S679 PolarHBondContact O-N 2.69Å; L675-S679 PolarHBondContact O-OG 3.35Å; L675-A687 HydrophobicContact CD1-CB 3.88Å; L675-L690 HydrophobicContact CD1-CB 4.39Å; L675-I691 HydrophobicContact CD1-CD1 4.2Å; L675-I691 HydrophobicContact CD1-CG1 4Å; L675-I691 HydrophobicContact CD2-CG1 4.08Å; L675-A695 HydrophobicContact CD2-CB 4.45Å; L675-V697 HydrophobicContact CD2-CG2 4.09Å; L675-A707 HydrophobicContact CD2-CB 4.15Å; L675-A707 HydrophobicContact CG-CB 3.93Å; L675-L723 HydrophobicContact CD1-CD2 4.2Å; L675-L723 HydrophobicContact CD2-CD2 3.97Å; L675-L723 HydrophobicContact CG-CD2 4.25Å
676	H	96.8	Very high	94.9	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.009	19%	0.185	C	C	.	.	H	α-helix	trans	-62.5	-45.9	173.7	-69.4	83.9	0	0	0	111	R672 T673 S679 Q680 V699 N705 T706 A707	R672-H676 HydrophobicContact CB-CB 3.96Å; R672-H676 HydrophobicContact CG-CB 4.25Å; T673-H676 PolarHBondContact N-ND1 2.98Å; T673-H676 WeakPolarHBondContact O-CB 3.42Å; T673-H676 PolarHBondContact O-N 3Å; T673-H676 PolarHBondContact OG1-ND1 3.34Å; H676-S679 WeakPolarHBondContact O-CB 3.4Å; H676-S679 PolarHBondContact O-N 3.2Å; H676-Q680 WeakPolarHBondContact O-CB 3.37Å; H676-Q680 PolarHBondContact O-N 3.25Å; H676-V699 PolarHBondContact CE1-O 3.49Å; H676-V699 PolarHBondContact NE2-O 3.45Å; H676-N705 PolarHBondContact NE2-O 2.91Å; H676-N705 VanDerWaalsContact NE2-O 3.14Å; H676-T706 VanDerWaalsContact NE2-C 3.31Å; H676-A707 PolarHBondContact CD2-N 3.27Å; H676-A707 PolarHBondContact NE2-N 3.49Å; H676-A707 VanDerWaalsContact NE2-N 3.19Å
677	L	96.6	Very high	95	Very high	3 Å²	3	39.4 Å²	39.4	2%	0.016	18%	0.182	C	C	.	.	H	α-helix	trans	-64.8	-43.5	179.5	-64.9	-171.9	0	0	0	112.3	W638 H642 W646 R672 T673 A674 S679 Q680 R681	W638-L677 HydrophobicContact CE3-CD1 4.48Å; W638-L677 HydrophobicContact CH2-CD1 3.82Å; W638-L677 HydrophobicContact CH2-CD2 4.44Å; W638-L677 HydrophobicContact CZ2-CD1 4.14Å; W638-L677 HydrophobicContact CZ2-CD2 4.42Å; W638-L677 HydrophobicContact CZ3-CD1 4Å; H642-L677 HydrophobicContact CB-CD1 3.64Å; W646-L677 HydrophobicContact CE3-CB 3.99Å; W646-L677 HydrophobicContact CE3-CD2 3.89Å; W646-L677 HydrophobicContact CE3-CG 4.38Å; W646-L677 HydrophobicContact CZ3-CD2 4.08Å; R672-L677 HydrophobicContact CB-CD2 4.32Å; T673-L677 PolarHBondContact O-N 3.34Å; T673-L677 VanDerWaalsContact O-N 3.14Å; A674-L677 PolarHBondContact O-N 3.08Å; L677-S679 VanDerWaalsContact C-N 3.28Å; L677-S679 PolarHBondContact O-N 2.97Å; L677-Q680 PolarHBondContact O-N 3.01Å; L677-R681 PolarHBondContact O-N 3.08Å
678	A	96.6	Very high	95.1	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62	-38.6	173.9	0	0	0	0	0	111.5	A645 A674 R681 G682 Q683 V686 A687 L690	A645-A678 HydrophobicContact CB-CB 4.4Å; A674-A678 WeakPolarHBondContact O-CB 3.46Å; A674-A678 PolarHBondContact O-N 2.96Å; A678-R681 PolarHBondContact O-N 3.41Å; A678-G682 PolarHBondContact O-N 3.49Å; A678-G682 VanDerWaalsContact O-N 3.13Å; A678-Q683 HydrophobicContact CB-CB 4.28Å; A678-Q683 PolarHBondContact O-N 2.92Å; A678-V686 HydrophobicContact CB-CB 4.47Å; A678-V686 HydrophobicContact CB-CG1 4.03Å; A678-A687 HydrophobicContact CB-CB 4.35Å; A678-L690 HydrophobicContact CB-CD1 4.22Å
679	S	96.1	Very high	95.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-66.9	-41.4	177.6	-62.8	0	0	0	0	112.2	L675 H676 L677 R681 G682 H716	L675-S679 VanDerWaalsContact O-CB 3.23Å; L675-S679 WeakPolarHBondContact O-CB 3.29Å; L675-S679 PolarHBondContact O-N 2.69Å; L675-S679 PolarHBondContact O-OG 3.35Å; H676-S679 WeakPolarHBondContact O-CB 3.4Å; H676-S679 PolarHBondContact O-N 3.2Å; L677-S679 VanDerWaalsContact C-N 3.28Å; L677-S679 PolarHBondContact O-N 2.97Å; S679-R681 VanDerWaalsContact C-N 3.29Å; S679-R681 PolarHBondContact O-N 3.21Å; S679-G682 PolarHBondContact O-N 3.31Å; S679-H716 PolarHBondContact O-CD2 2.9Å
680	Q	95.8	Very high	95.1	Very high	52 Å²	52	36.9 Å²	36.9	24%	0.243	16%	0.161	C	C	.	.	H	α-helix	trans	-63.1	-32.2	177.6	-164	179.3	-13.5	0	0	113.5	W646 H676 L677 V710 T714 H716	W646-Q680 HydrophobicContact CZ3-CB 4.25Å; W646-Q680 HydrophobicContact CZ3-CG 4.25Å; H676-Q680 WeakPolarHBondContact O-CB 3.37Å; H676-Q680 PolarHBondContact O-N 3.25Å; L677-Q680 PolarHBondContact O-N 3.01Å; Q680-V710 HydrophobicContact CB-CG1 3.48Å; Q680-V710 VanDerWaalsContact CB-CG1 3.48Å; Q680-V710 HydrophobicContact CG-CG1 3.81Å; Q680-T714 HydrophobicContact CG-CG2 3.99Å; Q680-H716 PolarHBondContact O-NE2 3.25Å
681	R	93.4	Very high	95.3	Very high	122 Å²	122	34.1 Å²	34.1	46%	0.46	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	1.3	-179.5	-66.5	-76.1	-82.9	173.8	-2.1	113	W646 L677 A678 S679 Q683	W646-R681 HydrophobicContact CD2-CG 3.73Å; W646-R681 HydrophobicContact CE3-CG 3.61Å; W646-R681 HydrophobicContact CG-CG 4.4Å; W646-R681 HydrophobicContact CH2-CG 4.02Å; W646-R681 HydrophobicContact CZ2-CG 4.1Å; W646-R681 HydrophobicContact CZ3-CG 3.77Å; L677-R681 PolarHBondContact O-N 3.08Å; A678-R681 PolarHBondContact O-N 3.41Å; S679-R681 VanDerWaalsContact C-N 3.29Å; S679-R681 PolarHBondContact O-N 3.21Å; R681-Q683 VanDerWaalsContact C-N 3.28Å; R681-Q683 HydrophobicContact CB-CG 3.87Å; R681-Q683 PolarHBondContact O-N 3.14Å
682	G	92.1	Very high	95.2	Very high	22 Å²	22	38.7 Å²	38.7	23%	0.227	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.4	23.2	178.3	0	0	0	0	0	114	A678 S679 Y684 H716	A678-G682 PolarHBondContact O-N 3.49Å; A678-G682 VanDerWaalsContact O-N 3.13Å; S679-G682 PolarHBondContact O-N 3.31Å; G682-Y684 PolarHBondContact O-N 3.25Å; G682-H716 WeakPolarHBondContact CA-CD2 3.49Å; G682-H716 WeakPolarHBondContact CA-NE2 3.5Å; G682-H716 PolarHBondContact N-CD2 3.02Å; G682-H716 PolarHBondContact N-NE2 2.82Å; G682-H716 VanDerWaalsContact N-NE2 3.18Å
683	Q	94.9	Very high	94.9	Very high	57 Å²	57	39.3 Å²	39.3	27%	0.266	17%	0.173	S	C	.	.			trans	-77.6	68.1	-175.5	-59.4	-66.5	0.2	0	0	111.5	G648 A678 R681 R685 V686 A687	G648-Q683 VanDerWaalsContact CA-CD 3.47Å; A678-Q683 HydrophobicContact CB-CB 4.28Å; A678-Q683 PolarHBondContact O-N 2.92Å; R681-Q683 VanDerWaalsContact C-N 3.28Å; R681-Q683 HydrophobicContact CB-CG 3.87Å; R681-Q683 PolarHBondContact O-N 3.14Å; Q683-R685 VanDerWaalsContact C-N 3.32Å; Q683-R685 PolarHBondContact O-N 3.36Å; Q683-V686 HydrophobicContact CB-CB 4.06Å; Q683-V686 HydrophobicContact CB-CG2 4.38Å; Q683-V686 PolarHBondContact O-N 2.95Å; Q683-A687 PolarHBondContact O-N 3.2Å
684	Y	94.8	Very high	94.5	Very high	94 Å²	94	41.9 Å²	41.9	37%	0.369	20%	0.199	S	C	.	.	H	α-helix	trans	-49.6	-47.1	-173.6	170.7	-96.3	0	0	0	113.5	G682 V686 A687 R688 L722	G682-Y684 PolarHBondContact O-N 3.25Å; Y684-V686 VanDerWaalsContact C-N 3.3Å; Y684-V686 PolarHBondContact O-N 3.39Å; Y684-A687 PolarHBondContact O-N 2.94Å; Y684-R688 WeakPolarHBondContact O-CB 3.48Å; Y684-R688 PolarHBondContact O-N 3.43Å; Y684-L722 HydrophobicContact CD2-CB 4.31Å; Y684-L722 HydrophobicContact CD2-CD2 3.99Å; Y684-L722 HydrophobicContact CE2-CB 3.89Å; Y684-L722 HydrophobicContact CE2-CD1 4.33Å; Y684-L722 HydrophobicContact CE2-CD2 3.89Å; Y684-L722 HydrophobicContact CE2-CG 4.26Å
685	R	95.6	Very high	94.4	Very high	171 Å²	171	42.3 Å²	42.3	65%	0.645	20%	0.203	S	C	*	.	H	α-helix	trans	-66	-34.6	-177.3	-61.7	-179	77	174.7	5	112.1	L650 Q683 I689	L650-R685 HydrophobicContact CD2-CB 4.3Å; Q683-R685 VanDerWaalsContact C-N 3.32Å; Q683-R685 PolarHBondContact O-N 3.36Å; R685-I689 PolarHBondContact O-N 3.31Å
686	V	95.8	Very high	94.2	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-74.2	-47.7	176.9	172.4	0	0	0	0	110.4	A645 L650 V653 A678 Q683 Y684 R688 I689 L690	A645-V686 HydrophobicContact CB-CG1 4.18Å; L650-V686 HydrophobicContact CB-CG2 4.31Å; L650-V686 HydrophobicContact CD1-CG2 4.38Å; V653-V686 HydrophobicContact CG1-CG1 4.37Å; V653-V686 HydrophobicContact CG2-CG1 3.96Å; A678-V686 HydrophobicContact CB-CB 4.47Å; A678-V686 HydrophobicContact CB-CG1 4.03Å; Q683-V686 HydrophobicContact CB-CB 4.06Å; Q683-V686 HydrophobicContact CB-CG2 4.38Å; Q683-V686 PolarHBondContact O-N 2.95Å; Y684-V686 VanDerWaalsContact C-N 3.3Å; Y684-V686 PolarHBondContact O-N 3.39Å; V686-R688 VanDerWaalsContact C-N 3.26Å; V686-R688 PolarHBondContact O-N 2.74Å; V686-I689 PolarHBondContact O-N 3.32Å; V686-I689 VanDerWaalsContact O-N 3.1Å; V686-L690 HydrophobicContact CG1-CD1 3.81Å; V686-L690 HydrophobicContact CG1-CG 4.17Å; V686-L690 WeakPolarHBondContact O-CG 3.3Å; V686-L690 PolarHBondContact O-N 3.4Å
687	A	95.7	Very high	94.1	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-54.7	-44.2	175.9	0	0	0	0	0	111.3	L675 A678 Q683 Y684 I689 L690 I691 T719 L722	L675-A687 HydrophobicContact CD1-CB 3.88Å; A678-A687 HydrophobicContact CB-CB 4.35Å; Q683-A687 PolarHBondContact O-N 3.2Å; Y684-A687 PolarHBondContact O-N 2.94Å; A687-I689 PolarHBondContact O-N 3.38Å; A687-L690 PolarHBondContact O-N 2.97Å; A687-I691 WeakPolarHBondContact O-CD1 3.45Å; A687-I691 VanDerWaalsContact O-CG1 3.24Å; A687-I691 WeakPolarHBondContact O-CG1 3.48Å; A687-I691 PolarHBondContact O-N 2.69Å; A687-T719 HydrophobicContact CB-CG2 3.97Å; A687-L722 HydrophobicContact CB-CD2 4.18Å
688	R	95	Very high	93.9	Very high	92 Å²	92	51.5 Å²	51.5	35%	0.347	24%	0.244	S	C	.	.	H	α-helix	trans	-58.3	-46.5	176.3	-162.3	-175	94.1	-155.9	6.3	112.6	Y684 V686 I691 E692 L722	Y684-R688 WeakPolarHBondContact O-CB 3.48Å; Y684-R688 PolarHBondContact O-N 3.43Å; V686-R688 VanDerWaalsContact C-N 3.26Å; V686-R688 PolarHBondContact O-N 2.74Å; R688-I691 PolarHBondContact O-N 2.8Å; R688-E692 WeakPolarHBondContact CG-OE1 3.47Å; R688-E692 IonicContact CZ-OE1 2.63Å; R688-E692 IonicContact NE-OE1 2.84Å; R688-E692 PolarHBondContact NE-OE1 3.41Å; R688-E692 IonicContact NH2-OE1 2.68Å; R688-E692 WeakPolarHBondContact O-CB 3.31Å; R688-E692 VanDerWaalsContact O-CG 3.32Å; R688-E692 WeakPolarHBondContact O-CG 3.45Å; R688-E692 PolarHBondContact O-N 3.09Å; R688-L722 HydrophobicContact CB-CD1 4.4Å; R688-L722 HydrophobicContact CB-CD2 3.73Å; R688-L722 HydrophobicContact CG-CD1 3.95Å; R688-L722 HydrophobicContact CG-CD2 4.22Å
689	I	94.5	Very high	93.8	Very high	16 Å²	16	52.7 Å²	52.7	8%	0.082	25%	0.251	C	S	.	.	H	α-helix	trans	-73.6	-34.3	-177.3	-78	-79.3	0	0	0	112	L650 V653 K654 R685 V686 A687 I691 E692 L693	L650-I689 HydrophobicContact CD1-CB 3.89Å; L650-I689 HydrophobicContact CD1-CG1 3.84Å; L650-I689 HydrophobicContact CD1-CG2 4.1Å; V653-I689 HydrophobicContact CG1-CG2 4.4Å; K654-I689 HydrophobicContact CG-CG2 3.8Å; R685-I689 PolarHBondContact O-N 3.31Å; V686-I689 PolarHBondContact O-N 3.32Å; V686-I689 VanDerWaalsContact O-N 3.1Å; A687-I689 PolarHBondContact O-N 3.38Å; I689-I691 VanDerWaalsContact C-N 3.33Å; I689-E692 WeakPolarHBondContact CD1-OE2 3.46Å; I689-E692 PolarHBondContact O-N 3.12Å; I689-L693 HydrophobicContact CG2-CD1 3.67Å; I689-L693 HydrophobicContact CG2-CG 4.31Å; I689-L693 VanDerWaalsContact O-CB 3.29Å; I689-L693 WeakPolarHBondContact O-CB 3.44Å; I689-L693 WeakPolarHBondContact O-CG 3.47Å; I689-L693 PolarHBondContact O-N 2.98Å
690	L	94.9	Very high	93.7	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-59.8	-45.4	171.7	-73	170.9	0	0	0	110.8	L641 A645 V653 V657 V664 A674 L675 A678 V686 A687 L693 G694 A695	L641-L690 HydrophobicContact CD1-CD2 4.23Å; L641-L690 HydrophobicContact CD2-CD2 4.44Å; A645-L690 HydrophobicContact CB-CD1 4.28Å; V653-L690 HydrophobicContact CG1-CD2 3.7Å; V653-L690 HydrophobicContact CG1-CG 4.09Å; V657-L690 HydrophobicContact CG2-CD2 4.24Å; V664-L690 HydrophobicContact CG1-CD2 4.05Å; A674-L690 HydrophobicContact CB-CD1 4.09Å; A674-L690 HydrophobicContact CB-CD2 4.39Å; L675-L690 HydrophobicContact CD1-CB 4.39Å; A678-L690 HydrophobicContact CB-CD1 4.22Å; V686-L690 HydrophobicContact CG1-CD1 3.81Å; V686-L690 HydrophobicContact CG1-CG 4.17Å; V686-L690 WeakPolarHBondContact O-CG 3.3Å; V686-L690 PolarHBondContact O-N 3.4Å; A687-L690 PolarHBondContact O-N 2.97Å; L690-L693 CarbonylContact O-C 3.53Å; L690-L693 PolarHBondContact O-N 3.3Å; L690-G694 PolarHBondContact O-N 3.47Å; L690-A695 HydrophobicContact CB-CB 4.01Å; L690-A695 WeakPolarHBondContact O-CB 3.28Å; L690-A695 PolarHBondContact O-N 3.12Å
691	I	94.6	Very high	93.6	Very high	19 Å²	19	54.4 Å²	54.4	10%	0.097	26%	0.259	C	S	.	.	H	α-helix	trans	-66.3	-45.5	177.2	-61.7	163.1	0	0	0	111.3	L675 A687 R688 I689 L693 G694 V697 L722 L723 H726	L675-I691 HydrophobicContact CD1-CD1 4.2Å; L675-I691 HydrophobicContact CD1-CG1 4Å; L675-I691 HydrophobicContact CD2-CG1 4.08Å; A687-I691 WeakPolarHBondContact O-CD1 3.45Å; A687-I691 VanDerWaalsContact O-CG1 3.24Å; A687-I691 WeakPolarHBondContact O-CG1 3.48Å; A687-I691 PolarHBondContact O-N 2.69Å; R688-I691 PolarHBondContact O-N 2.8Å; I689-I691 VanDerWaalsContact C-N 3.33Å; I691-L693 PolarHBondContact O-N 2.96Å; I691-G694 PolarHBondContact O-N 2.98Å; I691-V697 HydrophobicContact CD1-CG2 4.23Å; I691-V697 HydrophobicContact CG1-CG2 4.01Å; I691-V697 HydrophobicContact CG2-CG2 4.35Å; I691-L722 HydrophobicContact CD1-CD2 4.28Å; I691-L722 HydrophobicContact CD1-CG 4.23Å; I691-L723 HydrophobicContact CD1-CD2 3.89Å; I691-H726 HydrophobicContact CG2-CB 3.83Å; I691-H726 WeakPolarHBondContact CG2-ND1 3.38Å
692	E	92.3	Very high	93.6	Very high	105 Å²	105	52.6 Å²	52.6	49%	0.491	26%	0.264	S	S	.	.	H	α-helix	trans	-59.7	-28.7	176.3	-75.9	173.2	-162.7	0	0	112.4	R688 I689	R688-E692 WeakPolarHBondContact CG-OE1 3.47Å; R688-E692 IonicContact CZ-OE1 2.63Å; R688-E692 IonicContact NE-OE1 2.84Å; R688-E692 PolarHBondContact NE-OE1 3.41Å; R688-E692 IonicContact NH2-OE1 2.68Å; R688-E692 WeakPolarHBondContact O-CB 3.31Å; R688-E692 VanDerWaalsContact O-CG 3.32Å; R688-E692 WeakPolarHBondContact O-CG 3.45Å; R688-E692 PolarHBondContact O-N 3.09Å; I689-E692 WeakPolarHBondContact CD1-OE2 3.46Å; I689-E692 PolarHBondContact O-N 3.12Å
693	L	89.1	Confident	93.6	Very high	67 Å²	67	55.7 Å²	55.7	35%	0.351	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	13.2	178	-62.3	174.3	0	0	0	113.5	V657 I689 L690 I691	V657-L693 HydrophobicContact CB-CD1 3.81Å; V657-L693 HydrophobicContact CG1-CB 3.54Å; V657-L693 HydrophobicContact CG1-CD1 3.7Å; V657-L693 HydrophobicContact CG1-CG 4.18Å; V657-L693 HydrophobicContact CG2-CD1 4.43Å; I689-L693 HydrophobicContact CG2-CD1 3.67Å; I689-L693 HydrophobicContact CG2-CG 4.31Å; I689-L693 VanDerWaalsContact O-CB 3.29Å; I689-L693 WeakPolarHBondContact O-CB 3.44Å; I689-L693 WeakPolarHBondContact O-CG 3.47Å; I689-L693 PolarHBondContact O-N 2.98Å; L690-L693 CarbonylContact O-C 3.53Å; L690-L693 PolarHBondContact O-N 3.3Å; I691-L693 PolarHBondContact O-N 2.96Å
694	G	87.6	Confident	93.5	Very high	55 Å²	55	56.6 Å²	56.6	57%	0.567	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	97	16	168	0	0	0	0	0	116.6	L690 I691	L690-G694 PolarHBondContact O-N 3.47Å; I691-G694 PolarHBondContact O-N 2.98Å
695	A	93.5	Very high	93.5	Very high	9 Å²	9	52.5 Å²	52.5	7%	0.074	26%	0.264	C	S	.	.			trans	-63.6	133	170.9	0	0	0	0	0	111.3	V664 L675 L690 V697	V664-A695 HydrophobicContact CG1-CB 3.63Å; L675-A695 HydrophobicContact CD2-CB 4.45Å; L690-A695 HydrophobicContact CB-CB 4.01Å; L690-A695 WeakPolarHBondContact O-CB 3.28Å; L690-A695 PolarHBondContact O-N 3.12Å; A695-V697 PolarHBondContact O-N 3.41Å
696	D	93.4	Very high	93.5	Very high	76 Å²	76	44.6 Å²	44.6	41%	0.406	24%	0.235	S	C	.	.			trans	-80	122.2	177.4	-178.9	11.6	0	0	0	111.3	D665 R698 V699	D665-D696 PolarHBondContact OD1-N 3.02Å; D665-D696 PolarHBondContact OD2-N 2.68Å; D696-R698 PolarHBondContact O-N 2.83Å; D696-R698 WeakPolarHBondContact OD1-CB 3.47Å; D696-R698 PolarHBondContact OD1-N 3.33Å; D696-V699 HydrophobicContact CB-CG2 3.77Å
697	V	94.4	Very high	93.6	Very high	11 Å²	11	44.6 Å²	44.6	7%	0.067	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-16.3	179.9	-177.3	0	0	0	0	111.8	L675 I691 A695 L723 H726 A728	L675-V697 HydrophobicContact CD2-CG2 4.09Å; I691-V697 HydrophobicContact CD1-CG2 4.23Å; I691-V697 HydrophobicContact CG1-CG2 4.01Å; I691-V697 HydrophobicContact CG2-CG2 4.35Å; A695-V697 PolarHBondContact O-N 3.41Å; V697-L723 HydrophobicContact CG1-CB 4.32Å; V697-L723 HydrophobicContact CG1-CD2 3.84Å; V697-L723 HydrophobicContact CG2-CD2 4.44Å; V697-H726 HydrophobicContact CG2-CB 4.45Å; V697-A728 HydrophobicContact CG1-CB 3.61Å
698	R	92.1	Very high	93.6	Very high	113 Å²	113	44.6 Å²	44.6	43%	0.426	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-5.8	-176.5	-57.3	-55.7	-174.7	109.6	-4.8	114.1	D696 K700 Q727	D696-R698 PolarHBondContact O-N 2.83Å; D696-R698 WeakPolarHBondContact OD1-CB 3.47Å; D696-R698 PolarHBondContact OD1-N 3.33Å; R698-K700 PolarHBondContact O-N 3.34Å; R698-Q727 PolarHBondContact NE-O 2.95Å; R698-Q727 PolarHBondContact NH2-O 3.05Å
699	V	94.3	Very high	93.7	Very high	24 Å²	24	40.2 Å²	40.2	15%	0.145	22%	0.218	C	C	.	.			trans	-59	138.9	176.3	-173.9	0	0	0	0	109.8	D665 Q667 T673 H676 D696	D665-V699 HydrophobicContact CB-CG2 4.36Å; Q667-V699 HydrophobicContact CG-CG1 4.45Å; T673-V699 HydrophobicContact CG2-CB 4.06Å; T673-V699 HydrophobicContact CG2-CG1 3.59Å; T673-V699 HydrophobicContact CG2-CG2 4.43Å; H676-V699 PolarHBondContact CE1-O 3.49Å; H676-V699 PolarHBondContact NE2-O 3.45Å; D696-V699 HydrophobicContact CB-CG2 3.77Å
700	K	94.5	Very high	93.8	Very high	82 Å²	82	39.7 Å²	39.7	36%	0.357	22%	0.216	S	C	.	.			trans	-111.7	142.3	-178.2	-65.7	-173.6	-178.6	-172.8	0	110.6	Q667 R698 L704 N705 T706	Q667-K700 PolarHBondContact NE2-O 3.13Å; R698-K700 PolarHBondContact O-N 3.34Å; K700-L704 HydrophobicContact CB-CD2 4.41Å; K700-L704 HydrophobicContact CD-CB 4.19Å; K700-L704 HydrophobicContact CD-CD2 3.99Å; K700-N705 CarbonylContact C-O 3.51Å; K700-N705 WeakPolarHBondContact CA-O 3.31Å; K700-T706 HydrophobicContact CG-CG2 4.08Å
701	S	94.1	Very high	93.9	Very high	7 Å²	7	39.7 Å²	39.7	5%	0.049	22%	0.216	C	C	.	.			trans	-73.4	179.5	169.4	80	0	0	0	0	112.1	D670 G671 E703 L704 N705	D670-S701 WeakPolarHBondContact O-CB 3.27Å; G671-S701 WeakPolarHBondContact O-CA 3.26Å; S701-E703 PolarHBondContact O-N 2.59Å; S701-E703 PolarHBondContact OG-N 2.85Å; S701-L704 WeakPolarHBondContact O-CA 3.38Å; S701-L704 PolarHBondContact O-N 3.39Å; S701-N705 PolarHBondContact N-O 3.45Å; S701-N705 WeakPolarHBondContact OG-CB 3.32Å; S701-N705 PolarHBondContact OG-N 3.18Å
702	S	92.5	Very high	94	Very high	83 Å²	83	38.8 Å²	38.8	58%	0.58	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-35.4	173	51.8	0	0	0	0	113.5	D670 L704	D670-S702 VanDerWaalsContact O-CB 3.31Å; D670-S702 WeakPolarHBondContact O-CB 3.29Å; D670-S702 PolarHBondContact O-N 3.11Å; D670-S702 PolarHBondContact O-OG 3.3Å; S702-L704 PolarHBondContact O-N 3.33Å
703	E	91.1	Very high	94.2	Very high	87 Å²	87	36.3 Å²	36.3	41%	0.407	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	13.7	175.8	-63.1	173.5	161.1	0	0	113	S701 N705 A735	S701-E703 PolarHBondContact O-N 2.59Å; S701-E703 PolarHBondContact OG-N 2.85Å; E703-N705 WeakPolarHBondContact CB-ND2 3.44Å; E703-N705 PolarHBondContact O-N 3.28Å; E703-N705 VanDerWaalsContact O-N 3.14Å; E703-N705 PolarHBondContact OE2-ND2 3.23Å; E703-A735 WeakPolarHBondContact O-CB 3.47Å; E703-A735 PolarHBondContact O-N 3.32Å
704	L	93.6	Very high	94.4	Very high	76 Å²	76	35.2 Å²	35.2	40%	0.398	20%	0.196	S	C	.	.	S	Bend	trans	59.4	17.9	-172.7	-54.6	176.1	0	0	0	114.6	K700 S701 S702 A735	K700-L704 HydrophobicContact CB-CD2 4.41Å; K700-L704 HydrophobicContact CD-CB 4.19Å; K700-L704 HydrophobicContact CD-CD2 3.99Å; S701-L704 WeakPolarHBondContact O-CA 3.38Å; S701-L704 PolarHBondContact O-N 3.39Å; S702-L704 PolarHBondContact O-N 3.33Å; L704-A735 HydrophobicContact CB-CB 4.29Å; L704-A735 HydrophobicContact CD1-CB 4.17Å; L704-A735 HydrophobicContact CG-CB 4.22Å
705	N	94.9	Very high	94.7	Very high	9 Å²	9	33.5 Å²	33.5	5%	0.048	18%	0.178	C	C	.	.			trans	-75	131.8	175.8	-74.8	-47.4	0	0	0	109.9	H676 K700 S701 E703 H709 V710 N734	H676-N705 PolarHBondContact NE2-O 2.91Å; H676-N705 VanDerWaalsContact NE2-O 3.14Å; K700-N705 CarbonylContact C-O 3.51Å; K700-N705 WeakPolarHBondContact CA-O 3.31Å; S701-N705 PolarHBondContact N-O 3.45Å; S701-N705 WeakPolarHBondContact OG-CB 3.32Å; S701-N705 PolarHBondContact OG-N 3.18Å; E703-N705 WeakPolarHBondContact CB-ND2 3.44Å; E703-N705 PolarHBondContact O-N 3.28Å; E703-N705 VanDerWaalsContact O-N 3.14Å; E703-N705 PolarHBondContact OE2-ND2 3.23Å; N705-H709 HydrophobicContact CB-CB 4.02Å; N705-V710 HydrophobicContact CB-CG2 4.45Å; N705-N734 WeakPolarHBondContact OD1-CB 3.37Å; N705-N734 PolarHBondContact OD1-ND2 2.68Å
706	T	96.5	Very high	94.9	Very high	5 Å²	5	36 Å²	36	3%	0.031	19%	0.188	C	C	.	.			trans	-88.3	169.8	169.5	60.3	0	0	0	0	110.9	H676 K700 L708 H709 V710 I732	H676-T706 VanDerWaalsContact NE2-C 3.31Å; K700-T706 HydrophobicContact CG-CG2 4.08Å; T706-L708 PolarHBondContact O-N 3.25Å; T706-L708 VanDerWaalsContact O-N 3.13Å; T706-H709 PolarHBondContact N-ND1 3.3Å; T706-H709 WeakPolarHBondContact O-CB 3.03Å; T706-H709 PolarHBondContact O-N 3.39Å; T706-H709 PolarHBondContact OG1-ND1 3.41Å; T706-V710 PolarHBondContact O-N 3.43Å; T706-I732 HydrophobicContact CG2-CD1 3.94Å; T706-I732 HydrophobicContact CG2-CG2 4.23Å
707	A	96.3	Very high	95	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-55.3	-31.6	174	0	0	0	0	0	112.7	L675 H676 V710 A711 L723	L675-A707 HydrophobicContact CD2-CB 4.15Å; L675-A707 HydrophobicContact CG-CB 3.93Å; H676-A707 PolarHBondContact CD2-N 3.27Å; H676-A707 PolarHBondContact NE2-N 3.49Å; H676-A707 VanDerWaalsContact NE2-N 3.19Å; A707-V710 PolarHBondContact O-N 2.87Å; A707-A711 WeakPolarHBondContact O-CB 3.3Å; A707-A711 PolarHBondContact O-N 3.36Å; A707-L723 HydrophobicContact CB-CD1 4.04Å; A707-L723 HydrophobicContact CB-CD2 4.04Å
708	L	97.1	Very high	95	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-69.6	-39.9	176.9	-177.7	60.9	0	0	0	112.4	T706 V710 A711 A712 L723 I724 A728 D729 P740 L756	T706-L708 PolarHBondContact O-N 3.25Å; T706-L708 VanDerWaalsContact O-N 3.13Å; L708-V710 VanDerWaalsContact C-N 3.32Å; L708-V710 PolarHBondContact O-N 2.9Å; L708-A711 PolarHBondContact O-N 3.49Å; L708-A712 VanDerWaalsContact O-CB 3.22Å; L708-A712 WeakPolarHBondContact O-CB 3.43Å; L708-A712 PolarHBondContact O-N 3.22Å; L708-L723 HydrophobicContact CB-CD1 4.31Å; L708-L723 HydrophobicContact CD1-CB 4.37Å; L708-L723 HydrophobicContact CD1-CD1 4.45Å; L708-I724 HydrophobicContact CD1-CD1 4.17Å; L708-I724 HydrophobicContact CD1-CG1 4Å; L708-I724 HydrophobicContact CD2-CD1 4.36Å; L708-I724 HydrophobicContact CD2-CG1 3.87Å; L708-A728 HydrophobicContact CB-CB 4.3Å; L708-A728 HydrophobicContact CD2-CB 3.96Å; L708-D729 WeakPolarHBondContact CD2-O 3.24Å; L708-P740 HydrophobicContact CB-CG 4.42Å; L708-P740 HydrophobicContact CD2-CB 4.33Å; L708-P740 HydrophobicContact CD2-CG 3.86Å; L708-P740 HydrophobicContact CG-CB 3.99Å; L708-P740 HydrophobicContact CG-CG 3.77Å; L708-L756 HydrophobicContact CD1-CD2 4.48Å
709	H	97.1	Very high	95.2	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-57.7	-48.9	173.2	-74.5	94	0	0	0	110.7	N705 T706 A712 E713 I732 L738 L743	N705-H709 HydrophobicContact CB-CB 4.02Å; T706-H709 PolarHBondContact N-ND1 3.3Å; T706-H709 WeakPolarHBondContact O-CB 3.03Å; T706-H709 PolarHBondContact O-N 3.39Å; T706-H709 PolarHBondContact OG1-ND1 3.41Å; H709-A712 PolarHBondContact O-N 3.42Å; H709-E713 WeakPolarHBondContact O-CB 3.21Å; H709-E713 PolarHBondContact O-N 3.47Å; H709-I732 WeakPolarHBondContact CE1-CG2 3.46Å; H709-I732 PolarHBondContact CE1-O 2.98Å; H709-I732 PolarHBondContact NE2-O 3.38Å; H709-L738 PolarHBondContact NE2-O 3.2Å; H709-L743 HydrophobicContact CB-CD1 3.72Å
710	V	96.3	Very high	95.3	Very high	4 Å²	4	30.6 Å²	30.6	2%	0.024	17%	0.174	C	C	.	.	H	α-helix	trans	-63.4	-46.3	-179.2	179.4	0	0	0	0	111.1	Q680 N705 T706 A707 L708 A712 E713 T714	Q680-V710 HydrophobicContact CB-CG1 3.48Å; Q680-V710 VanDerWaalsContact CB-CG1 3.48Å; Q680-V710 HydrophobicContact CG-CG1 3.81Å; N705-V710 HydrophobicContact CB-CG2 4.45Å; T706-V710 PolarHBondContact O-N 3.43Å; A707-V710 PolarHBondContact O-N 2.87Å; L708-V710 VanDerWaalsContact C-N 3.32Å; L708-V710 PolarHBondContact O-N 2.9Å; V710-A712 VanDerWaalsContact C-N 3.28Å; V710-A712 PolarHBondContact O-N 3.13Å; V710-E713 PolarHBondContact O-N 3.47Å; V710-T714 PolarHBondContact O-N 3.03Å; V710-T714 VanDerWaalsContact O-N 3.12Å; V710-T714 PolarHBondContact O-OG1 3.41Å
711	A	96.9	Very high	95.3	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-61.4	-37.1	177	0	0	0	0	0	112.6	A707 L708 T714 G715 H716 T719 S720 L723	A707-A711 WeakPolarHBondContact O-CB 3.3Å; A707-A711 PolarHBondContact O-N 3.36Å; L708-A711 PolarHBondContact O-N 3.49Å; A711-T714 PolarHBondContact O-OG1 2.86Å; A711-G715 PolarHBondContact O-N 3.29Å; A711-G715 VanDerWaalsContact O-N 3.11Å; A711-H716 PolarHBondContact O-N 3.28Å; A711-T719 HydrophobicContact CB-CG2 4.48Å; A711-S720 VanDerWaalsContact CB-OG 3.24Å; A711-S720 WeakPolarHBondContact CB-OG 3.36Å; A711-L723 HydrophobicContact CB-CD1 4.09Å
712	A	96.6	Very high	95.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-72.7	-40.6	179.6	0	0	0	0	0	112.4	L708 H709 V710 T714 G715 P740 A744 H749 T752 L756	L708-A712 VanDerWaalsContact O-CB 3.22Å; L708-A712 WeakPolarHBondContact O-CB 3.43Å; L708-A712 PolarHBondContact O-N 3.22Å; H709-A712 PolarHBondContact O-N 3.42Å; V710-A712 VanDerWaalsContact C-N 3.28Å; V710-A712 PolarHBondContact O-N 3.13Å; A712-T714 VanDerWaalsContact C-N 3.3Å; A712-T714 PolarHBondContact O-N 3.29Å; A712-G715 PolarHBondContact O-N 3.3Å; A712-P740 HydrophobicContact CB-CB 3.81Å; A712-P740 WeakPolarHBondContact CB-O 3.32Å; A712-A744 HydrophobicContact CB-CB 4.28Å; A712-H749 PolarHBondContact O-CD2 3.16Å; A712-T752 HydrophobicContact CB-CG2 4.21Å; A712-L756 HydrophobicContact CB-CD1 4.28Å
713	E	96.1	Very high	95.6	Very high	54 Å²	54	28.2 Å²	28.2	25%	0.252	15%	0.15	S	C	.	.	H	α-helix	trans	-61.5	-37.9	174	-170.5	-177.1	-172.8	0	0	112	H709 V710 L743 R747 H749	H709-E713 WeakPolarHBondContact O-CB 3.21Å; H709-E713 PolarHBondContact O-N 3.47Å; V710-E713 PolarHBondContact O-N 3.47Å; E713-L743 HydrophobicContact CB-CB 4.08Å; E713-L743 HydrophobicContact CB-CD1 4.31Å; E713-R747 HydrophobicContact CG-CG 4.07Å; E713-R747 WeakPolarHBondContact O-CG 3.46Å; E713-R747 IonicContact OE1-CZ 2.69Å; E713-R747 IonicContact OE1-NE 3.71Å; E713-R747 IonicContact OE1-NH2 3.2Å; E713-R747 PolarHBondContact OE1-NH2 2.99Å; E713-H749 PolarHBondContact O-CD2 3.34Å; E713-H749 VanDerWaalsContact O-CD2 3.27Å; E713-H749 PolarHBondContact O-NE2 3.28Å
714	T	94.6	Very high	95.8	Very high	44 Å²	44	25 Å²	25	27%	0.27	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-1.9	179.9	57.7	0	0	0	0	114	Q680 V710 A711 A712 H716	Q680-T714 HydrophobicContact CG-CG2 3.99Å; V710-T714 PolarHBondContact O-N 3.03Å; V710-T714 VanDerWaalsContact O-N 3.12Å; V710-T714 PolarHBondContact O-OG1 3.41Å; A711-T714 PolarHBondContact O-OG1 2.86Å; A712-T714 VanDerWaalsContact C-N 3.3Å; A712-T714 PolarHBondContact O-N 3.29Å; T714-H716 PolarHBondContact OG1-CD2 2.89Å
715	G	93.6	Very high	95.8	Very high	19 Å²	19	29.6 Å²	29.6	20%	0.196	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.8	18.6	175.4	0	0	0	0	0	115.4	A711 A712 T717 H749 T752	A711-G715 PolarHBondContact O-N 3.29Å; A711-G715 VanDerWaalsContact O-N 3.11Å; A712-G715 PolarHBondContact O-N 3.3Å; G715-T717 VanDerWaalsContact C-N 3.28Å; G715-T717 PolarHBondContact O-N 3.28Å; G715-H749 WeakPolarHBondContact CA-CD2 3.5Å; G715-H749 PolarHBondContact N-CD2 3.21Å; G715-H749 VanDerWaalsContact N-CD2 3.25Å; G715-H749 PolarHBondContact N-NE2 2.83Å; G715-T752 PolarHBondContact O-OG1 3.37Å
716	H	96.6	Very high	95.8	Very high	60 Å²	60	32.9 Å²	32.9	28%	0.278	17%	0.166	S	C	.	.			trans	-84.1	68.6	-176.1	-67.4	-43.9	0	0	0	112.3	S679 Q680 G682 A711 T714 S718 T719 S720	S679-H716 PolarHBondContact O-CD2 2.9Å; Q680-H716 PolarHBondContact O-NE2 3.25Å; G682-H716 WeakPolarHBondContact CA-CD2 3.49Å; G682-H716 WeakPolarHBondContact CA-NE2 3.5Å; G682-H716 PolarHBondContact N-CD2 3.02Å; G682-H716 PolarHBondContact N-NE2 2.82Å; G682-H716 VanDerWaalsContact N-NE2 3.18Å; A711-H716 PolarHBondContact O-N 3.28Å; T714-H716 PolarHBondContact OG1-CD2 2.89Å; H716-S718 VanDerWaalsContact C-N 3.33Å; H716-S718 PolarHBondContact O-N 3.42Å; H716-S718 VanDerWaalsContact O-N 3.15Å; H716-T719 PolarHBondContact O-N 3.16Å; H716-S720 PolarHBondContact O-N 2.95Å; H716-S720 PolarHBondContact O-OG 3.46Å
717	T	95	Very high	95.5	Very high	29 Å²	29	40 Å²	40	18%	0.178	20%	0.199	C	C	.	.	H	α-helix	trans	-46.7	-45.9	-174.1	-52	0	0	0	0	114.5	G715 T719 S720 R721 T752 M755	G715-T717 VanDerWaalsContact C-N 3.28Å; G715-T717 PolarHBondContact O-N 3.28Å; T717-T719 PolarHBondContact O-N 3.42Å; T717-S720 PolarHBondContact O-N 3.17Å; T717-R721 PolarHBondContact O-N 2.96Å; T717-T752 PolarHBondContact OG1-N 3.49Å; T717-T752 PolarHBondContact OG1-OG1 3.3Å; T717-M755 HydrophobicContact CG2-CB 3.76Å; T717-M755 HydrophobicContact CG2-CE 4.25Å; T717-M755 HydrophobicContact CG2-CG 4.01Å
718	S	96.2	Very high	95.4	Very high	79 Å²	79	40.4 Å²	40.4	55%	0.552	20%	0.203	S	C	*	.	H	α-helix	trans	-66.1	-37.2	-179.1	-56.7	0	0	0	0	112.7	H716 L722	H716-S718 VanDerWaalsContact C-N 3.33Å; H716-S718 PolarHBondContact O-N 3.42Å; H716-S718 VanDerWaalsContact O-N 3.15Å; S718-L722 WeakPolarHBondContact O-CB 3.28Å; S718-L722 PolarHBondContact O-N 3.03Å; S718-L722 VanDerWaalsContact O-N 3.1Å
719	T	94.7	Very high	95.2	Very high	3 Å²	3	43.5 Å²	43.5	2%	0.018	22%	0.219	C	C	.	.	H	α-helix	trans	-72.6	-41	176.1	-54.5	0	0	0	0	110.6	A687 A711 H716 T717 R721 L722 L723	A687-T719 HydrophobicContact CB-CG2 3.97Å; A711-T719 HydrophobicContact CB-CG2 4.48Å; H716-T719 PolarHBondContact O-N 3.16Å; T717-T719 PolarHBondContact O-N 3.42Å; T719-R721 PolarHBondContact O-N 3.46Å; T719-L722 WeakPolarHBondContact O-CB 3.38Å; T719-L722 PolarHBondContact O-N 2.93Å; T719-L723 HydrophobicContact CG2-CD1 4.24Å; T719-L723 VanDerWaalsContact O-CG 3.3Å; T719-L723 WeakPolarHBondContact O-CG 3.27Å; T719-L723 PolarHBondContact O-N 3.08Å
720	S	96.3	Very high	95.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.5	-46.7	173.7	-56.2	0	0	0	0	111.7	A711 H716 T717 L722 L723 I724	A711-S720 VanDerWaalsContact CB-OG 3.24Å; A711-S720 WeakPolarHBondContact CB-OG 3.36Å; H716-S720 PolarHBondContact O-N 2.95Å; H716-S720 PolarHBondContact O-OG 3.46Å; T717-S720 PolarHBondContact O-N 3.17Å; S720-L722 VanDerWaalsContact C-N 3.32Å; S720-L722 PolarHBondContact O-N 3.3Å; S720-L723 PolarHBondContact O-N 3.27Å; S720-I724 VanDerWaalsContact O-CG1 3.29Å; S720-I724 WeakPolarHBondContact O-CG1 3.4Å; S720-I724 PolarHBondContact O-N 3.04Å
721	R	95.6	Very high	95	Very high	112 Å²	112	46 Å²	46	42%	0.423	23%	0.233	S	C	.	.	H	α-helix	trans	-60.5	-40.8	175.9	-170.9	-176	-61.8	-85.9	6.7	112.4	T717 T719 I724 K725 M755 E759	T717-R721 PolarHBondContact O-N 2.96Å; T719-R721 PolarHBondContact O-N 3.46Å; R721-I724 PolarHBondContact O-N 2.91Å; R721-K725 WeakPolarHBondContact O-CB 3.24Å; R721-K725 PolarHBondContact O-N 2.91Å; R721-M755 HydrophobicContact CB-CG 4.26Å; R721-M755 HydrophobicContact CB-SD 4.02Å; R721-M755 VanDerWaalsContact CZ-CG 3.42Å; R721-M755 VanDerWaalsContact NH2-CG 3.26Å; R721-E759 IonicContact CZ-OE1 2.6Å; R721-E759 IonicContact NH1-OE1 3.48Å; R721-E759 PolarHBondContact NH1-OE1 3.34Å
722	L	96.3	Very high	94.9	Very high	11 Å²	11	47.1 Å²	47.1	6%	0.058	24%	0.239	C	C	.	.	H	α-helix	trans	-60.8	-46.5	176.3	174.6	69.6	0	0	0	111.7	Y684 A687 R688 I691 S718 T719 S720 I724 K725 H726	Y684-L722 HydrophobicContact CD2-CB 4.31Å; Y684-L722 HydrophobicContact CD2-CD2 3.99Å; Y684-L722 HydrophobicContact CE2-CB 3.89Å; Y684-L722 HydrophobicContact CE2-CD1 4.33Å; Y684-L722 HydrophobicContact CE2-CD2 3.89Å; Y684-L722 HydrophobicContact CE2-CG 4.26Å; A687-L722 HydrophobicContact CB-CD2 4.18Å; R688-L722 HydrophobicContact CB-CD1 4.4Å; R688-L722 HydrophobicContact CB-CD2 3.73Å; R688-L722 HydrophobicContact CG-CD1 3.95Å; R688-L722 HydrophobicContact CG-CD2 4.22Å; I691-L722 HydrophobicContact CD1-CD2 4.28Å; I691-L722 HydrophobicContact CD1-CG 4.23Å; S718-L722 WeakPolarHBondContact O-CB 3.28Å; S718-L722 PolarHBondContact O-N 3.03Å; S718-L722 VanDerWaalsContact O-N 3.1Å; T719-L722 WeakPolarHBondContact O-CB 3.38Å; T719-L722 PolarHBondContact O-N 2.93Å; S720-L722 VanDerWaalsContact C-N 3.32Å; S720-L722 PolarHBondContact O-N 3.3Å; L722-I724 VanDerWaalsContact C-N 3.33Å; L722-I724 PolarHBondContact O-N 3.33Å; L722-K725 PolarHBondContact O-N 3.07Å; L722-H726 PolarHBondContact O-CD2 2.97Å; L722-H726 PolarHBondContact O-N 3.49Å; L722-H726 VanDerWaalsContact O-N 3.14Å
723	L	95.9	Very high	94.8	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.4	-44.9	178.9	-67.8	164.9	0	0	0	110.8	L675 I691 V697 A707 L708 A711 T719 S720 K725 H726 A728	L675-L723 HydrophobicContact CD1-CD2 4.2Å; L675-L723 HydrophobicContact CD2-CD2 3.97Å; L675-L723 HydrophobicContact CG-CD2 4.25Å; I691-L723 HydrophobicContact CD1-CD2 3.89Å; V697-L723 HydrophobicContact CG1-CB 4.32Å; V697-L723 HydrophobicContact CG1-CD2 3.84Å; V697-L723 HydrophobicContact CG2-CD2 4.44Å; A707-L723 HydrophobicContact CB-CD1 4.04Å; A707-L723 HydrophobicContact CB-CD2 4.04Å; L708-L723 HydrophobicContact CB-CD1 4.31Å; L708-L723 HydrophobicContact CD1-CB 4.37Å; L708-L723 HydrophobicContact CD1-CD1 4.45Å; A711-L723 HydrophobicContact CB-CD1 4.09Å; T719-L723 HydrophobicContact CG2-CD1 4.24Å; T719-L723 VanDerWaalsContact O-CG 3.3Å; T719-L723 WeakPolarHBondContact O-CG 3.27Å; T719-L723 PolarHBondContact O-N 3.08Å; S720-L723 PolarHBondContact O-N 3.27Å; L723-K725 PolarHBondContact O-N 2.81Å; L723-H726 CarbonylContact O-C 3.55Å; L723-H726 WeakPolarHBondContact O-CA 3.46Å; L723-H726 PolarHBondContact O-N 3.27Å; L723-H726 VanDerWaalsContact O-N 3.11Å; L723-A728 VanDerWaalsContact C-CB 3.43Å; L723-A728 HydrophobicContact CB-CB 3.98Å; L723-A728 WeakPolarHBondContact O-CB 3.25Å; L723-A728 PolarHBondContact O-N 2.96Å
724	I	95.3	Very high	94.7	Very high	20 Å²	20	49 Å²	49	10%	0.103	25%	0.248	C	C	.	.	H	α-helix	trans	-61.9	-44.5	178.1	-63.6	167.7	0	0	0	111.4	L708 S720 R721 L722 H726 Q727 V730 M755 L756 E759	L708-I724 HydrophobicContact CD1-CD1 4.17Å; L708-I724 HydrophobicContact CD1-CG1 4Å; L708-I724 HydrophobicContact CD2-CD1 4.36Å; L708-I724 HydrophobicContact CD2-CG1 3.87Å; S720-I724 VanDerWaalsContact O-CG1 3.29Å; S720-I724 WeakPolarHBondContact O-CG1 3.4Å; S720-I724 PolarHBondContact O-N 3.04Å; R721-I724 PolarHBondContact O-N 2.91Å; L722-I724 VanDerWaalsContact C-N 3.33Å; L722-I724 PolarHBondContact O-N 3.33Å; I724-H726 PolarHBondContact O-N 2.92Å; I724-Q727 WeakPolarHBondContact O-CA 3.25Å; I724-Q727 PolarHBondContact O-N 3.12Å; I724-V730 HydrophobicContact CD1-CG2 4.04Å; I724-V730 HydrophobicContact CG1-CG2 3.96Å; I724-V730 HydrophobicContact CG2-CG2 3.78Å; I724-M755 HydrophobicContact CD1-CE 4.36Å; I724-M755 HydrophobicContact CD1-SD 3.83Å; I724-L756 HydrophobicContact CD1-CD2 3.8Å; I724-E759 HydrophobicContact CD1-CB 4.16Å; I724-E759 HydrophobicContact CD1-CG 4.29Å; I724-E759 HydrophobicContact CG2-CB 4.09Å; I724-E759 HydrophobicContact CG2-CG 4.39Å
725	K	94.9	Very high	94.7	Very high	171 Å²	171	48 Å²	48	74%	0.743	25%	0.245	S	C	*	.	H	α-helix	trans	-58	-31.5	175.6	-174.8	178.8	178.9	-179	0	112.7	R721 L722 L723 Q727	R721-K725 WeakPolarHBondContact O-CB 3.24Å; R721-K725 PolarHBondContact O-N 2.91Å; L722-K725 PolarHBondContact O-N 3.07Å; L723-K725 PolarHBondContact O-N 2.81Å; K725-Q727 PolarHBondContact O-N 2.83Å
726	H	93.4	Very high	94.6	Very high	78 Å²	78	51 Å²	51	36%	0.361	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	33.8	174.2	-75.7	-87.7	0	0	0	112.7	I691 V697 L722 L723 I724 A728	I691-H726 HydrophobicContact CG2-CB 3.83Å; I691-H726 WeakPolarHBondContact CG2-ND1 3.38Å; V697-H726 HydrophobicContact CG2-CB 4.45Å; L722-H726 PolarHBondContact O-CD2 2.97Å; L722-H726 PolarHBondContact O-N 3.49Å; L722-H726 VanDerWaalsContact O-N 3.14Å; L723-H726 CarbonylContact O-C 3.55Å; L723-H726 WeakPolarHBondContact O-CA 3.46Å; L723-H726 PolarHBondContact O-N 3.27Å; L723-H726 VanDerWaalsContact O-N 3.11Å; I724-H726 PolarHBondContact O-N 2.92Å; H726-A728 PolarHBondContact O-N 3.26Å
727	Q	91.5	Very high	94.4	Very high	155 Å²	155	48.4 Å²	48.4	72%	0.724	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.1	39.6	175.3	-50.2	172.4	5.7	0	0	112.5	R698 I724 K725	R698-Q727 PolarHBondContact NE-O 2.95Å; R698-Q727 PolarHBondContact NH2-O 3.05Å; I724-Q727 WeakPolarHBondContact O-CA 3.25Å; I724-Q727 PolarHBondContact O-N 3.12Å; K725-Q727 PolarHBondContact O-N 2.83Å
728	A	93.4	Very high	94.4	Very high	10 Å²	10	47.9 Å²	47.9	8%	0.083	24%	0.239	C	C	.	.			trans	-70.3	137.9	159.9	0	0	0	0	0	109.4	V697 L708 L723 H726 V730	V697-A728 HydrophobicContact CG1-CB 3.61Å; L708-A728 HydrophobicContact CB-CB 4.3Å; L708-A728 HydrophobicContact CD2-CB 3.96Å; L723-A728 VanDerWaalsContact C-CB 3.43Å; L723-A728 HydrophobicContact CB-CB 3.98Å; L723-A728 WeakPolarHBondContact O-CB 3.25Å; L723-A728 PolarHBondContact O-N 2.96Å; H726-A728 PolarHBondContact O-N 3.26Å; A728-V730 PolarHBondContact O-N 3.15Å
729	D	93.7	Very high	94.4	Very high	64 Å²	64	44.1 Å²	44.1	34%	0.342	21%	0.212	S	C	.	.			trans	-74.7	119.5	172.8	-178	-1.2	0	0	0	109.7	L708 N731 I732	L708-D729 WeakPolarHBondContact CD2-O 3.24Å; D729-N731 VanDerWaalsContact C-N 3.3Å; D729-N731 PolarHBondContact OD1-N 3.1Å; D729-I732 HydrophobicContact CB-CB 4.03Å; D729-I732 HydrophobicContact CB-CG2 4.43Å; D729-I732 WeakPolarHBondContact O-CG2 3.12Å
730	V	94.8	Very high	94.5	Very high	13 Å²	13	44 Å²	44	8%	0.079	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-28.5	-176.3	-172.5	0	0	0	0	111.7	I724 A728 P740 L756 A761	I724-V730 HydrophobicContact CD1-CG2 4.04Å; I724-V730 HydrophobicContact CG1-CG2 3.96Å; I724-V730 HydrophobicContact CG2-CG2 3.78Å; A728-V730 PolarHBondContact O-N 3.15Å; V730-P740 WeakPolarHBondContact O-CD 3.37Å; V730-L756 HydrophobicContact CG1-CD2 4.01Å; V730-A761 HydrophobicContact CG1-CB 3.52Å
731	N	94.3	Very high	94.5	Very high	45 Å²	45	44 Å²	44	24%	0.241	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	16	-173.4	-66.4	-42.8	0	0	0	112.6	D729 Q733 G760 A761 D762 M765	D729-N731 VanDerWaalsContact C-N 3.3Å; D729-N731 PolarHBondContact OD1-N 3.1Å; N731-Q733 PolarHBondContact O-N 2.84Å; N731-G760 PolarHBondContact ND2-O 2.97Å; N731-A761 WeakPolarHBondContact OD1-CA 3.07Å; N731-D762 PolarHBondContact OD1-N 2.91Å; N731-M765 HydrophobicContact CB-CE 3.88Å
732	I	94.4	Very high	94.5	Very high	23 Å²	23	38.6 Å²	38.6	12%	0.118	19%	0.191	C	C	.	.			trans	-65.5	137.4	178.6	-167.9	155.3	0	0	0	110.8	T706 H709 D729 T739 P740	T706-I732 HydrophobicContact CG2-CD1 3.94Å; T706-I732 HydrophobicContact CG2-CG2 4.23Å; H709-I732 WeakPolarHBondContact CE1-CG2 3.46Å; H709-I732 PolarHBondContact CE1-O 2.98Å; H709-I732 PolarHBondContact NE2-O 3.38Å; D729-I732 HydrophobicContact CB-CB 4.03Å; D729-I732 HydrophobicContact CB-CG2 4.43Å; D729-I732 WeakPolarHBondContact O-CG2 3.12Å; I732-T739 WeakPolarHBondContact O-CA 3.5Å; I732-P740 WeakPolarHBondContact O-CD 3.49Å
733	Q	94.6	Very high	94.5	Very high	84 Å²	84	38.4 Å²	38.4	39%	0.393	19%	0.19	S	C	.	.			trans	-100.7	138.5	177.9	-68.9	-178.1	-48.5	0	0	111.5	N731 G737 L738 T739 M765 S766	N731-Q733 PolarHBondContact O-N 2.84Å; Q733-G737 WeakPolarHBondContact CG-O 3.42Å; Q733-G737 PolarHBondContact NE2-O 3.15Å; Q733-L738 WeakPolarHBondContact CA-O 3.17Å; Q733-T739 HydrophobicContact CG-CG2 3.92Å; Q733-M765 HydrophobicContact CG-SD 3.76Å; Q733-S766 PolarHBondContact NE2-O 3.27Å
734	N	94.5	Very high	94.6	Very high	8 Å²	8	38.4 Å²	38.4	4%	0.043	19%	0.19	C	C	.	.			trans	-84.3	-170.1	173.1	74.7	2.4	0	0	0	112.5	N705 Q736 G737 L738	N705-N734 WeakPolarHBondContact OD1-CB 3.37Å; N705-N734 PolarHBondContact OD1-ND2 2.68Å; N734-Q736 VanDerWaalsContact CG-OE1 3.27Å; N734-Q736 PolarHBondContact ND2-OE1 2.63Å; N734-Q736 PolarHBondContact O-N 2.96Å; N734-Q736 VanDerWaalsContact O-N 3.15Å; N734-Q736 WeakPolarHBondContact OD1-CA 3.27Å; N734-Q736 PolarHBondContact OD1-N 3.41Å; N734-Q736 PolarHBondContact OD1-OE1 3.46Å; N734-G737 PolarHBondContact O-N 3.28Å; N734-G737 PolarHBondContact OD1-N 3.02Å; N734-L738 PolarHBondContact N-O 3.2Å; N734-L738 WeakPolarHBondContact OD1-CB 3.32Å; N734-L738 PolarHBondContact OD1-N 3.39Å; N734-L738 PolarHBondContact OD1-O 3.26Å
735	A	92.9	Very high	94.6	Very high	25 Å²	25	37.5 Å²	37.5	21%	0.207	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-16.6	-178.6	0	0	0	0	0	113.8	E703 L704 R768	E703-A735 WeakPolarHBondContact O-CB 3.47Å; E703-A735 PolarHBondContact O-N 3.32Å; L704-A735 HydrophobicContact CB-CB 4.29Å; L704-A735 HydrophobicContact CD1-CB 4.17Å; L704-A735 HydrophobicContact CG-CB 4.22Å; A735-R768 PolarHBondContact O-NE 3.14Å; A735-R768 VanDerWaalsContact O-NE 3.09Å; A735-R768 PolarHBondContact O-NH1 2.76Å; A735-R768 PolarHBondContact O-NH2 3.32Å
736	Q	91.4	Very high	94.6	Very high	81 Å²	81	31.9 Å²	31.9	38%	0.379	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-0.4	175.2	-63.6	79.8	7.7	0	0	112.4	N734 L738 R768	N734-Q736 VanDerWaalsContact CG-OE1 3.27Å; N734-Q736 PolarHBondContact ND2-OE1 2.63Å; N734-Q736 PolarHBondContact O-N 2.96Å; N734-Q736 VanDerWaalsContact O-N 3.15Å; N734-Q736 WeakPolarHBondContact OD1-CA 3.27Å; N734-Q736 PolarHBondContact OD1-N 3.41Å; N734-Q736 PolarHBondContact OD1-OE1 3.46Å; Q736-L738 VanDerWaalsContact C-N 3.26Å; Q736-L738 HydrophobicContact CB-CD1 3.94Å; Q736-L738 HydrophobicContact CB-CG 3.95Å; Q736-R768 WeakPolarHBondContact O-CB 3.25Å; Q736-R768 VanDerWaalsContact O-CG 3.29Å; Q736-R768 WeakPolarHBondContact O-CG 3.22Å; Q736-R768 PolarHBondContact O-N 3.49Å
737	G	93.3	Very high	94.6	Very high	5 Å²	5	34.4 Å²	34.4	5%	0.052	17%	0.168	C	C	.	.	S	Bend	trans	80.3	5.3	-171.8	0	0	0	0	0	113.5	Q733 N734 D767	Q733-G737 WeakPolarHBondContact CG-O 3.42Å; Q733-G737 PolarHBondContact NE2-O 3.15Å; N734-G737 PolarHBondContact O-N 3.28Å; N734-G737 PolarHBondContact OD1-N 3.02Å; G737-D767 WeakPolarHBondContact O-CA 3.33Å
738	L	94.7	Very high	94.8	Very high	18 Å²	18	28.1 Å²	28.1	9%	0.094	15%	0.145	C	C	.	.			trans	-79.3	138.3	-179	-59	168.6	0	0	0	109.7	H709 Q733 N734 Q736 H742 L743 D767 L776	H709-L738 PolarHBondContact NE2-O 3.2Å; Q733-L738 WeakPolarHBondContact CA-O 3.17Å; N734-L738 PolarHBondContact N-O 3.2Å; N734-L738 WeakPolarHBondContact OD1-CB 3.32Å; N734-L738 PolarHBondContact OD1-N 3.39Å; N734-L738 PolarHBondContact OD1-O 3.26Å; Q736-L738 VanDerWaalsContact C-N 3.26Å; Q736-L738 HydrophobicContact CB-CD1 3.94Å; Q736-L738 HydrophobicContact CB-CG 3.95Å; L738-H742 HydrophobicContact CB-CB 4Å; L738-H742 HydrophobicContact CD2-CB 3.78Å; L738-H742 HydrophobicContact CG-CB 4.49Å; L738-L743 HydrophobicContact CB-CD2 4.39Å; L738-L743 HydrophobicContact CD1-CD2 3.89Å; L738-D767 HydrophobicContact CD2-CB 3.67Å; L738-D767 HydrophobicContact CG-CB 4.4Å; L738-L776 HydrophobicContact CD2-CD1 3.9Å
739	T	96.7	Very high	94.9	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.153	C	C	.	.			trans	-92.8	167.7	170.3	71	0	0	0	0	111	I732 Q733 L741 H742 L743 M765	I732-T739 WeakPolarHBondContact O-CA 3.5Å; Q733-T739 HydrophobicContact CG-CG2 3.92Å; T739-L741 PolarHBondContact O-N 3.12Å; T739-L741 VanDerWaalsContact O-N 3.16Å; T739-L741 PolarHBondContact OG1-N 3.04Å; T739-H742 PolarHBondContact N-ND1 3.17Å; T739-H742 VanDerWaalsContact N-ND1 3.12Å; T739-H742 WeakPolarHBondContact O-CB 3.46Å; T739-H742 PolarHBondContact O-N 3.29Å; T739-H742 PolarHBondContact OG1-N 3.46Å; T739-H742 PolarHBondContact OG1-ND1 3.07Å; T739-L743 PolarHBondContact O-N 3Å; T739-M765 HydrophobicContact CG2-CB 4.34Å; T739-M765 HydrophobicContact CG2-CG 3.95Å; T739-M765 HydrophobicContact CG2-SD 3.24Å; T739-M765 WeakPolarHBondContact CG2-SD 3.36Å
740	P	96.6	Very high	94.9	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-52.8	-34.3	170.2	-27.8	35.2	0	0	0	113.3	L708 A712 V730 I732 L743 A744 L756	L708-P740 HydrophobicContact CB-CG 4.42Å; L708-P740 HydrophobicContact CD2-CB 4.33Å; L708-P740 HydrophobicContact CD2-CG 3.86Å; L708-P740 HydrophobicContact CG-CB 3.99Å; L708-P740 HydrophobicContact CG-CG 3.77Å; A712-P740 HydrophobicContact CB-CB 3.81Å; A712-P740 WeakPolarHBondContact CB-O 3.32Å; V730-P740 WeakPolarHBondContact O-CD 3.37Å; I732-P740 WeakPolarHBondContact O-CD 3.49Å; P740-L743 PolarHBondContact O-N 3.44Å; P740-A744 WeakPolarHBondContact O-CB 3.35Å; P740-A744 PolarHBondContact O-N 3.32Å; P740-L756 HydrophobicContact CB-CD1 4.23Å; P740-L756 HydrophobicContact CB-CD2 4.34Å
741	L	96.7	Very high	95	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-66.1	-42.3	176.2	-175.8	61.5	0	0	0	111.7	T739 L743 A744 S745 V753 L756 I757 A761 P763 P773	T739-L741 PolarHBondContact O-N 3.12Å; T739-L741 VanDerWaalsContact O-N 3.16Å; T739-L741 PolarHBondContact OG1-N 3.04Å; L741-L743 PolarHBondContact O-N 2.97Å; L741-A744 PolarHBondContact O-N 2.92Å; L741-S745 VanDerWaalsContact O-CB 3.29Å; L741-S745 WeakPolarHBondContact O-CB 3.33Å; L741-S745 PolarHBondContact O-N 3.43Å; L741-S745 PolarHBondContact O-OG 2.81Å; L741-V753 HydrophobicContact CD1-CB 4.36Å; L741-V753 HydrophobicContact CD1-CG1 3.94Å; L741-V753 HydrophobicContact CD1-CG2 4.3Å; L741-L756 HydrophobicContact CB-CD1 4.37Å; L741-L756 HydrophobicContact CD1-CB 4.21Å; L741-L756 HydrophobicContact CD1-CD1 4.34Å; L741-I757 HydrophobicContact CD1-CG1 4.22Å; L741-I757 HydrophobicContact CD2-CG1 4.43Å; L741-A761 HydrophobicContact CB-CB 4.27Å; L741-A761 HydrophobicContact CD2-CB 3.96Å; L741-P763 HydrophobicContact CD2-CB 4.19Å; L741-P773 HydrophobicContact CB-CG 4.41Å; L741-P773 HydrophobicContact CD2-CB 4.47Å; L741-P773 HydrophobicContact CD2-CG 3.95Å; L741-P773 HydrophobicContact CG-CB 4.12Å; L741-P773 HydrophobicContact CG-CG 3.86Å
742	H	95.9	Very high	95	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-57.1	-48.2	174.6	-70.8	87	0	0	0	111.7	L738 T739 S745 Q746 M765 R771 P773 L776	L738-H742 HydrophobicContact CB-CB 4Å; L738-H742 HydrophobicContact CD2-CB 3.78Å; L738-H742 HydrophobicContact CG-CB 4.49Å; T739-H742 PolarHBondContact N-ND1 3.17Å; T739-H742 VanDerWaalsContact N-ND1 3.12Å; T739-H742 WeakPolarHBondContact O-CB 3.46Å; T739-H742 PolarHBondContact O-N 3.29Å; T739-H742 PolarHBondContact OG1-N 3.46Å; T739-H742 PolarHBondContact OG1-ND1 3.07Å; H742-S745 PolarHBondContact O-N 2.91Å; H742-Q746 WeakPolarHBondContact O-CB 3.36Å; H742-Q746 PolarHBondContact O-N 2.91Å; H742-M765 PolarHBondContact CE1-O 3.46Å; H742-M765 PolarHBondContact NE2-O 2.99Å; H742-R771 PolarHBondContact NE2-O 2.87Å; H742-R771 VanDerWaalsContact NE2-O 3.14Å; H742-P773 WeakPolarHBondContact NE2-CD 3.48Å; H742-L776 HydrophobicContact CB-CD1 3.71Å
743	L	96.2	Very high	95.1	Very high	7 Å²	7	28.8 Å²	28.8	4%	0.037	15%	0.153	C	C	.	.	H	α-helix	trans	-65.6	-43	-179	-63.4	176.2	0	0	0	112	H709 E713 L738 T739 P740 L741 S745 Q746 R747	H709-L743 HydrophobicContact CB-CD1 3.72Å; E713-L743 HydrophobicContact CB-CB 4.08Å; E713-L743 HydrophobicContact CB-CD1 4.31Å; L738-L743 HydrophobicContact CB-CD2 4.39Å; L738-L743 HydrophobicContact CD1-CD2 3.89Å; T739-L743 PolarHBondContact O-N 3Å; P740-L743 PolarHBondContact O-N 3.44Å; L741-L743 PolarHBondContact O-N 2.97Å; L743-S745 VanDerWaalsContact C-N 3.31Å; L743-S745 PolarHBondContact O-N 2.9Å; L743-Q746 PolarHBondContact O-N 3.45Å; L743-R747 WeakPolarHBondContact O-CG 3.3Å; L743-R747 PolarHBondContact O-N 2.9Å
744	A	96.8	Very high	95.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-63.4	-38.3	175.6	0	0	0	0	0	111.9	A712 P740 L741 G748 H749 T752 V753 L756	A712-A744 HydrophobicContact CB-CB 4.28Å; P740-A744 WeakPolarHBondContact O-CB 3.35Å; P740-A744 PolarHBondContact O-N 3.32Å; L741-A744 PolarHBondContact O-N 2.92Å; A744-G748 PolarHBondContact O-N 3.12Å; A744-G748 VanDerWaalsContact O-N 3.13Å; A744-H749 HydrophobicContact CB-CB 4.49Å; A744-H749 PolarHBondContact O-N 3.34Å; A744-T752 HydrophobicContact CB-CG2 3.93Å; A744-V753 HydrophobicContact CB-CG2 3.79Å; A744-L756 HydrophobicContact CB-CD1 4.04Å
745	S	95.4	Very high	95.2	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-71.3	-39.8	178.3	-67.5	0	0	0	0	113.1	L741 H742 L743 R747 G748 H782	L741-S745 VanDerWaalsContact O-CB 3.29Å; L741-S745 WeakPolarHBondContact O-CB 3.33Å; L741-S745 PolarHBondContact O-N 3.43Å; L741-S745 PolarHBondContact O-OG 2.81Å; H742-S745 PolarHBondContact O-N 2.91Å; L743-S745 VanDerWaalsContact C-N 3.31Å; L743-S745 PolarHBondContact O-N 2.9Å; S745-R747 VanDerWaalsContact C-N 3.26Å; S745-R747 PolarHBondContact O-N 3.41Å; S745-G748 PolarHBondContact O-N 2.89Å; S745-H782 PolarHBondContact O-CD2 3.37Å; S745-H782 VanDerWaalsContact O-CD2 3.26Å
746	Q	94.8	Very high	95.4	Very high	54 Å²	54	27.8 Å²	27.8	25%	0.252	14%	0.143	S	C	.	.	H	α-helix	trans	-63.5	-31.4	176	-171.6	-175.7	14.8	0	0	112.6	H742 L743 L776 H782	H742-Q746 WeakPolarHBondContact O-CB 3.36Å; H742-Q746 PolarHBondContact O-N 2.91Å; L743-Q746 PolarHBondContact O-N 3.45Å; Q746-L776 HydrophobicContact CB-CB 4.15Å; Q746-L776 HydrophobicContact CB-CD1 4.35Å; Q746-H782 PolarHBondContact O-CD2 3.18Å; Q746-H782 PolarHBondContact O-NE2 2.79Å
747	R	95.2	Very high	95.5	Very high	130 Å²	130	25.1 Å²	25.1	49%	0.491	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-2.8	-178.5	-60	-66.4	-168.5	-170.2	1.1	113.9	E713 L743 S745 H749	E713-R747 HydrophobicContact CG-CG 4.07Å; E713-R747 WeakPolarHBondContact O-CG 3.46Å; E713-R747 IonicContact OE1-CZ 2.69Å; E713-R747 IonicContact OE1-NE 3.71Å; E713-R747 IonicContact OE1-NH2 3.2Å; E713-R747 PolarHBondContact OE1-NH2 2.99Å; L743-R747 WeakPolarHBondContact O-CG 3.3Å; L743-R747 PolarHBondContact O-N 2.9Å; S745-R747 VanDerWaalsContact C-N 3.26Å; S745-R747 PolarHBondContact O-N 3.41Å; R747-H749 WeakPolarHBondContact CB-NE2 3.47Å
748	G	93.8	Very high	95.5	Very high	23 Å²	23	28.7 Å²	28.7	24%	0.237	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	19	175.1	0	0	0	0	0	115.5	A744 S745 L750 H782	A744-G748 PolarHBondContact O-N 3.12Å; A744-G748 VanDerWaalsContact O-N 3.13Å; S745-G748 PolarHBondContact O-N 2.89Å; G748-L750 PolarHBondContact O-N 3.14Å; G748-H782 VanDerWaalsContact CA-CD2 3.43Å; G748-H782 WeakPolarHBondContact CA-CD2 3.37Å; G748-H782 VanDerWaalsContact CA-CG 3.44Å; G748-H782 PolarHBondContact N-CD2 2.82Å; G748-H782 VanDerWaalsContact N-CD2 3.28Å; G748-H782 PolarHBondContact N-NE2 3.45Å
749	H	96.2	Very high	95.5	Very high	54 Å²	54	31.5 Å²	31.5	25%	0.25	17%	0.173	C	C	.	.			trans	-80.7	75.3	-173.8	-63.5	-48.9	0	0	0	112.9	A712 E713 G715 A744 R747 A751 T752 V753	A712-H749 PolarHBondContact O-CD2 3.16Å; E713-H749 PolarHBondContact O-CD2 3.34Å; E713-H749 VanDerWaalsContact O-CD2 3.27Å; E713-H749 PolarHBondContact O-NE2 3.28Å; G715-H749 WeakPolarHBondContact CA-CD2 3.5Å; G715-H749 PolarHBondContact N-CD2 3.21Å; G715-H749 VanDerWaalsContact N-CD2 3.25Å; G715-H749 PolarHBondContact N-NE2 2.83Å; A744-H749 HydrophobicContact CB-CB 4.49Å; A744-H749 PolarHBondContact O-N 3.34Å; R747-H749 WeakPolarHBondContact CB-NE2 3.47Å; H749-A751 PolarHBondContact O-N 2.84Å; H749-T752 WeakPolarHBondContact O-CB 3.48Å; H749-T752 PolarHBondContact O-N 2.69Å; H749-V753 WeakPolarHBondContact O-CG2 3.5Å; H749-V753 PolarHBondContact O-N 3.36Å
750	L	94.8	Very high	95.2	Very high	53 Å²	53	33.9 Å²	33.9	28%	0.277	20%	0.197	S	C	.	.	H	α-helix	trans	-48.3	-48.7	-175.7	-176.4	65.8	0	0	0	114.4	G748 T752 V753 K754 E784 V785 E788	G748-L750 PolarHBondContact O-N 3.14Å; L750-T752 VanDerWaalsContact C-N 3.29Å; L750-T752 PolarHBondContact O-N 3.35Å; L750-V753 PolarHBondContact O-N 3.06Å; L750-K754 HydrophobicContact CG-CD 4.44Å; L750-K754 WeakPolarHBondContact O-CG 3.3Å; L750-K754 PolarHBondContact O-N 3.29Å; L750-E784 HydrophobicContact CD1-CB 4.27Å; L750-E784 WeakPolarHBondContact CD1-O 3.4Å; L750-E784 HydrophobicContact CD2-CB 4.1Å; L750-V785 HydrophobicContact CB-CG2 4.17Å; L750-V785 HydrophobicContact CD1-CG2 4.23Å; L750-E788 HydrophobicContact CD1-CB 4.3Å; L750-E788 HydrophobicContact CD1-CG 3.56Å
751	A	95.6	Very high	95.1	Very high	61 Å²	61	34.1 Å²	34.1	50%	0.504	20%	0.2	S	C	.	.	H	α-helix	trans	-64	-36.5	-178.5	0	0	0	0	0	112.2	H749 M755	H749-A751 PolarHBondContact O-N 2.84Å; A751-M755 VanDerWaalsContact O-CB 3.31Å; A751-M755 WeakPolarHBondContact O-CB 3.46Å; A751-M755 PolarHBondContact O-N 3.07Å; A751-M755 VanDerWaalsContact O-N 3.12Å
752	T	95.2	Very high	94.8	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-71.5	-42.4	176.2	-57.8	0	0	0	0	111	A712 G715 T717 A744 H749 L750 M755 L756	A712-T752 HydrophobicContact CB-CG2 4.21Å; G715-T752 PolarHBondContact O-OG1 3.37Å; T717-T752 PolarHBondContact OG1-N 3.49Å; T717-T752 PolarHBondContact OG1-OG1 3.3Å; A744-T752 HydrophobicContact CB-CG2 3.93Å; H749-T752 WeakPolarHBondContact O-CB 3.48Å; H749-T752 PolarHBondContact O-N 2.69Å; L750-T752 VanDerWaalsContact C-N 3.29Å; L750-T752 PolarHBondContact O-N 3.35Å; T752-M755 HydrophobicContact CG2-CE 4.15Å; T752-M755 PolarHBondContact O-N 3.36Å; T752-L756 HydrophobicContact CG2-CD1 3.9Å; T752-L756 HydrophobicContact CG2-CG 4.22Å; T752-L756 WeakPolarHBondContact O-CB 3.3Å; T752-L756 VanDerWaalsContact O-CG 3.29Å; T752-L756 WeakPolarHBondContact O-CG 3.46Å; T752-L756 PolarHBondContact O-N 2.87Å
753	V	96.1	Very high	94.5	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.5	-50.7	175.4	170	0	0	0	0	111.1	L741 A744 H749 L750 M755 L756 I757 V785 L789	L741-V753 HydrophobicContact CD1-CB 4.36Å; L741-V753 HydrophobicContact CD1-CG1 3.94Å; L741-V753 HydrophobicContact CD1-CG2 4.3Å; A744-V753 HydrophobicContact CB-CG2 3.79Å; H749-V753 WeakPolarHBondContact O-CG2 3.5Å; H749-V753 PolarHBondContact O-N 3.36Å; L750-V753 PolarHBondContact O-N 3.06Å; V753-M755 VanDerWaalsContact C-N 3.29Å; V753-M755 PolarHBondContact O-N 2.72Å; V753-L756 PolarHBondContact O-N 3.49Å; V753-I757 HydrophobicContact CG1-CD1 3.82Å; V753-I757 WeakPolarHBondContact O-CG1 3.33Å; V753-I757 PolarHBondContact O-N 3.13Å; V753-V785 HydrophobicContact CG1-CG1 4.29Å; V753-V785 HydrophobicContact CG2-CG1 3.95Å; V753-V785 HydrophobicContact CG2-CG2 4.47Å; V753-L789 HydrophobicContact CG1-CD2 4.2Å; V753-L789 HydrophobicContact CG1-CG 4.43Å
754	K	95.4	Very high	94.1	Very high	91 Å²	91	42.2 Å²	42.2	40%	0.396	24%	0.237	S	C	.	.	H	α-helix	trans	-55.8	-45.3	176.1	-73.6	-176.6	179	-152.7	0	112.1	L750 A758 E788	L750-K754 HydrophobicContact CG-CD 4.44Å; L750-K754 WeakPolarHBondContact O-CG 3.3Å; L750-K754 PolarHBondContact O-N 3.29Å; K754-A758 VanDerWaalsContact O-CB 3.3Å; K754-A758 WeakPolarHBondContact O-CB 3.27Å; K754-A758 PolarHBondContact O-N 2.54Å; K754-E788 VanDerWaalsContact CE-CG 3.41Å; K754-E788 WeakPolarHBondContact CE-OE1 3.35Å; K754-E788 WeakPolarHBondContact CE-OE2 3.25Å; K754-E788 HydrophobicContact CG-CG 4.32Å; K754-E788 VanDerWaalsContact NZ-CD 3.32Å; K754-E788 IonicContact NZ-OE1 3.78Å; K754-E788 PolarHBondContact NZ-OE1 3.44Å; K754-E788 IonicContact NZ-OE2 2.73Å
755	M	96.5	Very high	93.7	Very high	5 Å²	5	44.4 Å²	44.4	3%	0.025	25%	0.248	C	C	.	.	H	α-helix	trans	-65.7	-45.2	179.2	177.9	-78.9	-54.4	0	0	111.5	T717 R721 I724 A751 T752 V753 I757 A758 E759	T717-M755 HydrophobicContact CG2-CB 3.76Å; T717-M755 HydrophobicContact CG2-CE 4.25Å; T717-M755 HydrophobicContact CG2-CG 4.01Å; R721-M755 HydrophobicContact CB-CG 4.26Å; R721-M755 HydrophobicContact CB-SD 4.02Å; R721-M755 VanDerWaalsContact CZ-CG 3.42Å; R721-M755 VanDerWaalsContact NH2-CG 3.26Å; I724-M755 HydrophobicContact CD1-CE 4.36Å; I724-M755 HydrophobicContact CD1-SD 3.83Å; A751-M755 VanDerWaalsContact O-CB 3.31Å; A751-M755 WeakPolarHBondContact O-CB 3.46Å; A751-M755 PolarHBondContact O-N 3.07Å; A751-M755 VanDerWaalsContact O-N 3.12Å; T752-M755 HydrophobicContact CG2-CE 4.15Å; T752-M755 PolarHBondContact O-N 3.36Å; V753-M755 VanDerWaalsContact C-N 3.29Å; V753-M755 PolarHBondContact O-N 2.72Å; M755-I757 PolarHBondContact O-N 3.06Å; M755-A758 PolarHBondContact O-N 3.37Å; M755-E759 HydrophobicContact CG-CG 4.43Å; M755-E759 VanDerWaalsContact O-CG 3.24Å; M755-E759 WeakPolarHBondContact O-CG 3.4Å; M755-E759 PolarHBondContact O-N 3.18Å; M755-E759 HydrophobicContact SD-CG 3.84Å
756	L	95.8	Very high	93.5	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.1	-45.1	178.9	-74.8	171.7	0	0	0	111.7	L708 A712 I724 V730 P740 L741 A744 T752 V753 A758 E759 G760 A761	L708-L756 HydrophobicContact CD1-CD2 4.48Å; A712-L756 HydrophobicContact CB-CD1 4.28Å; I724-L756 HydrophobicContact CD1-CD2 3.8Å; V730-L756 HydrophobicContact CG1-CD2 4.01Å; P740-L756 HydrophobicContact CB-CD1 4.23Å; P740-L756 HydrophobicContact CB-CD2 4.34Å; L741-L756 HydrophobicContact CB-CD1 4.37Å; L741-L756 HydrophobicContact CD1-CB 4.21Å; L741-L756 HydrophobicContact CD1-CD1 4.34Å; A744-L756 HydrophobicContact CB-CD1 4.04Å; T752-L756 HydrophobicContact CG2-CD1 3.9Å; T752-L756 HydrophobicContact CG2-CG 4.22Å; T752-L756 WeakPolarHBondContact O-CB 3.3Å; T752-L756 VanDerWaalsContact O-CG 3.29Å; T752-L756 WeakPolarHBondContact O-CG 3.46Å; T752-L756 PolarHBondContact O-N 2.87Å; V753-L756 PolarHBondContact O-N 3.49Å; L756-A758 PolarHBondContact O-N 3.09Å; L756-E759 CarbonylContact O-C 3.58Å; L756-E759 PolarHBondContact O-N 3.47Å; L756-G760 PolarHBondContact O-N 3.15Å; L756-A761 VanDerWaalsContact C-CB 3.49Å; L756-A761 HydrophobicContact CB-CB 3.93Å; L756-A761 WeakPolarHBondContact O-CB 3.22Å; L756-A761 PolarHBondContact O-N 3.3Å
757	I	94.3	Very high	93.3	Very high	25 Å²	25	43.8 Å²	43.8	13%	0.128	25%	0.249	C	C	.	.	H	α-helix	trans	-61.9	-44.5	175.9	-65.3	169	0	0	0	110.5	L741 V753 M755 E759 G760 L789 H792	L741-I757 HydrophobicContact CD1-CG1 4.22Å; L741-I757 HydrophobicContact CD2-CG1 4.43Å; V753-I757 HydrophobicContact CG1-CD1 3.82Å; V753-I757 WeakPolarHBondContact O-CG1 3.33Å; V753-I757 PolarHBondContact O-N 3.13Å; M755-I757 PolarHBondContact O-N 3.06Å; I757-E759 PolarHBondContact O-N 3.37Å; I757-G760 PolarHBondContact O-N 3.37Å; I757-L789 HydrophobicContact CD1-CD2 4.08Å; I757-H792 HydrophobicContact CG2-CB 4.35Å
758	A	94.1	Very high	93	Very high	81 Å²	81	46 Å²	46	67%	0.669	26%	0.257	S	S	*	.	H	α-helix	trans	-62.8	-29.2	177.8	0	0	0	0	0	113.3	K754 M755 L756 G760	K754-A758 VanDerWaalsContact O-CB 3.3Å; K754-A758 WeakPolarHBondContact O-CB 3.27Å; K754-A758 PolarHBondContact O-N 2.54Å; M755-A758 PolarHBondContact O-N 3.37Å; L756-A758 PolarHBondContact O-N 3.09Å; A758-G760 VanDerWaalsContact C-N 3.32Å
759	E	92.7	Very high	92.7	Very high	76 Å²	76	46.7 Å²	46.7	36%	0.355	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	10.3	176.3	-59.1	-73.6	170.9	0	0	112.8	R721 I724 M755 L756 I757	R721-E759 IonicContact CZ-OE1 2.6Å; R721-E759 IonicContact NH1-OE1 3.48Å; R721-E759 PolarHBondContact NH1-OE1 3.34Å; I724-E759 HydrophobicContact CD1-CB 4.16Å; I724-E759 HydrophobicContact CD1-CG 4.29Å; I724-E759 HydrophobicContact CG2-CB 4.09Å; I724-E759 HydrophobicContact CG2-CG 4.39Å; M755-E759 HydrophobicContact CG-CG 4.43Å; M755-E759 VanDerWaalsContact O-CG 3.24Å; M755-E759 WeakPolarHBondContact O-CG 3.4Å; M755-E759 PolarHBondContact O-N 3.18Å; M755-E759 HydrophobicContact SD-CG 3.84Å; L756-E759 CarbonylContact O-C 3.58Å; L756-E759 PolarHBondContact O-N 3.47Å; I757-E759 PolarHBondContact O-N 3.37Å
760	G	91.1	Very high	92.4	Very high	50 Å²	50	49.1 Å²	49.1	52%	0.515	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.4	22.8	171.7	0	0	0	0	0	116.2	N731 L756 I757 A758	N731-G760 PolarHBondContact ND2-O 2.97Å; L756-G760 PolarHBondContact O-N 3.15Å; I757-G760 PolarHBondContact O-N 3.37Å; A758-G760 VanDerWaalsContact C-N 3.32Å
761	A	93.8	Very high	92.1	Very high	6 Å²	6	49.2 Å²	49.2	5%	0.05	27%	0.265	C	S	.	.			trans	-64.2	134	169.9	0	0	0	0	0	111.2	V730 N731 L741 L756 P763	V730-A761 HydrophobicContact CG1-CB 3.52Å; N731-A761 WeakPolarHBondContact OD1-CA 3.07Å; L741-A761 HydrophobicContact CB-CB 4.27Å; L741-A761 HydrophobicContact CD2-CB 3.96Å; L756-A761 VanDerWaalsContact C-CB 3.49Å; L756-A761 HydrophobicContact CB-CB 3.93Å; L756-A761 WeakPolarHBondContact O-CB 3.22Å; L756-A761 PolarHBondContact O-N 3.3Å; A761-P763 VanDerWaalsContact O-CD 3.31Å; A761-P763 WeakPolarHBondContact O-CD 3.36Å
762	D	91.3	Very high	91.9	Very high	63 Å²	63	46.6 Å²	46.6	34%	0.337	24%	0.243	S	C	.	.			trans	-83.3	113.5	177.2	-173.8	-6.4	0	0	0	110.7	N731 Y764 M765	N731-D762 PolarHBondContact OD1-N 2.91Å; D762-Y764 PolarHBondContact O-N 3.45Å; D762-Y764 WeakPolarHBondContact OD1-CB 3.4Å; D762-Y764 PolarHBondContact OD1-N 3.12Å; D762-M765 HydrophobicContact CB-CB 4.49Å
763	P	89.1	Confident	91.8	Very high	16 Å²	16	46.6 Å²	46.6	10%	0.104	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-6	179	34.4	-36.5	0	0	0	113.8	L741 A761 P773 L789 C793	L741-P763 HydrophobicContact CD2-CB 4.19Å; A761-P763 VanDerWaalsContact O-CD 3.31Å; A761-P763 WeakPolarHBondContact O-CD 3.36Å; P763-P773 WeakPolarHBondContact O-CD 3.27Å; P763-L789 HydrophobicContact CB-CD2 4.46Å; P763-C793 HydrophobicContact CB-CB 4.33Å; P763-C793 HydrophobicContact CG-CB 4.15Å
764	Y	87.6	Confident	91.6	Very high	98 Å²	98	46.6 Å²	46.6	38%	0.384	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-6.5	178.4	-65.7	-82.8	0	0	0	113.6	D762 S766 I772 C793 L799	D762-Y764 PolarHBondContact O-N 3.45Å; D762-Y764 WeakPolarHBondContact OD1-CB 3.4Å; D762-Y764 PolarHBondContact OD1-N 3.12Å; Y764-S766 PolarHBondContact O-N 3.3Å; Y764-I772 WeakPolarHBondContact O-CG2 3.48Å; Y764-C793 HydrophobicContact CE1-CB 3.84Å; Y764-C793 HydrophobicContact CE2-CB 3.81Å; Y764-C793 VanDerWaalsContact CZ-CB 3.43Å; Y764-C793 WeakPolarHBondContact OH-CA 3.24Å; Y764-C793 WeakPolarHBondContact OH-CB 3.44Å; Y764-L799 HydrophobicContact CD1-CD1 4.45Å
765	M	89.9	Confident	91.3	Very high	46 Å²	46	42.3 Å²	42.3	23%	0.227	22%	0.224	C	C	.	.			trans	-62.4	131.5	176.5	-170.2	165.9	-64.8	0	0	109.5	N731 Q733 T739 H742 D762	N731-M765 HydrophobicContact CB-CE 3.88Å; Q733-M765 HydrophobicContact CG-SD 3.76Å; T739-M765 HydrophobicContact CG2-CB 4.34Å; T739-M765 HydrophobicContact CG2-CG 3.95Å; T739-M765 HydrophobicContact CG2-SD 3.24Å; T739-M765 WeakPolarHBondContact CG2-SD 3.36Å; H742-M765 PolarHBondContact CE1-O 3.46Å; H742-M765 PolarHBondContact NE2-O 2.99Å; D762-M765 HydrophobicContact CB-CB 4.49Å
766	S	89.8	Confident	91.1	Very high	33 Å²	33	42 Å²	42	23%	0.231	22%	0.223	C	C	.	.			trans	-102.5	148.6	179.2	63.3	0	0	0	0	111.8	Q733 Y764 Q770 R771	Q733-S766 PolarHBondContact NE2-O 3.27Å; Y764-S766 PolarHBondContact O-N 3.3Å; S766-Q770 PolarHBondContact OG-OE1 2.84Å; S766-R771 WeakPolarHBondContact CA-O 3.39Å
767	D	90.6	Very high	91	Very high	8 Å²	8	42 Å²	42	4%	0.043	22%	0.223	C	C	.	.			trans	-76.9	-175	170.9	79.6	-2.5	0	0	0	111.9	G737 L738 T769 Q770 R771	G737-D767 WeakPolarHBondContact O-CA 3.33Å; L738-D767 HydrophobicContact CD2-CB 3.67Å; L738-D767 HydrophobicContact CG-CB 4.4Å; D767-T769 PolarHBondContact O-N 3.4Å; D767-T769 VanDerWaalsContact O-N 3.16Å; D767-T769 VanDerWaalsContact OD1-C 3.3Å; D767-T769 VanDerWaalsContact OD1-CA 3.27Å; D767-T769 WeakPolarHBondContact OD1-CA 3.31Å; D767-T769 WeakPolarHBondContact OD1-CB 3.31Å; D767-T769 PolarHBondContact OD1-N 3.09Å; D767-T769 PolarHBondContact OD1-OG1 3.46Å; D767-T769 PolarHBondContact OD2-OG1 3.28Å; D767-Q770 PolarHBondContact O-N 3.37Å; D767-Q770 PolarHBondContact OD1-N 2.69Å; D767-R771 PolarHBondContact N-O 3.29Å; D767-R771 WeakPolarHBondContact OD1-CB 3.36Å; D767-R771 PolarHBondContact OD1-N 3.15Å; D767-R771 IonicContact OD2-CZ 3.62Å; D767-R771 IonicContact OD2-NE 3.85Å; D767-R771 PolarHBondContact OD2-NE 3.38Å; D767-R771 IonicContact OD2-NH2 3.96Å; D767-R771 PolarHBondContact OD2-NH2 3.42Å
768	R	89.6	Confident	90.9	Very high	175 Å²	175	40.9 Å²	40.9	66%	0.66	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-23.2	178.2	-75.1	-179.8	178.1	-170.9	2	114.3	A735 Q736 Q770	A735-R768 PolarHBondContact O-NE 3.14Å; A735-R768 VanDerWaalsContact O-NE 3.09Å; A735-R768 PolarHBondContact O-NH1 2.76Å; A735-R768 PolarHBondContact O-NH2 3.32Å; Q736-R768 WeakPolarHBondContact O-CB 3.25Å; Q736-R768 VanDerWaalsContact O-CG 3.29Å; Q736-R768 WeakPolarHBondContact O-CG 3.22Å; Q736-R768 PolarHBondContact O-N 3.49Å; R768-Q770 VanDerWaalsContact C-N 3.32Å
769	T	88.2	Confident	90.7	Very high	39 Å²	39	40.2 Å²	40.2	24%	0.239	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	14.2	177.2	55.5	0	0	0	0	112.7	D767 R771 Q802	D767-T769 PolarHBondContact O-N 3.4Å; D767-T769 VanDerWaalsContact O-N 3.16Å; D767-T769 VanDerWaalsContact OD1-C 3.3Å; D767-T769 VanDerWaalsContact OD1-CA 3.27Å; D767-T769 WeakPolarHBondContact OD1-CA 3.31Å; D767-T769 WeakPolarHBondContact OD1-CB 3.31Å; D767-T769 PolarHBondContact OD1-N 3.09Å; D767-T769 PolarHBondContact OD1-OG1 3.46Å; D767-T769 PolarHBondContact OD2-OG1 3.28Å; T769-R771 PolarHBondContact O-N 3.42Å; T769-R771 WeakPolarHBondContact OG1-CG 3.3Å; T769-R771 PolarHBondContact OG1-NE 3.49Å; T769-Q802 VanDerWaalsContact O-CB 3.26Å; T769-Q802 WeakPolarHBondContact O-CB 3.47Å; T769-Q802 PolarHBondContact O-N 3.2Å
770	Q	88.8	Confident	90.7	Very high	105 Å²	105	39.8 Å²	39.8	49%	0.491	20%	0.2	S	C	.	.	S	Bend	trans	60.4	20.6	-174.7	-59.6	-61.3	-33.9	0	0	114	S766 D767 R768 Q802	S766-Q770 PolarHBondContact OG-OE1 2.84Å; D767-Q770 PolarHBondContact O-N 3.37Å; D767-Q770 PolarHBondContact OD1-N 2.69Å; R768-Q770 VanDerWaalsContact C-N 3.32Å; Q770-Q802 HydrophobicContact CB-CB 4.46Å
771	R	89	Confident	90.7	Very high	55 Å²	55	38.4 Å²	38.4	21%	0.208	19%	0.185	C	C	.	.			trans	-87.9	127.9	175.4	-67.2	-176.4	-60	176	-0.7	109.8	H742 S766 D767 T769 H775 E779 D801	H742-R771 PolarHBondContact NE2-O 2.87Å; H742-R771 VanDerWaalsContact NE2-O 3.14Å; S766-R771 WeakPolarHBondContact CA-O 3.39Å; D767-R771 PolarHBondContact N-O 3.29Å; D767-R771 WeakPolarHBondContact OD1-CB 3.36Å; D767-R771 PolarHBondContact OD1-N 3.15Å; D767-R771 IonicContact OD2-CZ 3.62Å; D767-R771 IonicContact OD2-NE 3.85Å; D767-R771 PolarHBondContact OD2-NE 3.38Å; D767-R771 IonicContact OD2-NH2 3.96Å; D767-R771 PolarHBondContact OD2-NH2 3.42Å; T769-R771 PolarHBondContact O-N 3.42Å; T769-R771 WeakPolarHBondContact OG1-CG 3.3Å; T769-R771 PolarHBondContact OG1-NE 3.49Å; R771-H775 HydrophobicContact CB-CB 3.98Å; R771-H775 HydrophobicContact CG-CB 4.17Å; R771-E779 IonicContact NH1-OE1 3.67Å; R771-E779 IonicContact NH1-OE2 3.32Å; R771-E779 PolarHBondContact NH1-OE2 2.95Å; R771-D801 HydrophobicContact CG-CB 3.61Å
772	I	91.7	Very high	90.7	Very high	6 Å²	6	40.7 Å²	40.7	3%	0.031	20%	0.195	C	C	.	.			trans	-88.2	166	169.1	61.2	159.3	0	0	0	110.8	Y764 C774 H775 L799	Y764-I772 WeakPolarHBondContact O-CG2 3.48Å; I772-C774 HydrophobicContact CD1-CB 3.71Å; I772-C774 HydrophobicContact CG1-CB 4.01Å; I772-C774 PolarHBondContact O-N 3.15Å; I772-H775 WeakPolarHBondContact CG1-ND1 3.32Å; I772-H775 PolarHBondContact N-ND1 3.3Å; I772-H775 WeakPolarHBondContact O-CB 3.26Å; I772-H775 PolarHBondContact O-N 3.38Å; I772-L799 HydrophobicContact CD1-CD1 3.87Å
773	P	92.7	Very high	90.7	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-54	-29.2	-178.9	-27.3	35.7	0	0	0	114.5	L741 H742 P763 L776 A777 L789	L741-P773 HydrophobicContact CB-CG 4.41Å; L741-P773 HydrophobicContact CD2-CB 4.47Å; L741-P773 HydrophobicContact CD2-CG 3.95Å; L741-P773 HydrophobicContact CG-CB 4.12Å; L741-P773 HydrophobicContact CG-CG 3.86Å; H742-P773 WeakPolarHBondContact NE2-CD 3.48Å; P763-P773 WeakPolarHBondContact O-CD 3.27Å; P773-L776 PolarHBondContact O-N 3.29Å; P773-A777 PolarHBondContact O-N 3.46Å; P773-L789 HydrophobicContact CB-CD1 4.17Å; P773-L789 HydrophobicContact CB-CD2 4.32Å
774	C	91.2	Very high	90.7	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.3	-40.5	175	-171	0	0	0	0	112.7	I772 A777 A778 L786 S796	I772-C774 HydrophobicContact CD1-CB 3.71Å; I772-C774 HydrophobicContact CG1-CB 4.01Å; I772-C774 PolarHBondContact O-N 3.15Å; C774-A777 PolarHBondContact O-N 2.93Å; C774-A778 WeakPolarHBondContact O-CB 2.99Å; C774-A778 PolarHBondContact O-N 3.17Å; C774-L786 HydrophobicContact CB-CD1 4.5Å; C774-L786 WeakPolarHBondContact SG-CD1 3.35Å; C774-S796 PolarHBondContact SG-OG 2.96Å; C774-S796 VanDerWaalsContact SG-OG 3.39Å
775	H	90.8	Very high	91	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-61.9	-46.6	175.8	-67.5	84.4	0	0	0	110.7	R771 I772 A778 E779 L799 L810	R771-H775 HydrophobicContact CB-CB 3.98Å; R771-H775 HydrophobicContact CG-CB 4.17Å; I772-H775 WeakPolarHBondContact CG1-ND1 3.32Å; I772-H775 PolarHBondContact N-ND1 3.3Å; I772-H775 WeakPolarHBondContact O-CB 3.26Å; I772-H775 PolarHBondContact O-N 3.38Å; H775-A778 PolarHBondContact O-N 2.97Å; H775-E779 WeakPolarHBondContact O-CB 3.26Å; H775-E779 PolarHBondContact O-N 3.29Å; H775-L799 PolarHBondContact NE2-O 3.11Å; H775-L799 VanDerWaalsContact NE2-O 3.14Å; H775-L810 HydrophobicContact CB-CD1 3.76Å
776	L	91.7	Very high	91	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-67.3	-38	-178.5	-57.6	-179.7	0	0	0	112.3	L738 H742 Q746 P773 A778 N780	L738-L776 HydrophobicContact CD2-CD1 3.9Å; H742-L776 HydrophobicContact CB-CD1 3.71Å; Q746-L776 HydrophobicContact CB-CB 4.15Å; Q746-L776 HydrophobicContact CB-CD1 4.35Å; P773-L776 PolarHBondContact O-N 3.29Å; L776-A778 VanDerWaalsContact C-N 3.33Å; L776-N780 PolarHBondContact O-N 3.37Å; L776-N780 PolarHBondContact O-ND2 3.4Å
777	A	93.3	Very high	91	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-65.4	-38.2	174.7	0	0	0	0	0	111.7	P773 C774 G781 H782 V785 L786 L789	P773-A777 PolarHBondContact O-N 3.46Å; C774-A777 PolarHBondContact O-N 2.93Å; A777-G781 PolarHBondContact O-N 3.48Å; A777-H782 PolarHBondContact O-N 3.15Å; A777-V785 HydrophobicContact CB-CG1 3.98Å; A777-L786 HydrophobicContact CB-CB 4.35Å; A777-L786 HydrophobicContact CB-CD1 4.48Å; A777-L789 HydrophobicContact CB-CD1 4.01Å
778	A	91.3	Very high	91	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-73.2	-41.6	179.1	0	0	0	0	0	112.8	C774 H775 L776 N780 G781 L786 P807 A811 H816 V819 L823	C774-A778 WeakPolarHBondContact O-CB 2.99Å; C774-A778 PolarHBondContact O-N 3.17Å; H775-A778 PolarHBondContact O-N 2.97Å; L776-A778 VanDerWaalsContact C-N 3.33Å; A778-N780 VanDerWaalsContact C-N 3.26Å; A778-N780 PolarHBondContact O-N 3.35Å; A778-G781 PolarHBondContact O-N 3.21Å; A778-L786 HydrophobicContact CB-CD1 4.47Å; A778-L786 HydrophobicContact CB-CD2 4.47Å; A778-P807 HydrophobicContact CB-CB 3.74Å; A778-P807 VanDerWaalsContact CB-O 3.31Å; A778-P807 WeakPolarHBondContact CB-O 3.47Å; A778-A811 HydrophobicContact CB-CB 4.36Å; A778-H816 PolarHBondContact O-CD2 3.26Å; A778-H816 VanDerWaalsContact O-CD2 3.31Å; A778-V819 HydrophobicContact CB-CG1 3.99Å; A778-L823 HydrophobicContact CB-CD1 4.34Å
779	E	91.8	Very high	91	Very high	68 Å²	68	33.5 Å²	33.5	32%	0.318	17%	0.166	S	C	.	.	H	α-helix	trans	-58.1	-37.2	175.1	-174.6	180	-175.2	0	0	112.2	R771 H775 L810 H816	R771-E779 IonicContact NH1-OE1 3.67Å; R771-E779 IonicContact NH1-OE2 3.32Å; R771-E779 PolarHBondContact NH1-OE2 2.95Å; H775-E779 WeakPolarHBondContact O-CB 3.26Å; H775-E779 PolarHBondContact O-N 3.29Å; E779-L810 HydrophobicContact CB-CB 4.15Å; E779-L810 HydrophobicContact CB-CD1 4.44Å; E779-H816 PolarHBondContact O-CD2 3.18Å; E779-H816 PolarHBondContact O-NE2 3.29Å
780	N	91.5	Very high	90.9	Very high	66 Å²	66	34 Å²	34	35%	0.353	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	5.4	-178.9	-65.1	-78.7	0	0	0	114.1	L776 A778 H782	L776-N780 PolarHBondContact O-N 3.37Å; L776-N780 PolarHBondContact O-ND2 3.4Å; A778-N780 VanDerWaalsContact C-N 3.26Å; A778-N780 PolarHBondContact O-N 3.35Å; N780-H782 PolarHBondContact O-N 3.03Å
781	G	90.5	Very high	90.7	Very high	21 Å²	21	34.9 Å²	34.9	22%	0.216	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.6	19.6	173.3	0	0	0	0	0	115.6	A777 A778 S783 H816	A777-G781 PolarHBondContact O-N 3.48Å; A778-G781 PolarHBondContact O-N 3.21Å; G781-S783 PolarHBondContact O-N 3.36Å; G781-H816 PolarHBondContact N-CD2 3.37Å; G781-H816 PolarHBondContact N-NE2 3.36Å
782	H	94.4	Very high	90.4	Very high	54 Å²	54	37 Å²	37	25%	0.25	19%	0.186	C	C	.	.			trans	-82.9	74.7	-175.9	-62.2	-44	0	0	0	112.5	S745 Q746 G748 A777 N780 E784 V785 L786	S745-H782 PolarHBondContact O-CD2 3.37Å; S745-H782 VanDerWaalsContact O-CD2 3.26Å; Q746-H782 PolarHBondContact O-CD2 3.18Å; Q746-H782 PolarHBondContact O-NE2 2.79Å; G748-H782 VanDerWaalsContact CA-CD2 3.43Å; G748-H782 WeakPolarHBondContact CA-CD2 3.37Å; G748-H782 VanDerWaalsContact CA-CG 3.44Å; G748-H782 PolarHBondContact N-CD2 2.82Å; G748-H782 VanDerWaalsContact N-CD2 3.28Å; G748-H782 PolarHBondContact N-NE2 3.45Å; A777-H782 PolarHBondContact O-N 3.15Å; N780-H782 PolarHBondContact O-N 3.03Å; H782-E784 PolarHBondContact O-N 3.22Å; H782-V785 HydrophobicContact CB-CB 4.06Å; H782-V785 HydrophobicContact CB-CG2 4.34Å; H782-V785 PolarHBondContact O-N 3.42Å; H782-L786 WeakPolarHBondContact O-CB 3.17Å; H782-L786 PolarHBondContact O-N 2.83Å
783	S	90.5	Very high	89.7	Confident	25 Å²	25	36.7 Å²	36.7	18%	0.175	18%	0.184	C	C	.	.	H	α-helix	trans	-54.5	-44.3	-174.6	61	0	0	0	0	114.5	G781 L786 K787 M822	G781-S783 PolarHBondContact O-N 3.36Å; S783-L786 PolarHBondContact O-N 3.32Å; S783-K787 WeakPolarHBondContact O-CB 3.49Å; S783-K787 PolarHBondContact O-N 3.19Å; S783-M822 WeakPolarHBondContact O-CE 3.43Å
784	E	91	Very high	88.7	Confident	103 Å²	103	41 Å²	41	48%	0.481	21%	0.212	S	C	.	.	H	α-helix	trans	-69.2	-38.3	-178.7	-63	-55.3	120.6	0	0	112.5	L750 H782 K787 E788	L750-E784 HydrophobicContact CD1-CB 4.27Å; L750-E784 WeakPolarHBondContact CD1-O 3.4Å; L750-E784 HydrophobicContact CD2-CB 4.1Å; H782-E784 PolarHBondContact O-N 3.22Å; E784-K787 WeakPolarHBondContact O-CB 3.11Å; E784-K787 PolarHBondContact O-N 3.23Å; E784-E788 PolarHBondContact O-N 2.92Å
785	V	92.3	Very high	87.8	Confident	2 Å²	2	46.6 Å²	46.6	1%	0.012	24%	0.242	C	C	.	.	H	α-helix	trans	-65.8	-45.1	174.4	169.8	0	0	0	0	110.1	L750 V753 A777 H782 K787 E788 L789	L750-V785 HydrophobicContact CB-CG2 4.17Å; L750-V785 HydrophobicContact CD1-CG2 4.23Å; V753-V785 HydrophobicContact CG1-CG1 4.29Å; V753-V785 HydrophobicContact CG2-CG1 3.95Å; V753-V785 HydrophobicContact CG2-CG2 4.47Å; A777-V785 HydrophobicContact CB-CG1 3.98Å; H782-V785 HydrophobicContact CB-CB 4.06Å; H782-V785 HydrophobicContact CB-CG2 4.34Å; H782-V785 PolarHBondContact O-N 3.42Å; V785-K787 VanDerWaalsContact C-N 3.28Å; V785-K787 PolarHBondContact O-N 2.89Å; V785-E788 PolarHBondContact O-N 2.92Å; V785-L789 HydrophobicContact CG1-CD1 3.88Å; V785-L789 HydrophobicContact CG1-CG 4.32Å; V785-L789 WeakPolarHBondContact O-CG 3.25Å; V785-L789 PolarHBondContact O-N 2.76Å
786	L	90.2	Very high	86.8	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-59.8	-40.4	177.6	-177.6	67.1	0	0	0	111.5	C774 A777 A778 H782 S783 E788 L789 I790 V819 L823	C774-L786 HydrophobicContact CB-CD1 4.5Å; C774-L786 WeakPolarHBondContact SG-CD1 3.35Å; A777-L786 HydrophobicContact CB-CB 4.35Å; A777-L786 HydrophobicContact CB-CD1 4.48Å; A778-L786 HydrophobicContact CB-CD1 4.47Å; A778-L786 HydrophobicContact CB-CD2 4.47Å; H782-L786 WeakPolarHBondContact O-CB 3.17Å; H782-L786 PolarHBondContact O-N 2.83Å; S783-L786 PolarHBondContact O-N 3.32Å; L786-E788 VanDerWaalsContact C-N 3.34Å; L786-E788 PolarHBondContact O-N 3.45Å; L786-L789 PolarHBondContact O-N 3.49Å; L786-I790 HydrophobicContact CD1-CD1 4.08Å; L786-I790 HydrophobicContact CD1-CG1 4.26Å; L786-I790 HydrophobicContact CD2-CD1 4.34Å; L786-I790 HydrophobicContact CG-CD1 3.75Å; L786-I790 HydrophobicContact CG-CG1 4.33Å; L786-I790 WeakPolarHBondContact O-CB 3.47Å; L786-I790 VanDerWaalsContact O-CG1 3.26Å; L786-I790 WeakPolarHBondContact O-CG1 3.25Å; L786-I790 PolarHBondContact O-N 2.8Å; L786-V819 HydrophobicContact CD2-CB 4.2Å; L786-V819 HydrophobicContact CD2-CG1 3.39Å; L786-V819 HydrophobicContact CD2-CG2 4.09Å; L786-L823 HydrophobicContact CD2-CD1 4.06Å; L786-L823 HydrophobicContact CD2-CD2 4.18Å; L786-L823 HydrophobicContact CD2-CG 3.97Å
787	K	89.4	Confident	85.4	Confident	120 Å²	120	47.7 Å²	47.7	52%	0.522	25%	0.254	S	S	.	.	H	α-helix	trans	-57.8	-46.9	176	-166.5	175.9	177.7	177.6	0	112.1	S783 E784 V785 L791 M822	S783-K787 WeakPolarHBondContact O-CB 3.49Å; S783-K787 PolarHBondContact O-N 3.19Å; E784-K787 WeakPolarHBondContact O-CB 3.11Å; E784-K787 PolarHBondContact O-N 3.23Å; V785-K787 VanDerWaalsContact C-N 3.28Å; V785-K787 PolarHBondContact O-N 2.89Å; K787-L791 PolarHBondContact O-N 3.42Å; K787-M822 HydrophobicContact CB-CE 3.57Å; K787-M822 HydrophobicContact CG-CE 4.06Å
788	E	91.1	Very high	84.2	Confident	39 Å²	39	50.7 Å²	50.7	18%	0.182	28%	0.284	C	S	.	.	H	α-helix	trans	-68.6	-38.4	178.4	-68.4	-68.2	161.4	0	0	112	L750 K754 E784 V785 L786 L791 H792	L750-E788 HydrophobicContact CD1-CB 4.3Å; L750-E788 HydrophobicContact CD1-CG 3.56Å; K754-E788 VanDerWaalsContact CE-CG 3.41Å; K754-E788 WeakPolarHBondContact CE-OE1 3.35Å; K754-E788 WeakPolarHBondContact CE-OE2 3.25Å; K754-E788 HydrophobicContact CG-CG 4.32Å; K754-E788 VanDerWaalsContact NZ-CD 3.32Å; K754-E788 IonicContact NZ-OE1 3.78Å; K754-E788 PolarHBondContact NZ-OE1 3.44Å; K754-E788 IonicContact NZ-OE2 2.73Å; E784-E788 PolarHBondContact O-N 2.92Å; V785-E788 PolarHBondContact O-N 2.92Å; L786-E788 VanDerWaalsContact C-N 3.34Å; L786-E788 PolarHBondContact O-N 3.45Å; E788-L791 WeakPolarHBondContact O-CB 3.38Å; E788-L791 PolarHBondContact O-N 3.43Å; E788-H792 PolarHBondContact O-CD2 3.49Å; E788-H792 VanDerWaalsContact O-CD2 3.31Å; E788-H792 PolarHBondContact O-N 2.7Å
789	L	89.1	Confident	83.6	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-61.9	-52.5	174	-71.1	171.1	0	0	0	110.3	V753 I757 P763 P773 A777 V785 L786 L791 H792 C793	V753-L789 HydrophobicContact CG1-CD2 4.2Å; V753-L789 HydrophobicContact CG1-CG 4.43Å; I757-L789 HydrophobicContact CD1-CD2 4.08Å; P763-L789 HydrophobicContact CB-CD2 4.46Å; P773-L789 HydrophobicContact CB-CD1 4.17Å; P773-L789 HydrophobicContact CB-CD2 4.32Å; A777-L789 HydrophobicContact CB-CD1 4.01Å; V785-L789 HydrophobicContact CG1-CD1 3.88Å; V785-L789 HydrophobicContact CG1-CG 4.32Å; V785-L789 WeakPolarHBondContact O-CG 3.25Å; V785-L789 PolarHBondContact O-N 2.76Å; L786-L789 PolarHBondContact O-N 3.49Å; L789-L791 PolarHBondContact O-N 2.8Å; L789-H792 CarbonylContact O-C 3.59Å; L789-H792 WeakPolarHBondContact O-CA 3.44Å; L789-H792 PolarHBondContact O-N 3.07Å; L789-C793 VanDerWaalsContact C-SG 3.55Å; L789-C793 PolarHBondContact O-N 2.98Å; L789-C793 PolarHBondContact O-SG 2.69Å
790	I	86.9	Confident	83.3	Confident	48 Å²	48	54 Å²	54	25%	0.246	31%	0.309	C	S	.	.	H	α-helix	trans	-56.9	-36.2	178.8	-67.9	167.4	0	0	0	111.9	L786 H792 C793 P794 L823	L786-I790 HydrophobicContact CD1-CD1 4.08Å; L786-I790 HydrophobicContact CD1-CG1 4.26Å; L786-I790 HydrophobicContact CD2-CD1 4.34Å; L786-I790 HydrophobicContact CG-CD1 3.75Å; L786-I790 HydrophobicContact CG-CG1 4.33Å; L786-I790 WeakPolarHBondContact O-CB 3.47Å; L786-I790 VanDerWaalsContact O-CG1 3.26Å; L786-I790 WeakPolarHBondContact O-CG1 3.25Å; L786-I790 PolarHBondContact O-N 2.8Å; I790-H792 VanDerWaalsContact C-N 3.26Å; I790-H792 PolarHBondContact O-N 3.27Å; I790-C793 CarbonylContact O-C 3.08Å; I790-C793 VanDerWaalsContact O-C 3.28Å; I790-C793 PolarHBondContact O-N 3.39Å; I790-P794 WeakPolarHBondContact O-CA 3.4Å; I790-P794 VanDerWaalsContact O-N 3.17Å; I790-L823 HydrophobicContact CD1-CD2 3.7Å
791	L	85.6	Confident	83	Confident	124 Å²	124	51.5 Å²	51.5	65%	0.649	30%	0.296	S	S	*	.	H	α-helix	trans	-59.8	-37.9	175.5	-179	64.2	0	0	0	112.3	K787 E788 L789	K787-L791 PolarHBondContact O-N 3.42Å; E788-L791 WeakPolarHBondContact O-CB 3.38Å; E788-L791 PolarHBondContact O-N 3.43Å; L789-L791 PolarHBondContact O-N 2.8Å
792	H	81.6	Confident	82.7	Confident	99 Å²	99	56.7 Å²	56.7	46%	0.458	32%	0.315	S	S	.	.	H	α-helix	trans	-95.6	-15.8	-179	-72	-72.1	0	0	0	113.8	I757 E788 L789 I790	I757-H792 HydrophobicContact CG2-CB 4.35Å; E788-H792 PolarHBondContact O-CD2 3.49Å; E788-H792 VanDerWaalsContact O-CD2 3.31Å; E788-H792 PolarHBondContact O-N 2.7Å; L789-H792 CarbonylContact O-C 3.59Å; L789-H792 WeakPolarHBondContact O-CA 3.44Å; L789-H792 PolarHBondContact O-N 3.07Å; I790-H792 VanDerWaalsContact C-N 3.26Å; I790-H792 PolarHBondContact O-N 3.27Å
793	C	77.1	Confident	82.1	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.33	C	S	.	.			trans	-140.6	79.9	174.2	54.4	0	0	0	0	111.4	P763 Y764 L789 I790 D795 S796	P763-C793 HydrophobicContact CB-CB 4.33Å; P763-C793 HydrophobicContact CG-CB 4.15Å; Y764-C793 HydrophobicContact CE1-CB 3.84Å; Y764-C793 HydrophobicContact CE2-CB 3.81Å; Y764-C793 VanDerWaalsContact CZ-CB 3.43Å; Y764-C793 WeakPolarHBondContact OH-CA 3.24Å; Y764-C793 WeakPolarHBondContact OH-CB 3.44Å; L789-C793 VanDerWaalsContact C-SG 3.55Å; L789-C793 PolarHBondContact O-N 2.98Å; L789-C793 PolarHBondContact O-SG 2.69Å; I790-C793 CarbonylContact O-C 3.08Å; I790-C793 VanDerWaalsContact O-C 3.28Å; I790-C793 PolarHBondContact O-N 3.39Å; C793-D795 VanDerWaalsContact C-N 3.3Å; C793-D795 PolarHBondContact O-N 3.05Å; C793-S796 WeakPolarHBondContact O-CB 3.44Å; C793-S796 PolarHBondContact O-N 3.44Å; C793-S796 VanDerWaalsContact O-N 3.11Å; C793-S796 PolarHBondContact O-OG 2.6Å; C793-S796 VanDerWaalsContact SG-CB 3.55Å; C793-S796 PolarHBondContact SG-OG 2.8Å; C793-S796 VanDerWaalsContact SG-OG 3.38Å
794	P	72	Confident	81.8	Confident	90 Å²	90	60.6 Å²	60.6	58%	0.584	34%	0.341	S	S	*	.	G	3₁₀ helix	trans	-65.1	-30.6	-174.9	22.6	-32.2	0	0	0	113.5	I790 S796	I790-P794 WeakPolarHBondContact O-CA 3.4Å; I790-P794 VanDerWaalsContact O-N 3.17Å; P794-S796 PolarHBondContact O-N 2.86Å
795	D	71.9	Confident	81.6	Confident	119 Å²	119	58.3 Å²	58.3	64%	0.636	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-76.1	-7.8	178.3	-57.7	-40.9	0	0	0	113.2	C793 G797 G798	C793-D795 VanDerWaalsContact C-N 3.3Å; C793-D795 PolarHBondContact O-N 3.05Å; D795-G797 VanDerWaalsContact C-N 3.32Å; D795-G797 PolarHBondContact O-N 3.36Å; D795-G798 PolarHBondContact O-N 3.5Å
796	S	69.1	Low	81.4	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-67.8	-26.8	-173.7	65.1	0	0	0	0	114.4	C774 C793 P794 G798 L799	C774-S796 PolarHBondContact SG-OG 2.96Å; C774-S796 VanDerWaalsContact SG-OG 3.39Å; C793-S796 WeakPolarHBondContact O-CB 3.44Å; C793-S796 PolarHBondContact O-N 3.44Å; C793-S796 VanDerWaalsContact O-N 3.11Å; C793-S796 PolarHBondContact O-OG 2.6Å; C793-S796 VanDerWaalsContact SG-CB 3.55Å; C793-S796 PolarHBondContact SG-OG 2.8Å; C793-S796 VanDerWaalsContact SG-OG 3.38Å; P794-S796 PolarHBondContact O-N 2.86Å; S796-G798 PolarHBondContact O-N 3.48Å; S796-L799 PolarHBondContact O-N 3.18Å
797	G	63.6	Low	81.2	Confident	24 Å²	24	58.9 Å²	58.9	25%	0.247	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-68.5	-18	-178	0	0	0	0	0	114.4	D795	D795-G797 VanDerWaalsContact C-N 3.32Å; D795-G797 PolarHBondContact O-N 3.36Å
798	G	67.4	Low	81.1	Confident	62 Å²	62	55.1 Å²	55.1	64%	0.639	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-107.1	-4.5	-179.8	0	0	0	0	0	115	D795 S796	D795-G798 PolarHBondContact O-N 3.5Å; S796-G798 PolarHBondContact O-N 3.48Å
799	L	79.2	Confident	80.9	Confident	70 Å²	70	57.8 Å²	57.8	37%	0.366	33%	0.333	S	S	.	.			trans	-70.1	146.4	177.3	-65.8	176	0	0	0	110	Y764 I772 H775 S796 S806 P807	Y764-L799 HydrophobicContact CD1-CD1 4.45Å; I772-L799 HydrophobicContact CD1-CD1 3.87Å; H775-L799 PolarHBondContact NE2-O 3.11Å; H775-L799 VanDerWaalsContact NE2-O 3.14Å; S796-L799 PolarHBondContact O-N 3.18Å; L799-S806 WeakPolarHBondContact O-CA 3.17Å; L799-P807 VanDerWaalsContact O-CD 3.28Å; L799-P807 WeakPolarHBondContact O-CD 3.28Å
800	S	84.3	Confident	80.8	Confident	68 Å²	68	58.3 Å²	58.3	48%	0.476	34%	0.336	S	S	.	.			trans	-109.5	143.9	177.9	-57.7	0	0	0	0	110.8	L805	S800-L805 WeakPolarHBondContact CA-O 3.33Å
801	D	86.1	Confident	80.9	Confident	13 Å²	13	56 Å²	56	7%	0.07	32%	0.324	C	S	.	.			trans	-74.3	-174.3	169.3	71	8	0	0	0	112.2	R771 Q803 G804 L805	R771-D801 HydrophobicContact CG-CB 3.61Å; D801-Q803 PolarHBondContact O-N 3.15Å; D801-Q803 WeakPolarHBondContact OD1-CA 3.15Å; D801-Q803 WeakPolarHBondContact OD1-CB 3.17Å; D801-Q803 PolarHBondContact OD1-N 3.11Å; D801-Q803 PolarHBondContact OD2-OE1 3.35Å; D801-G804 PolarHBondContact O-N 3Å; D801-G804 PolarHBondContact OD1-N 2.82Å; D801-G804 VanDerWaalsContact OD1-N 3.07Å; D801-L805 PolarHBondContact N-O 3.13Å; D801-L805 WeakPolarHBondContact OD1-CB 3.46Å; D801-L805 PolarHBondContact OD1-N 3Å
802	Q	84	Confident	81.1	Confident	131 Å²	131	54.2 Å²	54.2	61%	0.612	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	-26	179.3	-175.8	178	2	0	0	113.4	T769 Q770 G804	T769-Q802 VanDerWaalsContact O-CB 3.26Å; T769-Q802 WeakPolarHBondContact O-CB 3.47Å; T769-Q802 PolarHBondContact O-N 3.2Å; Q770-Q802 HydrophobicContact CB-CB 4.46Å; Q802-G804 VanDerWaalsContact C-N 3.34Å
803	Q	82.9	Confident	81.3	Confident	121 Å²	121	56.9 Å²	56.9	57%	0.565	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-1.5	178	-68	77.1	12	0	0	112.6	D801 L805	D801-Q803 PolarHBondContact O-N 3.15Å; D801-Q803 WeakPolarHBondContact OD1-CA 3.15Å; D801-Q803 WeakPolarHBondContact OD1-CB 3.17Å; D801-Q803 PolarHBondContact OD1-N 3.11Å; D801-Q803 PolarHBondContact OD2-OE1 3.35Å; Q803-L805 VanDerWaalsContact C-N 3.32Å; Q803-L805 HydrophobicContact CB-CD1 4.24Å; Q803-L805 HydrophobicContact CB-CG 4.05Å
804	G	84.2	Confident	81.7	Confident	40 Å²	40	58.7 Å²	58.7	41%	0.412	35%	0.35	S	S	.	.	S	Bend	trans	81.1	11.1	-174.8	0	0	0	0	0	113.5	D801 Q802	D801-G804 PolarHBondContact O-N 3Å; D801-G804 PolarHBondContact OD1-N 2.82Å; D801-G804 VanDerWaalsContact OD1-N 3.07Å; Q802-G804 VanDerWaalsContact C-N 3.34Å
805	L	86.1	Confident	82.4	Confident	55 Å²	55	56.9 Å²	56.9	29%	0.288	35%	0.347	S	S	.	.			trans	-86.9	130.5	-179.2	-56	177.4	0	0	0	110.1	S800 D801 Q803 H809 L810	S800-L805 WeakPolarHBondContact CA-O 3.33Å; D801-L805 PolarHBondContact N-O 3.13Å; D801-L805 WeakPolarHBondContact OD1-CB 3.46Å; D801-L805 PolarHBondContact OD1-N 3Å; Q803-L805 VanDerWaalsContact C-N 3.32Å; Q803-L805 HydrophobicContact CB-CD1 4.24Å; Q803-L805 HydrophobicContact CB-CG 4.05Å; L805-H809 HydrophobicContact CB-CB 4.08Å; L805-H809 HydrophobicContact CD2-CB 4.03Å; L805-L810 HydrophobicContact CB-CD2 4.22Å; L805-L810 HydrophobicContact CB-CG 4.39Å; L805-L810 HydrophobicContact CD1-CD2 3.92Å
806	S	88.3	Confident	83.2	Confident	13 Å²	13	53.8 Å²	53.8	9%	0.091	33%	0.329	C	S	.	.			trans	-87.2	166.3	172.8	67.6	0	0	0	0	110.4	L799 L808 H809 L810	L799-S806 WeakPolarHBondContact O-CA 3.17Å; S806-L808 PolarHBondContact O-N 3.02Å; S806-L808 VanDerWaalsContact O-N 3.11Å; S806-L808 PolarHBondContact OG-N 3.4Å; S806-H809 PolarHBondContact N-ND1 3.44Å; S806-H809 VanDerWaalsContact N-ND1 3.14Å; S806-H809 WeakPolarHBondContact O-CB 3.08Å; S806-H809 PolarHBondContact O-N 2.69Å; S806-H809 PolarHBondContact OG-N 2.98Å; S806-H809 PolarHBondContact OG-ND1 3.48Å; S806-L810 PolarHBondContact O-N 2.72Å; S806-L810 VanDerWaalsContact O-N 3.08Å
807	P	86.2	Confident	84	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-52.9	-32.7	171.6	-26.8	35.3	0	0	0	112.7	A778 L799 L810 A811 L823	A778-P807 HydrophobicContact CB-CB 3.74Å; A778-P807 VanDerWaalsContact CB-O 3.31Å; A778-P807 WeakPolarHBondContact CB-O 3.47Å; L799-P807 VanDerWaalsContact O-CD 3.28Å; L799-P807 WeakPolarHBondContact O-CD 3.28Å; P807-L810 PolarHBondContact O-N 3.09Å; P807-A811 WeakPolarHBondContact O-CB 3.12Å; P807-A811 PolarHBondContact O-N 2.73Å; P807-L823 HydrophobicContact CB-CD1 4.1Å
808	L	86.9	Confident	85	Confident	41 Å²	41	62 Å²	62	22%	0.215	37%	0.373	C	S	.	.	H	α-helix	trans	-66.9	-43.4	174.7	-179.6	63.5	0	0	0	112	S806 L810 A811 V812 I820 L823 L824	S806-L808 PolarHBondContact O-N 3.02Å; S806-L808 VanDerWaalsContact O-N 3.11Å; S806-L808 PolarHBondContact OG-N 3.4Å; L808-L810 VanDerWaalsContact C-N 3.31Å; L808-L810 PolarHBondContact O-N 2.8Å; L808-A811 PolarHBondContact O-N 2.9Å; L808-V812 HydrophobicContact CD1-CG2 4.32Å; L808-V812 VanDerWaalsContact O-CG2 3.29Å; L808-V812 WeakPolarHBondContact O-CG2 3.15Å; L808-V812 PolarHBondContact O-N 3.1Å; L808-I820 HydrophobicContact CD1-CG2 4.22Å; L808-L823 HydrophobicContact CB-CB 4.44Å; L808-L823 HydrophobicContact CB-CD1 4.26Å; L808-L823 HydrophobicContact CD1-CB 3.96Å; L808-L824 HydrophobicContact CD1-CG 4.35Å; L808-L824 HydrophobicContact CD2-CD2 4.19Å
809	H	87.4	Confident	85.8	Confident	96 Å²	96	59 Å²	59	44%	0.444	34%	0.343	S	S	.	.	H	α-helix	trans	-59.8	-43.8	175.9	-63.2	147.9	0	0	0	111.2	L805 S806 V812 Q813	L805-H809 HydrophobicContact CB-CB 4.08Å; L805-H809 HydrophobicContact CD2-CB 4.03Å; S806-H809 PolarHBondContact N-ND1 3.44Å; S806-H809 VanDerWaalsContact N-ND1 3.14Å; S806-H809 WeakPolarHBondContact O-CB 3.08Å; S806-H809 PolarHBondContact O-N 2.69Å; S806-H809 PolarHBondContact OG-N 2.98Å; S806-H809 PolarHBondContact OG-ND1 3.48Å; H809-V812 PolarHBondContact O-N 2.94Å; H809-Q813 WeakPolarHBondContact O-CB 3.5Å; H809-Q813 PolarHBondContact O-N 3.3Å
810	L	86.8	Confident	86.1	Confident	10 Å²	10	57.3 Å²	57.3	5%	0.052	33%	0.334	C	S	.	.	H	α-helix	trans	-65.8	-39.8	177.7	-62.4	175	0	0	0	112.2	H775 E779 L805 S806 P807 L808 Q813 G814	H775-L810 HydrophobicContact CB-CD1 3.76Å; E779-L810 HydrophobicContact CB-CB 4.15Å; E779-L810 HydrophobicContact CB-CD1 4.44Å; L805-L810 HydrophobicContact CB-CD2 4.22Å; L805-L810 HydrophobicContact CB-CG 4.39Å; L805-L810 HydrophobicContact CD1-CD2 3.92Å; S806-L810 PolarHBondContact O-N 2.72Å; S806-L810 VanDerWaalsContact O-N 3.08Å; P807-L810 PolarHBondContact O-N 3.09Å; L808-L810 VanDerWaalsContact C-N 3.31Å; L808-L810 PolarHBondContact O-N 2.8Å; L810-Q813 PolarHBondContact O-N 2.96Å; L810-G814 PolarHBondContact O-N 3.39Å
811	A	88.9	Confident	86.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-64.9	-38.1	175.4	0	0	0	0	0	113	A778 P807 L808 G814 G815 H816 V819 I820 L823	A778-A811 HydrophobicContact CB-CB 4.36Å; P807-A811 WeakPolarHBondContact O-CB 3.12Å; P807-A811 PolarHBondContact O-N 2.73Å; L808-A811 PolarHBondContact O-N 2.9Å; A811-G814 PolarHBondContact O-N 2.97Å; A811-G815 PolarHBondContact O-N 3.45Å; A811-G815 VanDerWaalsContact O-N 3.08Å; A811-H816 PolarHBondContact O-N 3.49Å; A811-V819 HydrophobicContact CB-CB 4.15Å; A811-V819 HydrophobicContact CB-CG1 3.4Å; A811-I820 HydrophobicContact CB-CG1 3.95Å; A811-L823 HydrophobicContact CB-CD1 4.45Å
812	V	88.3	Confident	85.8	Confident	86 Å²	86	60.5 Å²	60.5	52%	0.521	35%	0.347	S	S	.	.	H	α-helix	trans	-67.2	-44.1	174.7	171.7	0	0	0	0	110.6	L808 H809 G814 G815 I820	L808-V812 HydrophobicContact CD1-CG2 4.32Å; L808-V812 VanDerWaalsContact O-CG2 3.29Å; L808-V812 WeakPolarHBondContact O-CG2 3.15Å; L808-V812 PolarHBondContact O-N 3.1Å; H809-V812 PolarHBondContact O-N 2.94Å; V812-G814 VanDerWaalsContact C-N 3.27Å; V812-G814 PolarHBondContact O-N 3.49Å; V812-G815 PolarHBondContact O-N 3.21Å; V812-G815 VanDerWaalsContact O-N 3.1Å; V812-I820 HydrophobicContact CB-CD1 4.49Å; V812-I820 HydrophobicContact CG2-CD1 3.99Å; V812-I820 HydrophobicContact CG2-CG1 3.98Å; V812-I820 HydrophobicContact CG2-CG2 4.48Å
813	Q	87.6	Confident	85.6	Confident	155 Å²	155	55.8 Å²	55.8	72%	0.724	33%	0.326	S	S	*	.	H	α-helix	trans	-60.6	-37.7	175.9	-175.5	177.5	-18.3	0	0	112	H809 L810 G815	H809-Q813 WeakPolarHBondContact O-CB 3.5Å; H809-Q813 PolarHBondContact O-N 3.3Å; L810-Q813 PolarHBondContact O-N 2.96Å; Q813-G815 VanDerWaalsContact C-N 3.35Å
814	G	83.7	Confident	85.4	Confident	39 Å²	39	51.8 Å²	51.8	40%	0.402	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-7.4	175.6	0	0	0	0	0	115.3	L810 A811 V812 H816	L810-G814 PolarHBondContact O-N 3.39Å; A811-G814 PolarHBondContact O-N 2.97Å; V812-G814 VanDerWaalsContact C-N 3.27Å; V812-G814 PolarHBondContact O-N 3.49Å; G814-H816 VanDerWaalsContact C-N 3.35Å; G814-H816 PolarHBondContact O-CE1 3.22Å
815	G	87.4	Confident	84.3	Confident	51 Å²	51	53.2 Å²	53.2	53%	0.526	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	23.5	-178.9	0	0	0	0	0	114.9	A811 V812 Q813 S817	A811-G815 PolarHBondContact O-N 3.45Å; A811-G815 VanDerWaalsContact O-N 3.08Å; V812-G815 PolarHBondContact O-N 3.21Å; V812-G815 VanDerWaalsContact O-N 3.1Å; Q813-G815 VanDerWaalsContact C-N 3.35Å; G815-S817 PolarHBondContact O-N 3.46Å; G815-S817 VanDerWaalsContact O-N 3.1Å
816	H	89.8	Confident	82.7	Confident	54 Å²	54	55.6 Å²	55.6	25%	0.25	33%	0.329	C	S	.	.			trans	-86.6	79.4	-170.1	-59.9	-54	0	0	0	113	A778 E779 G781 A811 G814 N818 V819 I820	A778-H816 PolarHBondContact O-CD2 3.26Å; A778-H816 VanDerWaalsContact O-CD2 3.31Å; E779-H816 PolarHBondContact O-CD2 3.18Å; E779-H816 PolarHBondContact O-NE2 3.29Å; G781-H816 PolarHBondContact N-CD2 3.37Å; G781-H816 PolarHBondContact N-NE2 3.36Å; A811-H816 PolarHBondContact O-N 3.49Å; G814-H816 VanDerWaalsContact C-N 3.35Å; G814-H816 PolarHBondContact O-CE1 3.22Å; H816-N818 VanDerWaalsContact C-N 3.29Å; H816-N818 PolarHBondContact O-N 2.88Å; H816-N818 VanDerWaalsContact O-N 3.12Å; H816-V819 HydrophobicContact CB-CB 4.02Å; H816-V819 HydrophobicContact CB-CG2 4.31Å; H816-V819 PolarHBondContact O-N 2.76Å; H816-I820 VanDerWaalsContact O-CG1 3.32Å; H816-I820 WeakPolarHBondContact O-CG1 3.41Å; H816-I820 PolarHBondContact O-N 2.6Å
817	S	85.4	Confident	80.7	Confident	82 Å²	82	62.1 Å²	62.1	57%	0.573	36%	0.358	S	S	*	.	H	α-helix	trans	-49.2	-41	-175.3	-57.1	0	0	0	0	115.2	G815 I820 T821	G815-S817 PolarHBondContact O-N 3.46Å; G815-S817 VanDerWaalsContact O-N 3.1Å; S817-I820 PolarHBondContact O-N 2.71Å; S817-T821 WeakPolarHBondContact O-CB 3.05Å; S817-T821 VanDerWaalsContact O-CG2 3.29Å; S817-T821 WeakPolarHBondContact O-CG2 3.47Å; S817-T821 PolarHBondContact O-N 3.28Å; S817-T821 PolarHBondContact O-OG1 3.45Å
818	N	83.9	Confident	79	Confident	114 Å²	114	65 Å²	65	61%	0.61	38%	0.375	S	S	*	.	H	α-helix	trans	-68	-35.6	179.2	-67.7	-16.3	0	0	0	112.7	H816 T821 M822	H816-N818 VanDerWaalsContact C-N 3.29Å; H816-N818 PolarHBondContact O-N 2.88Å; H816-N818 VanDerWaalsContact O-N 3.12Å; N818-T821 WeakPolarHBondContact CA-OG1 3.12Å; N818-T821 PolarHBondContact O-OG1 2.73Å; N818-M822 VanDerWaalsContact O-CG 3.31Å; N818-M822 WeakPolarHBondContact O-CG 3.13Å; N818-M822 PolarHBondContact O-N 2.74Å
819	V	85.1	Confident	76.8	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.006	38%	0.377	C	S	.	.	H	α-helix	trans	-74.6	-42.7	175.9	167.3	0	0	0	0	110.5	A778 L786 A811 H816 T821 M822 L823	A778-V819 HydrophobicContact CB-CG1 3.99Å; L786-V819 HydrophobicContact CD2-CB 4.2Å; L786-V819 HydrophobicContact CD2-CG1 3.39Å; L786-V819 HydrophobicContact CD2-CG2 4.09Å; A811-V819 HydrophobicContact CB-CB 4.15Å; A811-V819 HydrophobicContact CB-CG1 3.4Å; H816-V819 HydrophobicContact CB-CB 4.02Å; H816-V819 HydrophobicContact CB-CG2 4.31Å; H816-V819 PolarHBondContact O-N 2.76Å; V819-T821 VanDerWaalsContact C-N 3.35Å; V819-T821 PolarHBondContact O-N 3.2Å; V819-M822 PolarHBondContact O-N 2.82Å; V819-L823 HydrophobicContact CG1-CD1 3.68Å; V819-L823 HydrophobicContact CG1-CG 4.31Å; V819-L823 WeakPolarHBondContact O-CG 3.1Å; V819-L823 PolarHBondContact O-N 3.42Å
820	I	84.9	Confident	74.7	Confident	33 Å²	33	66.8 Å²	66.8	17%	0.169	39%	0.387	C	S	.	.	H	α-helix	trans	-58.5	-48.3	178.2	-65.2	164.7	0	0	0	110.2	L808 A811 V812 H816 S817 M822 L823 L824	L808-I820 HydrophobicContact CD1-CG2 4.22Å; A811-I820 HydrophobicContact CB-CG1 3.95Å; V812-I820 HydrophobicContact CB-CD1 4.49Å; V812-I820 HydrophobicContact CG2-CD1 3.99Å; V812-I820 HydrophobicContact CG2-CG1 3.98Å; V812-I820 HydrophobicContact CG2-CG2 4.48Å; H816-I820 VanDerWaalsContact O-CG1 3.32Å; H816-I820 WeakPolarHBondContact O-CG1 3.41Å; H816-I820 PolarHBondContact O-N 2.6Å; S817-I820 PolarHBondContact O-N 2.71Å; I820-M822 VanDerWaalsContact C-N 3.28Å; I820-M822 PolarHBondContact O-N 3.14Å; I820-L823 PolarHBondContact O-N 3.24Å; I820-L824 HydrophobicContact CG2-CD1 3.64Å; I820-L824 HydrophobicContact CG2-CG 4.34Å; I820-L824 WeakPolarHBondContact O-CB 3.4Å; I820-L824 VanDerWaalsContact O-CG 3.27Å; I820-L824 WeakPolarHBondContact O-CG 3.23Å; I820-L824 PolarHBondContact O-N 3.1Å
821	T	84.1	Confident	72.5	Confident	78 Å²	78	72 Å²	72	48%	0.479	42%	0.415	S	S	.	.	H	α-helix	trans	-64.2	-30.8	178.1	48.9	0	0	0	0	113.3	S817 N818 V819	S817-T821 WeakPolarHBondContact O-CB 3.05Å; S817-T821 VanDerWaalsContact O-CG2 3.29Å; S817-T821 WeakPolarHBondContact O-CG2 3.47Å; S817-T821 PolarHBondContact O-N 3.28Å; S817-T821 PolarHBondContact O-OG1 3.45Å; N818-T821 WeakPolarHBondContact CA-OG1 3.12Å; N818-T821 PolarHBondContact O-OG1 2.73Å; V819-T821 VanDerWaalsContact C-N 3.35Å; V819-T821 PolarHBondContact O-N 3.2Å
822	M	80.6	Confident	70.3	Confident	71 Å²	71	77.6 Å²	77.6	35%	0.35	44%	0.444	S	S	.	.	H	α-helix	trans	-75.2	-35.4	175.1	-81.4	-179.4	49.6	0	0	113.9	S783 K787 N818 V819 I820	S783-M822 WeakPolarHBondContact O-CE 3.43Å; K787-M822 HydrophobicContact CB-CE 3.57Å; K787-M822 HydrophobicContact CG-CE 4.06Å; N818-M822 VanDerWaalsContact O-CG 3.31Å; N818-M822 WeakPolarHBondContact O-CG 3.13Å; N818-M822 PolarHBondContact O-N 2.74Å; V819-M822 PolarHBondContact O-N 2.82Å; I820-M822 VanDerWaalsContact C-N 3.28Å; I820-M822 PolarHBondContact O-N 3.14Å
823	L	79.8	Confident	67.8	Low	32 Å²	32	78.3 Å²	78.3	17%	0.168	45%	0.449	C	S	.	.	H	α-helix	trans	-82.8	-20.9	-179.9	-72	172.9	0	0	0	112.6	A778 L786 I790 P807 L808 A811 V819 I820	A778-L823 HydrophobicContact CB-CD1 4.34Å; L786-L823 HydrophobicContact CD2-CD1 4.06Å; L786-L823 HydrophobicContact CD2-CD2 4.18Å; L786-L823 HydrophobicContact CD2-CG 3.97Å; I790-L823 HydrophobicContact CD1-CD2 3.7Å; P807-L823 HydrophobicContact CB-CD1 4.1Å; L808-L823 HydrophobicContact CB-CB 4.44Å; L808-L823 HydrophobicContact CB-CD1 4.26Å; L808-L823 HydrophobicContact CD1-CB 3.96Å; A811-L823 HydrophobicContact CB-CD1 4.45Å; V819-L823 HydrophobicContact CG1-CD1 3.68Å; V819-L823 HydrophobicContact CG1-CG 4.31Å; V819-L823 WeakPolarHBondContact O-CG 3.1Å; V819-L823 PolarHBondContact O-N 3.42Å; I820-L823 PolarHBondContact O-N 3.24Å
824	L	77.6	Confident	65.4	Low	37 Å²	37	79.1 Å²	79.1	19%	0.194	45%	0.452	C	S	.	.	S	Bend	trans	-77.8	137.1	173.9	-76.4	168.2	0	0	0	111.4	L808 I820 V828	L808-L824 HydrophobicContact CD1-CG 4.35Å; L808-L824 HydrophobicContact CD2-CD2 4.19Å; I820-L824 HydrophobicContact CG2-CD1 3.64Å; I820-L824 HydrophobicContact CG2-CG 4.34Å; I820-L824 WeakPolarHBondContact O-CB 3.4Å; I820-L824 VanDerWaalsContact O-CG 3.27Å; I820-L824 WeakPolarHBondContact O-CG 3.23Å; I820-L824 PolarHBondContact O-N 3.1Å; L824-V828 HydrophobicContact CD2-CB 4.31Å; L824-V828 HydrophobicContact CD2-CG1 4.04Å
825	P	61	Low	63.3	Low	69 Å²	69	82.4 Å²	82.4	45%	0.448	47%	0.47	S	S	.	.			trans	-59	145.3	169.8	-18.8	29.5	0	0	0	110.9	Q827 V828	P825-Q827 PolarHBondContact O-N 3.28Å; P825-V828 HydrophobicContact CG-CG2 4.5Å; P825-V828 PolarHBondContact O-N 3.5Å
826	P	53	Low	61.1	Low	106 Å²	106	83.7 Å²	83.7	69%	0.688	48%	0.475	S	S	*	.	H	α-helix	trans	-57.4	-18.1	-179.1	20.5	-31.7	0	0	0	114.1
827	Q	45.8	Very low	58.5	Low	149 Å²	149	87.2 Å²	87.2	70%	0.696	50%	0.5	S	S	*	.	H	α-helix	trans	-77.7	-20.3	178	-69.4	148.2	5.4	0	0	113.9	P825	P825-Q827 PolarHBondContact O-N 3.28Å
828	V	50.5	Low	55.8	Low	61 Å²	61	91.6 Å²	91.6	37%	0.37	51%	0.511	S	S	.	.	H	α-helix	trans	-89.1	-30.8	178.8	-177.6	0	0	0	0	111.3	L824 P825 Q830 N831	L824-V828 HydrophobicContact CD2-CB 4.31Å; L824-V828 HydrophobicContact CD2-CG1 4.04Å; P825-V828 HydrophobicContact CG-CG2 4.5Å; P825-V828 PolarHBondContact O-N 3.5Å; V828-Q830 VanDerWaalsContact C-N 3.31Å; V828-Q830 PolarHBondContact O-N 2.87Å; V828-N831 PolarHBondContact O-N 3.31Å
829	C	40.9	Very low	53.4	Low	38 Å²	38	92.3 Å²	92.3	26%	0.257	52%	0.523	S	S	.	.	H	α-helix	trans	-65.4	-29.9	179.4	-67.8	0	0	0	0	113.6	N831 L832 T833	C829-N831 VanDerWaalsContact C-N 3.31Å; C829-N831 PolarHBondContact O-N 3.48Å; C829-L832 PolarHBondContact O-N 3.47Å; C829-T833 PolarHBondContact O-OG1 3.03Å
830	Q	43	Very low	50.8	Low	136 Å²	136	98 Å²	98	64%	0.636	56%	0.557	S	S	*	*	H	α-helix	trans	-66.8	-31.7	175.6	-73.6	-178.6	-17.3	0	0	112.7	V828 L832 T833	V828-Q830 VanDerWaalsContact C-N 3.31Å; V828-Q830 PolarHBondContact O-N 2.87Å; Q830-L832 VanDerWaalsContact C-N 3.35Å; Q830-L832 PolarHBondContact O-N 3.06Å; Q830-T833 PolarHBondContact O-OG1 3.16Å
831	N	41.1	Very low	48.2	Very low	120 Å²	120	100.9 Å²	100.9	64%	0.642	59%	0.585	S	S	*	*	H	α-helix	trans	-79.7	-15	-178.5	-69.6	-20.1	0	0	0	113.7	V828 C829	V828-N831 PolarHBondContact O-N 3.31Å; C829-N831 VanDerWaalsContact C-N 3.31Å; C829-N831 PolarHBondContact O-N 3.48Å
832	L	42.8	Very low	45.6	Very low	117 Å²	117	106.1 Å²	106.1	61%	0.613	60%	0.604	S	S	*	*	H	α-helix	trans	-91.1	-25.6	176.9	-72.6	164.5	0	0	0	112.4	C829 Q830	C829-L832 PolarHBondContact O-N 3.47Å; Q830-L832 VanDerWaalsContact C-N 3.35Å; Q830-L832 PolarHBondContact O-N 3.06Å
833	T	36.8	Very low	43.1	Very low	102 Å²	102	111.5 Å²	111.5	63%	0.626	63%	0.629	S	S	*	*	H	α-helix	trans	-85.5	-21.8	-178.3	46.3	0	0	0	0	114.5	C829 Q830 S835	C829-T833 PolarHBondContact O-OG1 3.03Å; Q830-T833 PolarHBondContact O-OG1 3.16Å; T833-S835 VanDerWaalsContact C-N 3.34Å
834	E	36.7	Very low	41.4	Very low	171 Å²	171	115.2 Å²	115.2	80%	0.799	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-11.2	178	-76.1	-174.1	164.9	0	0	113.9
835	S	39.8	Very low	39.5	Very low	109 Å²	109	119.2 Å²	119.2	76%	0.762	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-3.5	-179.1	179.4	0	0	0	0	114.5	T833	T833-S835 VanDerWaalsContact C-N 3.34Å
836	A	40.8	Very low	37.8	Very low	78 Å²	78	120.5 Å²	120.5	65%	0.645	70%	0.699	S	S	*	*	S	Bend	trans	-133.6	33	-165.2	0	0	0	0	0	115.4
837	V	34.8	Very low	36.6	Very low	128 Å²	128	120 Å²	120	78%	0.776	70%	0.704	S	S	*	*			trans	-154	104.9	158.1	-173.3	0	0	0	0	109.9
838	Q	28.5	Very low	35.8	Very low	173 Å²	173	122.2 Å²	122.2	81%	0.808	71%	0.714	S	S	*	*			trans	-164.1	128.2	133	-78.8	-155.7	-15.3	0	0	109.3
839	P	34.4	Very low	34.8	Very low	130 Å²	130	126 Å²	126	84%	0.844	74%	0.737	S	S	*	*			trans	-82.9	125.8	168.4	31.9	-26.4	0	0	0	108.9
840	V	29.1	Very low	34.2	Very low	121 Å²	121	132.6 Å²	132.6	73%	0.733	76%	0.762	S	S	*	*			trans	-120.5	113.2	173	-175	0	0	0	0	108.5
841	A	31.8	Very low	33.6	Very low	92 Å²	92	133.5 Å²	133.5	76%	0.76	77%	0.766	S	S	*	*			trans	-100.3	143.1	155.9	0	0	0	0	0	108.3
842	E	29.6	Very low	32.9	Very low	188 Å²	188	134.7 Å²	134.7	88%	0.879	77%	0.771	S	S	*	*			trans	97.5	119.9	172.5	-58.7	-172.1	158.6	0	0	117.9
843	E	28	Very low	32.2	Very low	185 Å²	185	137 Å²	137	86%	0.864	78%	0.779	S	S	*	*			trans	-85.6	-169.5	177	-57.9	-173.9	135.7	0	0	112.8
844	P	44.2	Very low	31.9	Very low	110 Å²	110	143.4 Å²	143.4	71%	0.714	79%	0.792	S	S	*	*				-110.7	-167	-94.3	40.4	-20	0	0	0	110.1
845	P	37.5	Very low	31.6	Very low	120 Å²	120	144 Å²	144	78%	0.779	79%	0.792	S	S	*	*			cis	-150.4	176.1	29.9	42.1	-18.1	0	0	0	120.3
846	A	25.4	Very low	31	Very low	96 Å²	96	146.8 Å²	146.8	79%	0.793	80%	0.796	S	S	*	*			trans	79.7	121.1	143.5	0	0	0	0	0	122.7
847	A	27.2	Very low	30.5	Very low	95 Å²	95	148.3 Å²	148.3	79%	0.785	80%	0.797	S	S	*	*			trans	103.8	121.3	133.6	0	0	0	0	0	120.5
848	E	28.2	Very low	30.3	Very low	196 Å²	196	150.2 Å²	150.2	92%	0.916	80%	0.802	S	S	*	*			trans	85	101.9	146.5	-68	-174.3	169.6	0	0	121.8
849	V	29.8	Very low	30.3	Very low	140 Å²	140	149.6 Å²	149.6	85%	0.848	80%	0.803	S	S	*	*			trans	-81.4	137	163	171.3	0	0	0	0	110.5
850	K	28.7	Very low	30.1	Very low	178 Å²	178	152.7 Å²	152.7	77%	0.774	80%	0.803	S	S	*	*			trans	-162.3	115.6	143.7	-111.8	172.5	-173.3	176.2	0	114.3
851	Q	30	Very low	30.1	Very low	155 Å²	155	154.8 Å²	154.8	72%	0.724	81%	0.809	S	S	*	*			trans	62.8	133.5	131.1	-74.3	176.1	-19	0	0	119
852	L	26.8	Very low	30	Very low	144 Å²	144	155.5 Å²	155.5	75%	0.754	80%	0.804	S	S	*	*			cis	-151.5	128.1	28.9	-81.5	106.8	0	0	0	110
853	Q	29.1	Very low	29.8	Very low	165 Å²	165	156.1 Å²	156.1	77%	0.771	81%	0.807	S	S	*	*				60.8	109.9	88.3	-78.1	-167.7	-6.8	0	0	118.7
854	R	29.1	Very low	29.9	Very low	238 Å²	238	156.1 Å²	156.1	90%	0.898	81%	0.807	S	S	*	*				177.8	102.7	110.3	-92.8	172	-178	-170.2	0.8	109.4
855	K	32.2	Very low	29.3	Very low	184 Å²	184	159.8 Å²	159.8	80%	0.8	81%	0.812	S	S	*	*				66.8	113.1	89.1	-92.9	-170.2	177.9	-177.5	0	116.2
856	I	27.1	Very low	28.9	Very low	166 Å²	166	160.8 Å²	160.8	85%	0.851	81%	0.81	S	S	*	*				-169.8	95.2	119.6	-81.3	147.3	0	0	0	105.1
857	V	29.2	Very low	29.2	Very low	110 Å²	110	164.6 Å²	164.6	67%	0.667	81%	0.809	S	S	*	*				61.2	99.4	89.2	-172.9	0	0	0	0	114.3
858	I	29.8	Very low	29.3	Very low	169 Å²	169	167.7 Å²	167.7	87%	0.867	81%	0.812	S	S	*	*			trans	-110.5	125.1	157	-64.7	176	0	0	0	107.1
859	L	29.4	Very low	29.1	Very low	159 Å²	159	164.2 Å²	164.2	83%	0.832	81%	0.808	S	S	*	*			trans	-77.5	125.3	173.3	-81.8	160	0	0	0	109.8
860	K	30.6	Very low	29.4	Very low	195 Å²	195	163.1 Å²	163.1	85%	0.848	80%	0.804	S	S	*	*			trans	-88.5	135.6	163.8	-101.2	179.5	171.8	179.4	0	109.1
861	L	28.5	Very low	29.3	Very low	165 Å²	165	163.5 Å²	163.5	86%	0.864	81%	0.808	S	S	*	*			trans	-123	89.3	155.5	-85.7	153.7	0	0	0	104.9
862	T	29.1	Very low	29.2	Very low	108 Å²	108	161.3 Å²	161.3	66%	0.663	81%	0.81	S	S	*	*				63.2	98.2	94	61.1	0	0	0	0	114
863	E	26.2	Very low	29.5	Very low	200 Å²	200	159.8 Å²	159.8	94%	0.935	81%	0.809	S	S	*	*			trans	-103	128.1	150.7	-77.2	-175.2	159.1	0	0	108.4
864	H	29	Very low	29.5	Very low	186 Å²	186	156.9 Å²	156.9	86%	0.861	81%	0.807	S	S	*	*			trans	-94.4	134.3	171.4	-104.5	-76.4	0	0	0	109.3
865	K	32.3	Very low	29.9	Very low	187 Å²	187	150.6 Å²	150.6	81%	0.813	80%	0.797	S	S	*	*			trans	-113.3	136.8	157.1	-90.1	-174.5	174.2	179.1	0	108.3
866	D	29.8	Very low	29.6	Very low	140 Å²	140	150.8 Å²	150.8	75%	0.749	80%	0.801	S	S	*	*			trans	-176.6	116	134.8	-93	-28	0	0	0	108
867	K	31.6	Very low	30	Very low	177 Å²	177	148.1 Å²	148.1	77%	0.77	80%	0.797	S	S	*	*				77.3	113.1	104.3	-77.2	-175.4	179.1	177	0	114.5
868	D	28	Very low	30.2	Very low	160 Å²	160	148.8 Å²	148.8	86%	0.856	80%	0.803	S	S	*	*				175.9	133.9	117.8	-85.7	-23.7	0	0	0	110.9
869	C	25.7	Very low	30.3	Very low	123 Å²	123	145.9 Å²	145.9	83%	0.831	80%	0.798	S	S	*	*			trans	-91.9	151.3	163.1	-75.3	0	0	0	0	107.6
870	P	36.2	Very low	31.5	Very low	116 Å²	116	143.8 Å²	143.8	75%	0.753	79%	0.794	S	S	*	*				-153.9	176.6	72.9	41.4	-20.5	0	0	0	117.7
871	E	25.1	Very low	31.3	Very low	186 Å²	186	143.4 Å²	143.4	87%	0.869	80%	0.795	S	S	*	*			trans	92.7	121	156.8	-73.6	173.5	-176.8	0	0	120.8
872	S	28	Very low	31.5	Very low	110 Å²	110	140.7 Å²	140.7	77%	0.769	79%	0.79	S	S	*	*			trans	-73.9	175.7	172.7	51.6	0	0	0	0	111.4
873	P	34.3	Very low	32.1	Very low	111 Å²	111	141.4 Å²	141.4	72%	0.721	80%	0.797	S	S	*	*			cis	-143.1	166	28.7	36	-11.8	0	0	0	119.7
874	S	28.8	Very low	32.2	Very low	104 Å²	104	137.2 Å²	137.2	73%	0.727	79%	0.789	S	S	*	*			trans	-23.9	157.5	151.7	45.9	0	0	0	0	116.9
875	P	37.8	Very low	33.3	Very low	107 Å²	107	133.8 Å²	133.8	70%	0.695	78%	0.784	S	S	*	*				-146.3	145.3	59.6	38.1	-15.8	0	0	0	116.6
876	E	25.8	Very low	33.1	Very low	188 Å²	188	134.1 Å²	134.1	88%	0.879	79%	0.788	S	S	*	*				81.5	122.2	105.9	-67.1	179.9	157.1	0	0	115.9
877	S	33.8	Very low	33.2	Very low	110 Å²	110	132.4 Å²	132.4	77%	0.769	79%	0.787	S	S	*	*			trans	-62.8	161.3	158.5	52.8	0	0	0	0	110.5
878	P	34.8	Very low	33.7	Very low	123 Å²	123	129.7 Å²	129.7	80%	0.799	79%	0.787	S	S	*	*				-154.8	162.1	85.3	37.5	-16.2	0	0	0	116
879	S	30.8	Very low	33.7	Very low	109 Å²	109	127.1 Å²	127.1	76%	0.762	78%	0.782	S	S	*	*			trans	-93.5	172.2	149.6	41.6	0	0	0	0	108.4
880	P	54.9	Low	34.6	Very low	114 Å²	114	126 Å²	126	74%	0.74	77%	0.773	S	S	*	*			cis	-143	-161.1	14.7	34.5	-8.5	0	0	0	114.3
881	E	27.6	Very low	34.2	Very low	188 Å²	188	128.9 Å²	128.9	88%	0.879	78%	0.777	S	S	*	*			trans	116.2	127.2	154.9	-64.6	-169.8	163.1	0	0	119.3
882	S	32.6	Very low	34.4	Very low	107 Å²	107	126 Å²	126	75%	0.748	78%	0.775	S	S	*	*			trans	-83.4	154.2	164.3	54.5	0	0	0	0	111.1
883	P	40.2	Very low	34.6	Very low	124 Å²	124	125 Å²	125	81%	0.805	77%	0.774	S	S	*	*				-149.4	165.9	83.7	33.9	-12.8	0	0	0	116.2
884	S	29.4	Very low	34.5	Very low	111 Å²	111	125.4 Å²	125.4	78%	0.776	78%	0.779	S	S	*	*			trans	-67.7	-178.6	167.9	46.8	0	0	0	0	113.7
885	P	51.8	Low	34.6	Very low	115 Å²	115	125.1 Å²	125.1	75%	0.747	78%	0.783	S	S	*	*			cis	-133.2	173.3	-3.7	38.3	-19.8	0	0	0	114.6
886	E	28.5	Very low	34.9	Very low	193 Å²	193	125.9 Å²	125.9	90%	0.902	79%	0.788	S	S	*	*			trans	165.8	131	139	-93.3	178	-176.6	0	0	113.1
887	S	30.7	Very low	35.5	Very low	105 Å²	105	127 Å²	127	73%	0.734	81%	0.814	S	S	*	*			trans	-78.6	169.3	164.2	53.3	0	0	0	0	111.4
888	P	42.3	Very low	35.6	Very low	119 Å²	119	127.8 Å²	127.8	77%	0.773	82%	0.816	S	S	*	*			cis	-140.6	-177.3	24.3	35.8	-11.7	0	0	0	116.7
889	S	28.3	Very low	35.6	Very low	106 Å²	106	128.1 Å²	128.1	74%	0.741	82%	0.817	S	S	*	*			trans	-50.8	-178.8	172.9	56.8	0	0	0	0	115.8
890	P	44.1	Very low	35.9	Very low	100 Å²	100	129.1 Å²	129.1	65%	0.649	82%	0.82	S	S	*	*			cis	-148.7	-175.8	16	44.7	-23.1	0	0	0	118.6
891	Q	28.2	Very low	34.7	Very low	177 Å²	177	130 Å²	130	83%	0.827	83%	0.825	S	S	*	*			trans	75.9	112.8	147.8	-78.2	168.3	7.4	0	0	122.2
892	C	30.5	Very low	35.2	Very low	124 Å²	124	126.4 Å²	126.4	84%	0.838	82%	0.822	S	S	*	*				172	108.8	117	-87.6	0	0	0	0	107.9
893	A	30.2	Very low	35.3	Very low	89 Å²	89	127.7 Å²	127.7	74%	0.736	83%	0.827	S	S	*	*				75.1	131	77.2	0	0	0	0	0	114.6
894	S	33.5	Very low	35	Very low	120 Å²	120	127.9 Å²	127.9	84%	0.839	83%	0.828	S	S	*	*			trans	79.1	106.2	175.4	67	0	0	0	0	116
895	A	31.2	Very low	35.4	Very low	98 Å²	98	129.2 Å²	129.2	81%	0.81	83%	0.832	S	S	*	*				76.1	156.4	53.8	0	0	0	0	0	113
896	P	44.5	Very low	34.1	Very low	123 Å²	123	130.4 Å²	130.4	80%	0.799	84%	0.839	S	S	*	*				-122.5	166.4	-102.3	32.1	-13.6	0	0	0	114
897	C	36.8	Very low	34.6	Very low	211 Å²	211	124.7 Å²	124.7	100%	1.426	83%	0.834	S	S	*	*			trans	-148.5	0	147.6	-96	0	0	0	0	109.3

Retrieved 897 of 897 residues in 898.7 ms (Link to these results)

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