A0A077ZGF4_TRITR Loading...

DNA replication licensing factor MCM4

Acts as component of the MCM2-7 complex (MCM complex) which is the replicative helicase essential for 'once per cell cycle' DNA replication initiation and elongation in eukaryotic cells. The active ATPase sites in the MCM2-7 ring are formed through the interaction surfaces of two neighboring subunits such that a critical structure of a conserved arginine finger motif is provided in trans relative to the ATP-binding site of the Walker A box of the adjacent subunit. The six ATPase active sites, however, are likely to contribute differentially to the complex helicase activity.

AlphaFold DB , UniProt , Accession A0A077ZGF4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 816 aa.

						>A0A077ZGF4_TRITR|A0A077ZGF4
MATSPSQTDVSADGFLSPLSSPHRTINDIVSRVRSSQRSYSAASDRLYLSYSNEALSIAQQTRNGSNDATGSRNVFAMVDEQTDDGEKRSYIWGTRICLSEVEKAFRRFVENFRSSEDESDSEPSIEGGRASYKQKLCEVYHTQETVIELDLQHVKSFDEVLYHQIVNYPNDIITYLDYTLNEMFYEIYPESQRSIELQIKPFNAEQIYGMRTLEPDDINKLISINGMVIRATGLIPEMREAFFECNICKSSTTVFVEFGQIVEPTLCTNCNSKSTFVLVSNRSIFGDRQIVKLQEFPDEMPPGQAPLSVSVYLLDSMVDLVMPGDRITVTGIYRSEPIRELPKQRAVKSVLRTFIDAIHILKLDRHKLNEKDDISWLSEERINQIRSLAARPDVYERLSHALAPSIFEHDDIKKAVLFLLFGGTRKDFTSVASGYSRAEINILLCGDPGTAKSQLLQYVHRLLPRGQYVSGKGTSAAGLTAHITRDPETKHFVLQIGALALSDNGVCCIDEFDKMNDYTRSVLQEVMEQQTLSVAKAGIVCQLNARSSILAAANPVESQWNQQKTIVENVQLPHTLMSRFDLIFLMVDPQDEYYDRRLASHLVSLYFKGYEEEEAELVDMSLLKDYIAYAKAVCAPVLSQAAANNLIHKYVEMRKGDSSRGHISAYPRQLESLIRLSEARAKIRLCSTVEELDVEEAYSLYREALKQVATDPLTGKVDVSILALGMSAATRRAAADLRQLIKNRMLAKEDGAWVAPKALLMEIRESGGATVRRDLFEEVLNEMCKDEMLLRGRLGRVRLNRQNIVPDESVGVAAE
					

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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	36.1	Very low	36.5	Very low	243 Å²	243	131.8 Å²	131.8	100%	1.197	80%	0.798	S	S	*	*				0	118.1	0	-86.7	178.9	165.3	0	0	107.4
2	A	34.3	Very low	36.3	Very low	102 Å²	102	128.2 Å²	128.2	84%	0.843	79%	0.792	S	S	*	*			trans	59	129.7	-175.5	0	0	0	0	0	114.2
3	T	38.9	Very low	35.5	Very low	139 Å²	139	131.5 Å²	131.5	85%	0.853	80%	0.802	S	S	*	*			cis	-155.9	143.6	44.4	40.2	0	0	0	0	112.7
4	S	36.9	Very low	34.9	Very low	107 Å²	107	126.9 Å²	126.9	75%	0.748	79%	0.793	S	S	*	*			trans	-74.9	-161.6	174.3	56.2	0	0	0	0	114.4
5	P	55.7	Low	34.4	Very low	110 Å²	110	132.1 Å²	132.1	71%	0.714	80%	0.8	S	S	*	*			cis	-142.7	-177.5	-38.4	26.9	-4.3	0	0	0	114.8
6	S	36	Very low	34	Very low	105 Å²	105	134.4 Å²	134.4	73%	0.734	81%	0.806	S	S	*	*			trans	137.3	136.5	137.1	60.7	0	0	0	0	111.8
7	Q	36.2	Very low	33.6	Very low	166 Å²	166	132.3 Å²	132.3	78%	0.776	80%	0.799	S	S	*	*			cis	-167.3	142.6	5.3	-112.2	172.8	-6.6	0	0	109
8	T	35.1	Very low	33.3	Very low	106 Å²	106	132 Å²	132	65%	0.65	80%	0.8	S	S	*	*			trans	63.7	143.8	137.5	60.1	0	0	0	0	121.5
9	D	31.6	Very low	33	Very low	136 Å²	136	134.4 Å²	134.4	73%	0.727	81%	0.807	S	S	*	*			cis	-174.3	131.3	0.1	-96.7	-20.5	0	0	0	106.6
10	V	31.7	Very low	32.9	Very low	124 Å²	124	133.3 Å²	133.3	75%	0.752	81%	0.806	S	S	*	*				83.4	119.3	85.1	173.1	0	0	0	0	116.2
11	S	29.1	Very low	32.7	Very low	112 Å²	112	131.4 Å²	131.4	78%	0.783	80%	0.799	S	S	*	*			trans	106.1	122	142.8	-70	0	0	0	0	124.1
12	A	34.2	Very low	32.5	Very low	88 Å²	88	125.3 Å²	125.3	73%	0.727	78%	0.777	S	S	*	*				92.8	104.5	126.6	0	0	0	0	0	122.1
13	D	26.1	Very low	32.2	Very low	172 Å²	172	129.1 Å²	129.1	92%	0.92	78%	0.777	S	S	*	*				33.9	129.3	128.4	-63.2	-26.3	0	0	0	122.2
14	G	27.1	Very low	31.8	Very low	66 Å²	66	131.5 Å²	131.5	68%	0.68	77%	0.771	S	S	*	*			trans	137.1	105.1	137.3	0	0	0	0	0	116.7
15	F	26.2	Very low	31.4	Very low	205 Å²	205	130.2 Å²	130.2	90%	0.899	76%	0.759	S	S	*	*			trans	56.6	104.9	151.9	-78.9	-99.6	0	0	0	118.4
16	L	29	Very low	30.3	Very low	169 Å²	169	131.2 Å²	131.2	89%	0.885	76%	0.757	S	S	*	*				178.4	126.4	124.3	-92.1	149.4	0	0	0	111.2
17	S	26.5	Very low	30	Very low	99 Å²	99	132 Å²	132	69%	0.692	75%	0.753	S	S	*	*			trans	-27.2	135.9	172.9	49.2	0	0	0	0	118.7
18	P	28	Very low	29.8	Very low	127 Å²	127	128.1 Å²	128.1	83%	0.825	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-90.8	124.3	155.1	32.8	-23.5	0	0	0	110.1	S20	P18-S20 PolarHBondContact O-N 2.83Å
19	L	28.3	Very low	29.7	Very low	177 Å²	177	127.8 Å²	127.8	93%	0.927	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-58.3	127.8	168.4	-83.5	151.4	0	0	0	110.2
20	S	31.3	Very low	29.6	Very low	112 Å²	112	124.1 Å²	124.1	78%	0.783	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-71.1	136.6	179.3	51	0	0	0	0	113.1	P18	P18-S20 PolarHBondContact O-N 2.83Å
21	S	29.3	Very low	29.5	Very low	95 Å²	95	121.2 Å²	121.2	66%	0.664	70%	0.698	S	S	*	*			trans	-44.4	177.1	174.1	62.9	0	0	0	0	118.8
22	P	30.4	Very low	29.6	Very low	114 Å²	114	123.4 Å²	123.4	74%	0.74	69%	0.689	S	S	*	*				-134.2	108.1	88	35.3	-21.3	0	0	0	113.1	R24	P22-R24 VanDerWaalsContact C-N 3.35Å; P22-R24 PolarHBondContact O-N 2.67Å; P22-R24 VanDerWaalsContact O-N 3.11Å
23	H	27.9	Very low	29.5	Very low	182 Å²	182	121.9 Å²	121.9	84%	0.843	67%	0.67	S	S	*	*			trans	-67.8	99.3	150.5	-86.8	-78.3	0	0	0	106	T25	H23-T25 PolarHBondContact O-N 3.11Å
24	R	30.8	Very low	29.6	Very low	189 Å²	189	121.2 Å²	121.2	71%	0.713	66%	0.655	S	S	*	*			trans	-68.2	113.8	162.9	-79.9	-174.8	175.5	-172.4	1.6	107	P22 I26	P22-R24 VanDerWaalsContact C-N 3.35Å; P22-R24 PolarHBondContact O-N 2.67Å; P22-R24 VanDerWaalsContact O-N 3.11Å; R24-I26 PolarHBondContact O-N 2.72Å
25	T	29.3	Very low	29.9	Very low	81 Å²	81	120.6 Å²	120.6	50%	0.497	64%	0.64	S	S	.	*			trans	-51.9	125.9	178.5	1.6	0	0	0	0	110.5	H23 N27 D28	H23-T25 PolarHBondContact O-N 3.11Å; T25-N27 PolarHBondContact O-N 3.39Å; T25-D28 WeakPolarHBondContact O-CB 3.16Å; T25-D28 PolarHBondContact O-N 3.05Å; T25-D28 PolarHBondContact OG1-OD2 3.25Å
26	I	32.7	Very low	30.3	Very low	131 Å²	131	112.3 Å²	112.3	67%	0.672	61%	0.608	S	S	*	*	H	α-helix	trans	-49.4	-29.4	174.7	-70.3	167.1	0	0	0	111.5	R24 D28 I29 V30	R24-I26 PolarHBondContact O-N 2.72Å; I26-D28 VanDerWaalsContact C-N 3.34Å; I26-D28 PolarHBondContact O-N 3.47Å; I26-I29 PolarHBondContact O-N 3.5Å; I26-V30 HydrophobicContact CG2-CG2 4.19Å; I26-V30 VanDerWaalsContact O-CG2 3.28Å; I26-V30 WeakPolarHBondContact O-CG2 3.47Å; I26-V30 PolarHBondContact O-N 3.48Å
27	N	29.7	Very low	30.6	Very low	121 Å²	121	105.8 Å²	105.8	65%	0.647	57%	0.573	S	S	*	*	H	α-helix	trans	-66.4	-26.1	175.7	-68.3	-17.6	0	0	0	114.8	T25 S31	T25-N27 PolarHBondContact O-N 3.39Å; N27-S31 WeakPolarHBondContact O-CB 3.27Å; N27-S31 PolarHBondContact O-N 2.92Å; N27-S31 VanDerWaalsContact O-N 3.13Å; N27-S31 PolarHBondContact O-OG 2.78Å
28	D	30.9	Very low	30.6	Very low	84 Å²	84	110.1 Å²	110.1	45%	0.449	57%	0.574	S	S	.	*	H	α-helix	trans	-77.6	-28.3	175.8	-69.2	-42.5	0	0	0	112	T25 I26 S31 R32	T25-D28 WeakPolarHBondContact O-CB 3.16Å; T25-D28 PolarHBondContact O-N 3.05Å; T25-D28 PolarHBondContact OG1-OD2 3.25Å; I26-D28 VanDerWaalsContact C-N 3.34Å; I26-D28 PolarHBondContact O-N 3.47Å; D28-S31 WeakPolarHBondContact CA-OG 3.45Å; D28-S31 PolarHBondContact O-OG 3.09Å; D28-R32 VanDerWaalsContact O-CG 3.28Å; D28-R32 WeakPolarHBondContact O-CG 3.36Å; D28-R32 PolarHBondContact O-N 3.32Å
29	I	32.7	Very low	31	Very low	99 Å²	99	104.5 Å²	104.5	51%	0.508	54%	0.538	S	S	.	.	H	α-helix	trans	-76.7	-46.3	175	-60.3	172.5	0	0	0	109.3	I26 S31 R32 V33	I26-I29 PolarHBondContact O-N 3.5Å; I29-S31 VanDerWaalsContact C-N 3.3Å; I29-S31 PolarHBondContact O-N 2.88Å; I29-R32 PolarHBondContact O-N 2.92Å; I29-V33 HydrophobicContact CG2-CG2 4.29Å; I29-V33 WeakPolarHBondContact O-CB 3.45Å; I29-V33 VanDerWaalsContact O-CG2 3.26Å; I29-V33 WeakPolarHBondContact O-CG2 3.49Å; I29-V33 PolarHBondContact O-N 2.93Å
30	V	30.2	Very low	31.4	Very low	60 Å²	60	101.2 Å²	101.2	36%	0.364	51%	0.514	S	S	.	.	H	α-helix	trans	-62.2	-36.1	178.5	174.4	0	0	0	0	112	I26 R34	I26-V30 HydrophobicContact CG2-CG2 4.19Å; I26-V30 VanDerWaalsContact O-CG2 3.28Å; I26-V30 WeakPolarHBondContact O-CG2 3.47Å; I26-V30 PolarHBondContact O-N 3.48Å; V30-R34 WeakPolarHBondContact O-CB 3.46Å; V30-R34 VanDerWaalsContact O-CG 3.23Å; V30-R34 WeakPolarHBondContact O-CG 3.34Å; V30-R34 PolarHBondContact O-N 3.07Å; V30-R34 VanDerWaalsContact O-N 3.1Å
31	S	29.7	Very low	31.5	Very low	62 Å²	62	96.9 Å²	96.9	43%	0.434	48%	0.483	S	S	.	.	H	α-helix	trans	-73.2	-34.9	176.5	55.8	0	0	0	0	113.5	N27 D28 I29 S35	N27-S31 WeakPolarHBondContact O-CB 3.27Å; N27-S31 PolarHBondContact O-N 2.92Å; N27-S31 VanDerWaalsContact O-N 3.13Å; N27-S31 PolarHBondContact O-OG 2.78Å; D28-S31 WeakPolarHBondContact CA-OG 3.45Å; D28-S31 PolarHBondContact O-OG 3.09Å; I29-S31 VanDerWaalsContact C-N 3.3Å; I29-S31 PolarHBondContact O-N 2.88Å; S31-S35 PolarHBondContact O-N 3.17Å; S31-S35 VanDerWaalsContact O-N 3.16Å; S31-S35 PolarHBondContact O-OG 3.11Å
32	R	31.3	Very low	31.6	Very low	158 Å²	158	93.2 Å²	93.2	60%	0.596	46%	0.459	S	S	*	.	H	α-helix	trans	-69.9	-41.9	174.3	-77.1	178.1	-176.3	-159.7	-1.2	112.7	D28 I29 R34 S35 S36	D28-R32 VanDerWaalsContact O-CG 3.28Å; D28-R32 WeakPolarHBondContact O-CG 3.36Å; D28-R32 PolarHBondContact O-N 3.32Å; I29-R32 PolarHBondContact O-N 2.92Å; R32-R34 VanDerWaalsContact C-N 3.32Å; R32-R34 PolarHBondContact O-N 3.48Å; R32-S35 WeakPolarHBondContact CA-OG 3.33Å; R32-S35 PolarHBondContact O-N 3.16Å; R32-S35 PolarHBondContact O-OG 2.77Å; R32-S36 PolarHBondContact O-N 3.42Å; R32-S36 VanDerWaalsContact O-N 3.07Å
33	V	32.6	Very low	31.7	Very low	56 Å²	56	90.2 Å²	90.2	34%	0.339	44%	0.444	S	S	.	.	H	α-helix	trans	-59.4	-45.6	173.7	171.7	0	0	0	0	109.7	I29 S35 S36 Q37	I29-V33 HydrophobicContact CG2-CG2 4.29Å; I29-V33 WeakPolarHBondContact O-CB 3.45Å; I29-V33 VanDerWaalsContact O-CG2 3.26Å; I29-V33 WeakPolarHBondContact O-CG2 3.49Å; I29-V33 PolarHBondContact O-N 2.93Å; V33-S35 VanDerWaalsContact C-N 3.33Å; V33-S35 PolarHBondContact O-N 3.5Å; V33-S36 PolarHBondContact O-N 2.9Å; V33-S36 VanDerWaalsContact O-N 3.11Å; V33-S36 PolarHBondContact O-OG 3.46Å; V33-Q37 HydrophobicContact CG1-CG 4.33Å; V33-Q37 VanDerWaalsContact CG1-NE2 3.33Å; V33-Q37 VanDerWaalsContact O-CG 3.23Å; V33-Q37 WeakPolarHBondContact O-CG 3.43Å; V33-Q37 PolarHBondContact O-N 3.15Å
34	R	28	Very low	31.9	Very low	159 Å²	159	83.9 Å²	83.9	60%	0.6	42%	0.42	S	S	*	.	H	α-helix	trans	-60.5	-32.9	175.6	-78.3	175.7	179.8	-175.4	1.6	114.8	V30 R32	V30-R34 WeakPolarHBondContact O-CB 3.46Å; V30-R34 VanDerWaalsContact O-CG 3.23Å; V30-R34 WeakPolarHBondContact O-CG 3.34Å; V30-R34 PolarHBondContact O-N 3.07Å; V30-R34 VanDerWaalsContact O-N 3.1Å; R32-R34 VanDerWaalsContact C-N 3.32Å; R32-R34 PolarHBondContact O-N 3.48Å
35	S	32.2	Very low	32	Very low	53 Å²	53	79 Å²	79	37%	0.371	41%	0.408	S	S	.	.	H	α-helix	trans	-76.1	-31.7	174.6	51.3	0	0	0	0	113.1	S31 R32 V33	S31-S35 PolarHBondContact O-N 3.17Å; S31-S35 VanDerWaalsContact O-N 3.16Å; S31-S35 PolarHBondContact O-OG 3.11Å; R32-S35 WeakPolarHBondContact CA-OG 3.33Å; R32-S35 PolarHBondContact O-N 3.16Å; R32-S35 PolarHBondContact O-OG 2.77Å; V33-S35 VanDerWaalsContact C-N 3.33Å; V33-S35 PolarHBondContact O-N 3.5Å
36	S	34.6	Very low	32.2	Very low	31 Å²	31	81.8 Å²	81.8	22%	0.217	41%	0.409	C	S	.	.	H	α-helix	trans	-70.5	-35.7	175.9	77.3	0	0	0	0	111.9	R32 V33 S39	R32-S36 PolarHBondContact O-N 3.42Å; R32-S36 VanDerWaalsContact O-N 3.07Å; V33-S36 PolarHBondContact O-N 2.9Å; V33-S36 VanDerWaalsContact O-N 3.11Å; V33-S36 PolarHBondContact O-OG 3.46Å; S36-S39 PolarHBondContact O-N 2.84Å; S36-S39 PolarHBondContact O-OG 2.75Å
37	Q	35.5	Very low	32.3	Very low	31 Å²	31	79.5 Å²	79.5	15%	0.145	40%	0.398	C	S	.	.	H	α-helix	trans	-65.7	-46.6	-176.8	-76.3	169.2	-21.6	0	0	113	V33 S39 Y40 S41	V33-Q37 HydrophobicContact CG1-CG 4.33Å; V33-Q37 VanDerWaalsContact CG1-NE2 3.33Å; V33-Q37 VanDerWaalsContact O-CG 3.23Å; V33-Q37 WeakPolarHBondContact O-CG 3.43Å; V33-Q37 PolarHBondContact O-N 3.15Å; Q37-S39 PolarHBondContact O-N 2.75Å; Q37-Y40 PolarHBondContact O-N 3.07Å; Q37-S41 WeakPolarHBondContact O-CB 3.35Å; Q37-S41 PolarHBondContact O-N 2.97Å
38	R	28	Very low	32.5	Very low	190 Å²	190	79.4 Å²	79.4	72%	0.717	39%	0.39	S	S	*	.	H	α-helix	trans	-56.8	-21.7	-179.3	-76.8	-174.9	176	-172.6	-1.9	115	S41 A42	R38-S41 PolarHBondContact O-OG 2.96Å; R38-S41 VanDerWaalsContact O-OG 3.11Å; R38-A42 WeakPolarHBondContact O-CB 3.04Å; R38-A42 PolarHBondContact O-N 3.36Å; R38-A42 VanDerWaalsContact O-N 3.08Å
39	S	35.6	Very low	32.6	Very low	9 Å²	9	80 Å²	80	6%	0.063	39%	0.392	C	S	.	.	H	α-helix	trans	-88.2	-33.4	-175.6	64.8	0	0	0	0	113.7	S36 Q37 A43 R240 E241	S36-S39 PolarHBondContact O-N 2.84Å; S36-S39 PolarHBondContact O-OG 2.75Å; Q37-S39 PolarHBondContact O-N 2.75Å; S39-A43 PolarHBondContact O-N 3.15Å; S39-R240 WeakPolarHBondContact OG-CD 3.41Å; S39-E241 VanDerWaalsContact CB-OE1 3.32Å; S39-E241 WeakPolarHBondContact CB-OE1 3.27Å
40	Y	35.6	Very low	32.7	Very low	108 Å²	108	77.1 Å²	77.1	42%	0.424	38%	0.381	S	S	.	.	H	α-helix	trans	-72.3	-42	166.7	-89.3	-84.4	0	0	0	109.9	Q37 A42 A43 S44	Q37-Y40 PolarHBondContact O-N 3.07Å; Y40-A42 VanDerWaalsContact C-N 3.26Å; Y40-A42 PolarHBondContact O-N 2.91Å; Y40-A43 PolarHBondContact O-N 3.29Å; Y40-S44 PolarHBondContact O-N 2.97Å; Y40-S44 PolarHBondContact O-OG 3.42Å
41	S	34.3	Very low	33	Very low	21 Å²	21	79.8 Å²	79.8	15%	0.147	39%	0.385	C	S	.	.	H	α-helix	trans	-52.2	-40.9	172	109.2	0	0	0	0	112.9	Q37 R38 S44 D45 E197	Q37-S41 WeakPolarHBondContact O-CB 3.35Å; Q37-S41 PolarHBondContact O-N 2.97Å; R38-S41 PolarHBondContact O-OG 2.96Å; R38-S41 VanDerWaalsContact O-OG 3.11Å; S41-S44 VanDerWaalsContact CA-OG 3.32Å; S41-S44 WeakPolarHBondContact CA-OG 3.4Å; S41-S44 PolarHBondContact O-OG 3.25Å; S41-D45 WeakPolarHBondContact O-CA 3.44Å; S41-D45 WeakPolarHBondContact O-CB 3.08Å; S41-D45 PolarHBondContact O-N 2.88Å; S41-E197 VanDerWaalsContact CB-CD 3.46Å; S41-E197 WeakPolarHBondContact CB-OE1 3.34Å; S41-E197 PolarHBondContact N-OE2 3.13Å
42	A	31.3	Very low	33.1	Very low	19 Å²	19	79.1 Å²	79.1	16%	0.157	38%	0.38	C	S	.	.	H	α-helix	trans	-73.4	-27.6	-179.6	0	0	0	0	0	113.2	R38 Y40 R46 F256	R38-A42 WeakPolarHBondContact O-CB 3.04Å; R38-A42 PolarHBondContact O-N 3.36Å; R38-A42 VanDerWaalsContact O-N 3.08Å; Y40-A42 VanDerWaalsContact C-N 3.26Å; Y40-A42 PolarHBondContact O-N 2.91Å; A42-R46 VanDerWaalsContact O-CB 3.26Å; A42-R46 WeakPolarHBondContact O-CB 3.39Å; A42-R46 WeakPolarHBondContact O-CG 3.23Å; A42-R46 PolarHBondContact O-N 3.49Å; A42-F256 HydrophobicContact CB-CD1 4.4Å; A42-F256 HydrophobicContact CB-CE1 3.48Å; A42-F256 VanDerWaalsContact CB-CE1 3.48Å; A42-F256 HydrophobicContact CB-CE2 3.81Å; A42-F256 HydrophobicContact CB-CZ 3.15Å
43	A	32.8	Very low	33.1	Very low	51 Å²	51	75.7 Å²	75.7	42%	0.421	37%	0.374	S	S	.	.	H	α-helix	trans	-76.8	-41	173.8	0	0	0	0	0	111.1	S39 Y40 R46 L47	S39-A43 PolarHBondContact O-N 3.15Å; Y40-A43 PolarHBondContact O-N 3.29Å; A43-R46 PolarHBondContact O-N 2.89Å; A43-L47 WeakPolarHBondContact O-CG 3.48Å; A43-L47 PolarHBondContact O-N 3.04Å
44	S	32.2	Very low	33.2	Very low	48 Å²	48	77.4 Å²	77.4	34%	0.336	38%	0.378	S	S	.	.	H	α-helix	trans	-71.2	-36.2	172.2	40.7	0	0	0	0	112.5	Y40 S41 R46 L47 Y48	Y40-S44 PolarHBondContact O-N 2.97Å; Y40-S44 PolarHBondContact O-OG 3.42Å; S41-S44 VanDerWaalsContact CA-OG 3.32Å; S41-S44 WeakPolarHBondContact CA-OG 3.4Å; S41-S44 PolarHBondContact O-OG 3.25Å; S44-R46 VanDerWaalsContact C-N 3.34Å; S44-L47 PolarHBondContact O-N 2.96Å; S44-Y48 WeakPolarHBondContact O-CB 3.36Å; S44-Y48 PolarHBondContact O-N 3.29Å
45	D	31.9	Very low	33.4	Very low	87 Å²	87	72.3 Å²	72.3	47%	0.465	37%	0.37	S	S	.	.	H	α-helix	trans	-65.7	-35.9	171.6	-78.8	-27.2	0	0	0	111	S41 Y48 L49	S41-D45 WeakPolarHBondContact O-CA 3.44Å; S41-D45 WeakPolarHBondContact O-CB 3.08Å; S41-D45 PolarHBondContact O-N 2.88Å; D45-Y48 WeakPolarHBondContact O-CB 3.29Å; D45-Y48 PolarHBondContact O-N 3.48Å; D45-L49 VanDerWaalsContact O-CB 3.25Å; D45-L49 WeakPolarHBondContact O-CB 3.26Å; D45-L49 WeakPolarHBondContact O-CD1 3.2Å; D45-L49 VanDerWaalsContact O-CG 3.28Å; D45-L49 WeakPolarHBondContact O-CG 3.37Å; D45-L49 PolarHBondContact O-N 3.12Å
46	R	34.8	Very low	33.4	Very low	139 Å²	139	75.7 Å²	75.7	53%	0.525	38%	0.384	S	S	.	.	H	α-helix	trans	-72.3	-32.9	172.4	-92	-173.3	174	-176.5	0	112.8	A42 A43 S44 L49 S50 E258	A42-R46 VanDerWaalsContact O-CB 3.26Å; A42-R46 WeakPolarHBondContact O-CB 3.39Å; A42-R46 WeakPolarHBondContact O-CG 3.23Å; A42-R46 PolarHBondContact O-N 3.49Å; A43-R46 PolarHBondContact O-N 2.89Å; S44-R46 VanDerWaalsContact C-N 3.34Å; R46-L49 PolarHBondContact O-N 3.45Å; R46-S50 WeakPolarHBondContact O-CA 3.27Å; R46-S50 WeakPolarHBondContact O-CB 3.38Å; R46-S50 PolarHBondContact O-N 3.06Å; R46-S50 PolarHBondContact O-OG 3.34Å; R46-E258 IonicContact NH1-OE1 3.22Å; R46-E258 PolarHBondContact NH1-OE1 3.21Å
47	L	34.6	Very low	33.3	Very low	83 Å²	83	76.3 Å²	76.3	44%	0.435	39%	0.388	S	S	.	.	H	α-helix	trans	-65.9	-43.2	169	-72.2	163.5	0	0	0	109.8	A43 S44 L49 S50 Y51	A43-L47 WeakPolarHBondContact O-CG 3.48Å; A43-L47 PolarHBondContact O-N 3.04Å; S44-L47 PolarHBondContact O-N 2.96Å; L47-L49 VanDerWaalsContact C-N 3.33Å; L47-L49 PolarHBondContact O-N 3.4Å; L47-S50 WeakPolarHBondContact CA-OG 3.33Å; L47-S50 PolarHBondContact O-N 2.89Å; L47-S50 PolarHBondContact O-OG 2.98Å; L47-S50 VanDerWaalsContact O-OG 3.11Å; L47-Y51 HydrophobicContact CB-CD2 4.18Å; L47-Y51 HydrophobicContact CB-CE2 4.15Å; L47-Y51 HydrophobicContact CD2-CD2 4.48Å; L47-Y51 HydrophobicContact CD2-CE2 3.75Å; L47-Y51 VanDerWaalsContact O-CB 3.32Å; L47-Y51 WeakPolarHBondContact O-CB 3.39Å; L47-Y51 WeakPolarHBondContact O-CD2 3.42Å; L47-Y51 PolarHBondContact O-N 2.9Å
48	Y	34.3	Very low	33.2	Very low	120 Å²	120	79.7 Å²	79.7	47%	0.471	41%	0.406	S	S	.	.	H	α-helix	trans	-57.5	-44.8	173.5	-133.4	-65	0	0	0	111.6	S44 D45 S52 Y179	S44-Y48 WeakPolarHBondContact O-CB 3.36Å; S44-Y48 PolarHBondContact O-N 3.29Å; D45-Y48 WeakPolarHBondContact O-CB 3.29Å; D45-Y48 PolarHBondContact O-N 3.48Å; Y48-S52 WeakPolarHBondContact O-CB 3.48Å; Y48-S52 PolarHBondContact O-N 2.85Å; Y48-S52 PolarHBondContact O-OG 3.42Å; Y48-Y179 HydrophobicContact CD2-CD2 4.23Å; Y48-Y179 AromaticContact CD2-CE2 3.37Å; Y48-Y179 HydrophobicContact CD2-CE2 3.37Å; Y48-Y179 HydrophobicContact CE2-CD2 4.22Å; Y48-Y179 AromaticContact CE2-CE2 3.16Å; Y48-Y179 HydrophobicContact CE2-CE2 3.16Å; Y48-Y179 AromaticContact CE2-CZ 3.59Å; Y48-Y179 VanDerWaalsContact CE2-OH 3.26Å; Y48-Y179 WeakPolarHBondContact CE2-OH 3.46Å; Y48-Y179 HydrophobicContact CG-CE2 4.34Å; Y48-Y179 AromaticContact CZ-CE2 3.99Å; Y48-Y179 AromaticContact CZ-CZ 4Å; Y48-Y179 PolarHBondContact OH-OH 3.41Å; Y48-Y179 VanDerWaalsContact OH-OH 3.08Å
49	L	32	Very low	33.6	Very low	97 Å²	97	74.4 Å²	74.4	51%	0.508	40%	0.403	S	S	.	.	H	α-helix	trans	-78.3	-29.4	-179.9	-76.1	160.8	0	0	0	113.2	D45 R46 L47 S52 N53	D45-L49 VanDerWaalsContact O-CB 3.25Å; D45-L49 WeakPolarHBondContact O-CB 3.26Å; D45-L49 WeakPolarHBondContact O-CD1 3.2Å; D45-L49 VanDerWaalsContact O-CG 3.28Å; D45-L49 WeakPolarHBondContact O-CG 3.37Å; D45-L49 PolarHBondContact O-N 3.12Å; R46-L49 PolarHBondContact O-N 3.45Å; L47-L49 VanDerWaalsContact C-N 3.33Å; L47-L49 PolarHBondContact O-N 3.4Å; L49-S52 WeakPolarHBondContact CA-OG 3.27Å; L49-N53 VanDerWaalsContact CD2-ND2 3.32Å; L49-N53 WeakPolarHBondContact CD2-ND2 3.33Å; L49-N53 WeakPolarHBondContact O-CB 3.44Å; L49-N53 VanDerWaalsContact O-CG 3.31Å; L49-N53 PolarHBondContact O-N 3.25Å; L49-N53 PolarHBondContact O-ND2 2.91Å
50	S	34.4	Very low	33.5	Very low	38 Å²	38	81.9 Å²	81.9	27%	0.266	44%	0.437	S	S	.	.	H	α-helix	trans	-74.4	-46.8	175.2	66.4	0	0	0	0	109.7	R46 L47 S52 E54	R46-S50 WeakPolarHBondContact O-CA 3.27Å; R46-S50 WeakPolarHBondContact O-CB 3.38Å; R46-S50 PolarHBondContact O-N 3.06Å; R46-S50 PolarHBondContact O-OG 3.34Å; L47-S50 WeakPolarHBondContact CA-OG 3.33Å; L47-S50 PolarHBondContact O-N 2.89Å; L47-S50 PolarHBondContact O-OG 2.98Å; L47-S50 VanDerWaalsContact O-OG 3.11Å; S50-S52 VanDerWaalsContact C-N 3.34Å; S50-S52 PolarHBondContact O-N 3.08Å; S50-E54 WeakPolarHBondContact O-CB 3.49Å; S50-E54 WeakPolarHBondContact O-CG 3.44Å; S50-E54 PolarHBondContact O-N 2.97Å
51	Y	36.7	Very low	33.5	Very low	115 Å²	115	83.9 Å²	83.9	45%	0.451	45%	0.45	S	S	.	.	H	α-helix	trans	-66.5	-33.4	177.2	-72.3	-62.9	0	0	0	112.7	L47 A55	L47-Y51 HydrophobicContact CB-CD2 4.18Å; L47-Y51 HydrophobicContact CB-CE2 4.15Å; L47-Y51 HydrophobicContact CD2-CD2 4.48Å; L47-Y51 HydrophobicContact CD2-CE2 3.75Å; L47-Y51 VanDerWaalsContact O-CB 3.32Å; L47-Y51 WeakPolarHBondContact O-CB 3.39Å; L47-Y51 WeakPolarHBondContact O-CD2 3.42Å; L47-Y51 PolarHBondContact O-N 2.9Å; Y51-A55 WeakPolarHBondContact O-CB 3.22Å
52	S	32.8	Very low	33.6	Very low	48 Å²	48	88.5 Å²	88.5	34%	0.336	48%	0.478	S	S	.	.	H	α-helix	trans	-84.1	-39.2	177.6	60	0	0	0	0	114.4	Y48 L49 S50	Y48-S52 WeakPolarHBondContact O-CB 3.48Å; Y48-S52 PolarHBondContact O-N 2.85Å; Y48-S52 PolarHBondContact O-OG 3.42Å; L49-S52 WeakPolarHBondContact CA-OG 3.27Å; S50-S52 VanDerWaalsContact C-N 3.34Å; S50-S52 PolarHBondContact O-N 3.08Å
53	N	30.7	Very low	33.7	Very low	87 Å²	87	98.4 Å²	98.4	47%	0.465	51%	0.511	S	S	.	.	H	α-helix	trans	-84.4	-27.4	-178.5	-65.4	-53.5	0	0	0	113.7	L49 L56 S57	L49-N53 VanDerWaalsContact CD2-ND2 3.32Å; L49-N53 WeakPolarHBondContact CD2-ND2 3.33Å; L49-N53 WeakPolarHBondContact O-CB 3.44Å; L49-N53 VanDerWaalsContact O-CG 3.31Å; L49-N53 PolarHBondContact O-N 3.25Å; L49-N53 PolarHBondContact O-ND2 2.91Å; N53-L56 PolarHBondContact O-N 2.92Å; N53-S57 WeakPolarHBondContact O-CB 3.33Å; N53-S57 PolarHBondContact O-N 2.7Å; N53-S57 VanDerWaalsContact O-N 3.13Å; N53-S57 PolarHBondContact O-OG 3.48Å
54	E	34.9	Very low	33.7	Very low	91 Å²	91	103.1 Å²	103.1	43%	0.425	53%	0.529	S	S	.	.	H	α-helix	trans	-72.2	-35.6	173.2	-68.3	-178.3	156	0	0	111.1	S50 L56 S57 I58	S50-E54 WeakPolarHBondContact O-CB 3.49Å; S50-E54 WeakPolarHBondContact O-CG 3.44Å; S50-E54 PolarHBondContact O-N 2.97Å; E54-L56 PolarHBondContact O-N 3.46Å; E54-S57 WeakPolarHBondContact CA-OG 3.39Å; E54-S57 PolarHBondContact O-N 3.09Å; E54-S57 PolarHBondContact O-OG 2.92Å; E54-I58 HydrophobicContact CB-CD1 4.24Å; E54-I58 WeakPolarHBondContact O-CB 3.23Å; E54-I58 WeakPolarHBondContact O-CD1 3.4Å; E54-I58 WeakPolarHBondContact O-CG1 3.21Å; E54-I58 PolarHBondContact O-N 3.13Å
55	A	32.7	Very low	33.5	Very low	52 Å²	52	104.7 Å²	104.7	43%	0.43	55%	0.553	S	S	.	*	H	α-helix	trans	-63.8	-23.8	174.2	0	0	0	0	0	113.9	Y51	Y51-A55 WeakPolarHBondContact O-CB 3.22Å
56	L	32.5	Very low	33.6	Very low	125 Å²	125	106.2 Å²	106.2	65%	0.654	57%	0.571	S	S	*	*	H	α-helix	trans	-92	-25.5	176	-87	153.8	0	0	0	113.4	N53 E54	N53-L56 PolarHBondContact O-N 2.92Å; E54-L56 PolarHBondContact O-N 3.46Å
57	S	31.3	Very low	33.4	Very low	43 Å²	43	107.3 Å²	107.3	30%	0.301	59%	0.587	S	S	.	*	H	α-helix	trans	-91.3	-29.3	-178	51.5	0	0	0	0	113.8	N53 E54 A59 Q60 Q61	N53-S57 WeakPolarHBondContact O-CB 3.33Å; N53-S57 PolarHBondContact O-N 2.7Å; N53-S57 VanDerWaalsContact O-N 3.13Å; N53-S57 PolarHBondContact O-OG 3.48Å; E54-S57 WeakPolarHBondContact CA-OG 3.39Å; E54-S57 PolarHBondContact O-N 3.09Å; E54-S57 PolarHBondContact O-OG 2.92Å; S57-A59 VanDerWaalsContact C-N 3.26Å; S57-A59 PolarHBondContact O-N 3.35Å; S57-Q60 PolarHBondContact O-N 3.03Å; S57-Q60 VanDerWaalsContact O-N 3.13Å; S57-Q61 PolarHBondContact O-N 3.21Å
58	I	35.1	Very low	33.3	Very low	102 Å²	102	111.3 Å²	111.3	52%	0.523	61%	0.609	S	S	.	*	H	α-helix	trans	-66.8	-28.6	176.4	-65.6	165.7	0	0	0	111.6	E54 Q60	E54-I58 HydrophobicContact CB-CD1 4.24Å; E54-I58 WeakPolarHBondContact O-CB 3.23Å; E54-I58 WeakPolarHBondContact O-CD1 3.4Å; E54-I58 WeakPolarHBondContact O-CG1 3.21Å; E54-I58 PolarHBondContact O-N 3.13Å; I58-Q60 PolarHBondContact O-N 2.91Å
59	A	34.5	Very low	33.1	Very low	80 Å²	80	110.3 Å²	110.3	66%	0.661	63%	0.625	S	S	*	*	H	α-helix	trans	-71.8	-12.7	175	0	0	0	0	0	114.2	S57	S57-A59 VanDerWaalsContact C-N 3.26Å; S57-A59 PolarHBondContact O-N 3.35Å
60	Q	35.1	Very low	33.3	Very low	166 Å²	166	112.2 Å²	112.2	78%	0.776	64%	0.641	S	S	*	*	H	α-helix	trans	-111.2	-16.9	-178.4	-68.5	-174.8	-10.5	0	0	113.8	S57 I58	S57-Q60 PolarHBondContact O-N 3.03Å; S57-Q60 VanDerWaalsContact O-N 3.13Å; I58-Q60 PolarHBondContact O-N 2.91Å
61	Q	35.7	Very low	32.9	Very low	149 Å²	149	114.4 Å²	114.4	70%	0.696	67%	0.669	S	S	*	*	H	α-helix	trans	-96.1	-8.4	-174.2	-70.8	-176.1	-1.8	0	0	115.1	S57 R63	S57-Q61 PolarHBondContact O-N 3.21Å; Q61-R63 PolarHBondContact O-N 3.02Å; Q61-R63 VanDerWaalsContact O-N 3.07Å
62	T	35.8	Very low	32.8	Very low	119 Å²	119	113.2 Å²	113.2	73%	0.73	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	13.3	178.3	50.5	0	0	0	0	115
63	R	33.1	Very low	32.6	Very low	227 Å²	227	123.2 Å²	123.2	86%	0.857	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	-7.6	178.5	-90.3	-173.8	176.6	-176.8	0.6	117.1	Q61	Q61-R63 PolarHBondContact O-N 3.02Å; Q61-R63 VanDerWaalsContact O-N 3.07Å
64	N	33.1	Very low	32.7	Very low	149 Å²	149	124 Å²	124	80%	0.797	71%	0.713	S	S	*	*			trans	-132.7	104.2	179.8	-77	-24.9	0	0	0	111.6
65	G	27.8	Very low	32.8	Very low	82 Å²	82	125 Å²	125	85%	0.845	73%	0.725	S	S	*	*			trans	-71.7	127.8	170.8	0	0	0	0	0	111.8
66	S	34.7	Very low	32.9	Very low	119 Å²	119	130.2 Å²	130.2	83%	0.832	74%	0.738	S	S	*	*			trans	-160.4	126.9	148.2	35.6	0	0	0	0	109.3
67	N	28.7	Very low	33.3	Very low	162 Å²	162	126.1 Å²	126.1	87%	0.866	72%	0.722	S	S	*	*			trans	-68.4	123.8	178.5	-66.5	-39.5	0	0	0	110
68	D	33.5	Very low	33.7	Very low	167 Å²	167	130.7 Å²	130.7	89%	0.893	74%	0.741	S	S	*	*			trans	-142.5	116.6	151.4	-95	-30.7	0	0	0	110.4
69	A	30	Very low	34.3	Very low	99 Å²	99	129.9 Å²	129.9	82%	0.818	74%	0.74	S	S	*	*			trans	-94.8	97	-173.2	0	0	0	0	0	110.3
70	T	35.4	Very low	34.8	Very low	136 Å²	136	131.8 Å²	131.8	83%	0.834	74%	0.739	S	S	*	*			trans	-158.2	108.1	159.4	45.7	0	0	0	0	112.1
71	G	27.9	Very low	35.4	Very low	84 Å²	84	132.7 Å²	132.7	87%	0.866	74%	0.744	S	S	*	*				89.9	12.6	119.9	0	0	0	0	0	122
72	S	34.2	Very low	35.8	Very low	91 Å²	91	134.3 Å²	134.3	64%	0.636	75%	0.751	S	S	*	*			trans	-120.8	101.1	171.6	-63.6	0	0	0	0	111.4	N74	S72-N74 PolarHBondContact O-N 3.49Å
73	R	28.2	Very low	36.4	Very low	257 Å²	257	131.5 Å²	131.5	97%	0.97	73%	0.734	S	S	*	*			trans	-74.6	74.9	164.7	-83.7	179.2	161.9	168.5	-6.2	108.3
74	N	32.5	Very low	37.4	Very low	104 Å²	104	129.1 Å²	129.1	56%	0.556	74%	0.738	S	S	*	*			trans	-80	143.3	165.7	-71.5	2.7	0	0	0	108.3	S72 F76	S72-N74 PolarHBondContact O-N 3.49Å; N74-F76 VanDerWaalsContact O-CD2 3.28Å; N74-F76 WeakPolarHBondContact O-CD2 3.47Å; N74-F76 PolarHBondContact O-N 3.48Å
75	V	36.3	Very low	38.5	Very low	112 Å²	112	128.3 Å²	128.3	68%	0.679	73%	0.734	S	S	*	*			trans	-59.8	100.2	-179.9	179.9	0	0	0	0	108.5	A77	V75-A77 PolarHBondContact O-N 3.39Å; V75-A77 VanDerWaalsContact O-N 3.1Å
76	F	35.1	Very low	39.9	Very low	162 Å²	162	127.6 Å²	127.6	71%	0.711	73%	0.727	S	S	*	*			trans	-74.3	98.7	173.8	-82.7	-87.4	0	0	0	108.3	N74 M78	N74-F76 VanDerWaalsContact O-CD2 3.28Å; N74-F76 WeakPolarHBondContact O-CD2 3.47Å; N74-F76 PolarHBondContact O-N 3.48Å; F76-M78 PolarHBondContact O-N 2.64Å
77	A	40.9	Very low	41.1	Very low	39 Å²	39	126.5 Å²	126.5	32%	0.322	71%	0.708	S	S	.	*			trans	-66.5	115.6	158.2	0	0	0	0	0	107.3	V75 V79	V75-A77 PolarHBondContact O-N 3.39Å; V75-A77 VanDerWaalsContact O-N 3.1Å; A77-V79 PolarHBondContact O-N 3.39Å
78	M	40.5	Very low	42.8	Very low	139 Å²	139	126.5 Å²	126.5	69%	0.685	70%	0.7	S	S	*	*			trans	-74.4	113.8	170.1	-70.8	-162.3	168.8	0	0	107.6	F76	F76-M78 PolarHBondContact O-N 2.64Å
79	V	48	Very low	44.7	Very low	85 Å²	85	122.2 Å²	122.2	52%	0.515	67%	0.672	S	S	.	*	B	Isolated β-bridge	trans	-93.4	109	170.7	-176.4	0	0	0	0	106.2	A77	A77-V79 PolarHBondContact O-N 3.39Å
80	D	43.5	Very low	47.1	Very low	119 Å²	119	119.1 Å²	119.1	64%	0.636	64%	0.644	S	S	*	*			trans	-72	130.4	167.7	-87.9	-19.3	0	0	0	109	Q82	D80-Q82 PolarHBondContact O-N 3.36Å
81	E	48.3	Very low	49.4	Very low	186 Å²	186	116 Å²	116	87%	0.869	62%	0.617	S	S	*	*			trans	-70.7	115	172	-75.5	-174.9	149.6	0	0	109.9
82	Q	43.5	Very low	52	Low	183 Å²	183	113.3 Å²	113.3	86%	0.855	58%	0.583	S	S	*	*			trans	58.2	93.1	154.2	-61.3	178.6	-8.3	0	0	117	D80	D80-Q82 PolarHBondContact O-N 3.36Å
83	T	49.5	Very low	54.2	Low	59 Å²	59	118.5 Å²	118.5	36%	0.362	59%	0.589	S	S	.	*			trans	-77.9	151.7	148.4	49	0	0	0	0	110	D85 G86	T83-D85 PolarHBondContact O-N 2.98Å; T83-G86 PolarHBondContact O-N 3.35Å; T83-G86 VanDerWaalsContact O-N 3.1Å
84	D	54.4	Low	56.7	Low	178 Å²	178	109.3 Å²	109.3	95%	0.952	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.2	-14.8	-172.9	-74.8	-32.2	0	0	0	116.1
85	D	55.3	Low	59.1	Low	131 Å²	131	105.3 Å²	105.3	70%	0.701	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	1.1	-179.4	-62.5	-39.2	0	0	0	115.3	T83 E87	T83-D85 PolarHBondContact O-N 2.98Å; D85-E87 PolarHBondContact O-N 2.98Å; D85-E87 VanDerWaalsContact O-N 3.1Å
86	G	58.7	Low	61.4	Low	68 Å²	68	111.4 Å²	111.4	70%	0.701	56%	0.564	S	S	*	*			trans	71	2	175.3	0	0	0	0	0	116.1	T83	T83-G86 PolarHBondContact O-N 3.35Å; T83-G86 VanDerWaalsContact O-N 3.1Å
87	E	58.5	Low	63.7	Low	95 Å²	95	104 Å²	104	44%	0.444	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-83.8	127.5	174.5	-63.2	-171.1	163.7	0	0	111.2	D85 R89 K104	D85-E87 PolarHBondContact O-N 2.98Å; D85-E87 VanDerWaalsContact O-N 3.1Å; E87-R89 PolarHBondContact O-N 3.34Å; E87-K104 IonicContact OE1-NZ 2.92Å; E87-K104 PolarHBondContact OE1-NZ 3.23Å; E87-K104 IonicContact OE2-NZ 3.22Å; E87-K104 PolarHBondContact OE2-NZ 2.91Å
88	K	65	Low	65.9	Low	162 Å²	162	102.1 Å²	102.1	70%	0.704	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-72.2	116.2	173.4	-66.5	-178.7	-179.1	-179.9	0	108.9
89	R	72.5	Confident	68	Low	77 Å²	77	96.2 Å²	96.2	29%	0.291	49%	0.488	S	S	.	.	P	Polyproline II helix	trans	-90.9	123.4	173.6	-63.5	-174.7	-177	-167	-2.2	109.4	E87 Y91	E87-R89 PolarHBondContact O-N 3.34Å; R89-Y91 HydrophobicContact CB-CE2 3.86Å
90	S	80.3	Confident	69.8	Low	34 Å²	34	93.3 Å²	93.3	24%	0.238	47%	0.471	C	S	.	.	B	Isolated β-bridge	trans	-113.1	126.6	175.5	46.9	0	0	0	0	109.4	C98 L99	S90-C98 WeakPolarHBondContact O-CA 3.49Å; S90-L99 PolarHBondContact O-N 3.45Å
91	Y	85	Confident	71.8	Confident	70 Å²	70	92.4 Å²	92.4	28%	0.275	46%	0.463	S	S	.	.	B	Isolated β-bridge	trans	-110.5	141.6	178.6	-65.5	-85.4	0	0	0	110.6	R89 I97 C98	R89-Y91 HydrophobicContact CB-CE2 3.86Å; Y91-I97 WeakPolarHBondContact CA-O 3.31Å; Y91-C98 HydrophobicContact CD1-CB 4.14Å; Y91-C98 HydrophobicContact CE1-CB 3.68Å
92	I	82.5	Confident	73.7	Confident	29 Å²	29	83.7 Å²	83.7	15%	0.149	42%	0.423	C	S	.	.			trans	-78.5	131.5	173.6	-61.5	158.4	0	0	0	109	G94 T95 I97 L99 D172	I92-G94 PolarHBondContact O-N 3.3Å; I92-T95 WeakPolarHBondContact CB-OG1 3.49Å; I92-T95 HydrophobicContact CG2-CG2 4.3Å; I92-T95 PolarHBondContact O-N 2.98Å; I92-T95 VanDerWaalsContact O-N 3.13Å; I92-T95 VanDerWaalsContact O-O 3.13Å; I92-T95 PolarHBondContact O-OG1 3.03Å; I92-I97 PolarHBondContact N-O 2.88Å; I92-L99 HydrophobicContact CD1-CD2 3.67Å; I92-L99 HydrophobicContact CD1-CG 4.5Å; I92-L99 HydrophobicContact CG1-CD2 3.9Å; I92-L99 HydrophobicContact CG1-CG 4.25Å; I92-D172 HydrophobicContact CD1-CB 3.94Å
93	W	80.3	Confident	75.8	Confident	200 Å²	200	77 Å²	77	76%	0.758	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.3	128.2	178.1	-177.2	79.2	0	0	0	111.4
94	G	80.8	Confident	77.7	Confident	64 Å²	64	78 Å²	78	66%	0.66	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.7	-4.5	-177.9	0	0	0	0	0	114.5	I92	I92-G94 PolarHBondContact O-N 3.3Å
95	T	83.3	Confident	79.3	Confident	20 Å²	20	70.2 Å²	70.2	12%	0.123	35%	0.351	C	S	.	.	S	Bend	trans	-126	168.6	172.7	80.3	0	0	0	0	110.4	I92 I97 Y169	I92-T95 WeakPolarHBondContact CB-OG1 3.49Å; I92-T95 HydrophobicContact CG2-CG2 4.3Å; I92-T95 PolarHBondContact O-N 2.98Å; I92-T95 VanDerWaalsContact O-N 3.13Å; I92-T95 VanDerWaalsContact O-O 3.13Å; I92-T95 PolarHBondContact O-OG1 3.03Å; T95-I97 HydrophobicContact CG2-CD1 4.39Å; T95-I97 PolarHBondContact OG1-N 2.87Å; T95-Y169 HydrophobicContact CG2-CD1 3.48Å; T95-Y169 VanDerWaalsContact CG2-CD1 3.48Å; T95-Y169 HydrophobicContact CG2-CD2 4.48Å; T95-Y169 HydrophobicContact CG2-CE1 3.49Å; T95-Y169 VanDerWaalsContact CG2-CE1 3.49Å; T95-Y169 HydrophobicContact CG2-CE2 4.46Å; T95-Y169 HydrophobicContact CG2-CG 3.99Å
96	R	83.6	Confident	80.9	Confident	239 Å²	239	64.1 Å²	64.1	90%	0.902	32%	0.319	S	S	*	.			trans	-100.3	16.4	173.4	-64.1	-177	180	177.8	0.6	112
97	I	83.8	Confident	82.4	Confident	6 Å²	6	62.8 Å²	62.8	3%	0.031	29%	0.292	C	S	.	.			trans	-87.4	127.2	-169.2	-61.4	162.7	0	0	0	109.4	Y91 I92 T95 V102 Q165 Y169 I173	Y91-I97 WeakPolarHBondContact CA-O 3.31Å; I92-I97 PolarHBondContact N-O 2.88Å; T95-I97 HydrophobicContact CG2-CD1 4.39Å; T95-I97 PolarHBondContact OG1-N 2.87Å; I97-V102 HydrophobicContact CG2-CG2 3.49Å; I97-V102 VanDerWaalsContact CG2-CG2 3.49Å; I97-Q165 HydrophobicContact CG1-CG 4.34Å; I97-Y169 HydrophobicContact CD1-CD2 3.47Å; I97-Y169 VanDerWaalsContact CD1-CD2 3.47Å; I97-Y169 HydrophobicContact CD1-CE2 4.14Å; I97-Y169 HydrophobicContact CD1-CG 3.87Å; I97-I173 HydrophobicContact CD1-CD1 3.84Å; I97-I173 HydrophobicContact CD1-CG1 4.27Å
98	C	86.4	Confident	83.8	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.007	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-92.1	121.3	172.1	-171.8	0	0	0	0	109.4	S90 Y91 S100 E101 V102	S90-C98 WeakPolarHBondContact O-CA 3.49Å; Y91-C98 HydrophobicContact CD1-CB 4.14Å; Y91-C98 HydrophobicContact CE1-CB 3.68Å; C98-S100 PolarHBondContact O-N 3.35Å; C98-S100 PolarHBondContact SG-OG 3.47Å; C98-S100 VanDerWaalsContact SG-OG 3.33Å; C98-E101 HydrophobicContact CB-CB 4.12Å; C98-E101 HydrophobicContact CB-CG 3.91Å; C98-E101 PolarHBondContact O-N 2.9Å; C98-V102 PolarHBondContact O-N 2.84Å
99	L	84.4	Confident	85	Confident	15 Å²	15	57.7 Å²	57.7	8%	0.079	27%	0.265	C	S	.	.	H	α-helix	trans	-62.7	-41.9	-175.3	-68.9	175.3	0	0	0	112.5	S90 I92 E101 V102 E103 Y176	S90-L99 PolarHBondContact O-N 3.45Å; I92-L99 HydrophobicContact CD1-CD2 3.67Å; I92-L99 HydrophobicContact CD1-CG 4.5Å; I92-L99 HydrophobicContact CG1-CD2 3.9Å; I92-L99 HydrophobicContact CG1-CG 4.25Å; L99-E101 VanDerWaalsContact C-N 3.27Å; L99-E101 PolarHBondContact O-N 3.38Å; L99-V102 PolarHBondContact O-N 3.16Å; L99-E103 PolarHBondContact O-N 2.89Å; L99-Y176 HydrophobicContact CB-CE1 4.17Å; L99-Y176 HydrophobicContact CB-CE2 4.34Å; L99-Y176 HydrophobicContact CD2-CD1 4.07Å; L99-Y176 HydrophobicContact CD2-CD2 4.02Å; L99-Y176 HydrophobicContact CD2-CE1 4.12Å; L99-Y176 HydrophobicContact CD2-CE2 4.11Å; L99-Y176 HydrophobicContact CD2-CG 4.01Å; L99-Y176 VanDerWaalsContact O-CE1 3.26Å; L99-Y176 WeakPolarHBondContact O-CE1 3.4Å; L99-Y176 PolarHBondContact O-OH 3.32Å
100	S	85.9	Confident	85.6	Confident	23 Å²	23	54.3 Å²	54.3	16%	0.161	25%	0.253	C	S	.	.	H	α-helix	trans	-66.1	-28.9	-179	58.1	0	0	0	0	113.3	C98 K104	C98-S100 PolarHBondContact O-N 3.35Å; C98-S100 PolarHBondContact SG-OG 3.47Å; C98-S100 VanDerWaalsContact SG-OG 3.33Å; S100-K104 WeakPolarHBondContact O-CB 3.43Å; S100-K104 VanDerWaalsContact O-CG 3.26Å; S100-K104 WeakPolarHBondContact O-CG 3.32Å; S100-K104 PolarHBondContact O-N 3.19Å
101	E	86.4	Confident	85.8	Confident	100 Å²	100	58.7 Å²	58.7	47%	0.467	27%	0.269	S	S	.	.	H	α-helix	trans	-72.2	-43.1	175.3	-68.2	176.4	-177.7	0	0	110.9	C98 L99 K104 A105	C98-E101 HydrophobicContact CB-CB 4.12Å; C98-E101 HydrophobicContact CB-CG 3.91Å; C98-E101 PolarHBondContact O-N 2.9Å; L99-E101 VanDerWaalsContact C-N 3.27Å; L99-E101 PolarHBondContact O-N 3.38Å; E101-K104 PolarHBondContact O-N 3.01Å; E101-A105 VanDerWaalsContact O-CB 3.32Å; E101-A105 WeakPolarHBondContact O-CB 3.11Å; E101-A105 PolarHBondContact O-N 3.06Å
102	V	87.3	Confident	85.7	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.018	28%	0.28	C	S	.	.	H	α-helix	trans	-61.7	-45.2	176.5	176.3	0	0	0	0	111	I97 C98 L99 A105 F106 L162 Y176 L177	I97-V102 HydrophobicContact CG2-CG2 3.49Å; I97-V102 VanDerWaalsContact CG2-CG2 3.49Å; C98-V102 PolarHBondContact O-N 2.84Å; L99-V102 PolarHBondContact O-N 3.16Å; V102-A105 PolarHBondContact O-N 3.08Å; V102-F106 WeakPolarHBondContact O-CB 3.38Å; V102-F106 PolarHBondContact O-N 3.27Å; V102-L162 HydrophobicContact CG1-CD1 4.01Å; V102-Y176 HydrophobicContact CB-CD1 4.37Å; V102-Y176 HydrophobicContact CB-CE1 4.29Å; V102-Y176 HydrophobicContact CG1-CD1 4Å; V102-Y176 HydrophobicContact CG1-CE1 4.33Å; V102-L177 HydrophobicContact CG1-CD2 4.46Å
103	E	87.7	Confident	85.6	Confident	43 Å²	43	59.1 Å²	59.1	20%	0.201	28%	0.276	C	S	.	.	H	α-helix	trans	-59.3	-49.9	177.4	177.8	-179.2	178.5	0	0	111.4	L99 A105 F106 R107 Y176 T180	L99-E103 PolarHBondContact O-N 2.89Å; E103-A105 VanDerWaalsContact C-N 3.33Å; E103-A105 PolarHBondContact O-N 3.2Å; E103-F106 PolarHBondContact O-N 3.02Å; E103-R107 HydrophobicContact CG-CG 4.45Å; E103-R107 WeakPolarHBondContact O-CB 3.33Å; E103-R107 WeakPolarHBondContact O-CG 3.42Å; E103-R107 PolarHBondContact O-N 2.96Å; E103-R107 IonicContact OE1-CZ 2.82Å; E103-R107 IonicContact OE1-NE 3.68Å; E103-R107 PolarHBondContact OE1-NE 3.31Å; E103-R107 IonicContact OE1-NH2 2.99Å; E103-R107 PolarHBondContact OE1-NH2 3.28Å; E103-Y176 HydrophobicContact CB-CE1 3.99Å; E103-Y176 PolarHBondContact OE2-OH 3.14Å; E103-T180 HydrophobicContact CB-CG2 4.02Å; E103-T180 HydrophobicContact CG-CG2 3.78Å
104	K	89	Confident	85.2	Confident	79 Å²	79	60 Å²	60	34%	0.343	28%	0.279	S	S	.	.	H	α-helix	trans	-62.4	-40.9	179.3	-73.4	172.8	178.7	-175.3	0	111.7	E87 S100 E101 R108	E87-K104 IonicContact OE1-NZ 2.92Å; E87-K104 PolarHBondContact OE1-NZ 3.23Å; E87-K104 IonicContact OE2-NZ 3.22Å; E87-K104 PolarHBondContact OE2-NZ 2.91Å; S100-K104 WeakPolarHBondContact O-CB 3.43Å; S100-K104 VanDerWaalsContact O-CG 3.26Å; S100-K104 WeakPolarHBondContact O-CG 3.32Å; S100-K104 PolarHBondContact O-N 3.19Å; E101-K104 PolarHBondContact O-N 3.01Å; K104-R108 WeakPolarHBondContact O-CB 3.38Å; K104-R108 WeakPolarHBondContact O-CD 3.47Å; K104-R108 WeakPolarHBondContact O-CG 3.32Å; K104-R108 PolarHBondContact O-N 3.06Å; K104-R108 VanDerWaalsContact O-N 3.13Å
105	A	88.8	Confident	84.4	Confident	15 Å²	15	58.6 Å²	58.6	12%	0.124	26%	0.259	C	S	.	.	H	α-helix	trans	-64.2	-46.7	177.6	0	0	0	0	0	111.2	E101 V102 E103 R108 F109	E101-A105 VanDerWaalsContact O-CB 3.32Å; E101-A105 WeakPolarHBondContact O-CB 3.11Å; E101-A105 PolarHBondContact O-N 3.06Å; V102-A105 PolarHBondContact O-N 3.08Å; E103-A105 VanDerWaalsContact C-N 3.33Å; E103-A105 PolarHBondContact O-N 3.2Å; A105-R108 PolarHBondContact O-N 2.8Å; A105-F109 PolarHBondContact O-N 3.11Å
106	F	89.4	Confident	83	Confident	4 Å²	4	63 Å²	63	2%	0.018	29%	0.29	C	S	.	.	H	α-helix	trans	-67.9	-42.2	-179.2	-174.2	-109.7	0	0	0	112.9	V102 E103 R108 F109 V110 L150 L162 L177 T180 L181 I200	V102-F106 WeakPolarHBondContact O-CB 3.38Å; V102-F106 PolarHBondContact O-N 3.27Å; E103-F106 PolarHBondContact O-N 3.02Å; F106-R108 VanDerWaalsContact C-N 3.34Å; F106-R108 PolarHBondContact O-N 3.03Å; F106-F109 HydrophobicContact CD2-CD1 4.25Å; F106-F109 HydrophobicContact CE2-CD1 4.22Å; F106-F109 WeakPolarHBondContact O-CB 3.18Å; F106-F109 PolarHBondContact O-N 3.46Å; F106-F109 VanDerWaalsContact O-N 3.14Å; F106-V110 HydrophobicContact CD1-CG2 4.24Å; F106-V110 HydrophobicContact CD2-CG2 4.47Å; F106-V110 HydrophobicContact CE1-CG2 3.83Å; F106-V110 HydrophobicContact CE2-CG2 4.08Å; F106-V110 HydrophobicContact CZ-CG2 3.75Å; F106-V110 WeakPolarHBondContact O-CG2 3.24Å; F106-V110 PolarHBondContact O-N 2.75Å; F106-L150 HydrophobicContact CE2-CD2 4.44Å; F106-L162 HydrophobicContact CB-CD2 4.4Å; F106-L162 HydrophobicContact CD2-CD2 4.32Å; F106-L177 HydrophobicContact CB-CD2 3.88Å; F106-L177 HydrophobicContact CD1-CD2 3.93Å; F106-L177 HydrophobicContact CD2-CD2 3.44Å; F106-L177 VanDerWaalsContact CD2-CD2 3.44Å; F106-L177 HydrophobicContact CE1-CD2 4.3Å; F106-L177 HydrophobicContact CE2-CD2 3.86Å; F106-L177 HydrophobicContact CG-CD2 3.46Å; F106-L177 VanDerWaalsContact CG-CD2 3.46Å; F106-L177 HydrophobicContact CZ-CD2 4.26Å; F106-T180 WeakPolarHBondContact CD1-OG1 3.22Å; F106-T180 WeakPolarHBondContact CE1-OG1 3.39Å; F106-L181 HydrophobicContact CE1-CB 4.13Å; F106-L181 HydrophobicContact CZ-CD1 4.35Å; F106-I200 HydrophobicContact CE1-CD1 4.24Å; F106-I200 HydrophobicContact CZ-CD1 3.72Å
107	R	90.4	Very high	81.4	Confident	39 Å²	39	59.6 Å²	59.6	15%	0.147	29%	0.285	C	S	.	.	H	α-helix	trans	-58.7	-46.1	173.6	-73.1	-176.8	-176.3	-108.6	10.8	111.6	E103 F109 V110 E111 E183 M184 E187	E103-R107 HydrophobicContact CG-CG 4.45Å; E103-R107 WeakPolarHBondContact O-CB 3.33Å; E103-R107 WeakPolarHBondContact O-CG 3.42Å; E103-R107 PolarHBondContact O-N 2.96Å; E103-R107 IonicContact OE1-CZ 2.82Å; E103-R107 IonicContact OE1-NE 3.68Å; E103-R107 PolarHBondContact OE1-NE 3.31Å; E103-R107 IonicContact OE1-NH2 2.99Å; E103-R107 PolarHBondContact OE1-NH2 3.28Å; R107-F109 VanDerWaalsContact C-N 3.27Å; R107-F109 PolarHBondContact O-N 2.99Å; R107-V110 PolarHBondContact O-N 3.25Å; R107-E111 WeakPolarHBondContact O-CG 3.15Å; R107-E111 PolarHBondContact O-N 3.28Å; R107-E183 IonicContact CZ-OE1 2.77Å; R107-E183 IonicContact NH2-OE1 3.37Å; R107-E183 PolarHBondContact NH2-OE1 2.91Å; R107-E183 IonicContact NH2-OE2 3.95Å; R107-E183 PolarHBondContact NH2-OE2 3Å; R107-M184 HydrophobicContact CB-SD 4.3Å; R107-M184 HydrophobicContact CG-CG 4.16Å; R107-M184 HydrophobicContact CG-SD 3.82Å; R107-E187 IonicContact CZ-OE1 3.71Å; R107-E187 VanDerWaalsContact NH1-CD 3.34Å; R107-E187 IonicContact NH1-OE1 3.25Å; R107-E187 PolarHBondContact NH1-OE1 3.34Å; R107-E187 IonicContact NH1-OE2 3.24Å; R107-E187 PolarHBondContact NH1-OE2 3.33Å; R107-E187 IonicContact NH2-OE1 2.79Å
108	R	88.2	Confident	79.4	Confident	148 Å²	148	65.8 Å²	65.8	56%	0.558	32%	0.318	S	S	*	.	H	α-helix	trans	-59.6	-39.4	175.8	-75.1	172.6	-172.4	165.7	3.1	112	K104 A105 F106 N112 F158	K104-R108 WeakPolarHBondContact O-CB 3.38Å; K104-R108 WeakPolarHBondContact O-CD 3.47Å; K104-R108 WeakPolarHBondContact O-CG 3.32Å; K104-R108 PolarHBondContact O-N 3.06Å; K104-R108 VanDerWaalsContact O-N 3.13Å; A105-R108 PolarHBondContact O-N 2.8Å; F106-R108 VanDerWaalsContact C-N 3.34Å; F106-R108 PolarHBondContact O-N 3.03Å; R108-N112 VanDerWaalsContact O-CB 3.24Å; R108-N112 WeakPolarHBondContact O-CB 3.44Å; R108-N112 PolarHBondContact O-N 3.37Å; R108-N112 PolarHBondContact O-ND2 3.25Å; R108-F158 HydrophobicContact CB-CE1 4.22Å; R108-F158 HydrophobicContact CB-CZ 4.22Å
109	F	88.7	Confident	77.2	Confident	2 Å²	2	75.4 Å²	75.4	1%	0.009	36%	0.363	C	S	.	.	H	α-helix	trans	-62.1	-53.2	176.3	170	-103.4	0	0	0	111	A105 F106 R107 E111 N112 F113 Y133 L150 H154 V155 F158	A105-F109 PolarHBondContact O-N 3.11Å; F106-F109 HydrophobicContact CD2-CD1 4.25Å; F106-F109 HydrophobicContact CE2-CD1 4.22Å; F106-F109 WeakPolarHBondContact O-CB 3.18Å; F106-F109 PolarHBondContact O-N 3.46Å; F106-F109 VanDerWaalsContact O-N 3.14Å; R107-F109 VanDerWaalsContact C-N 3.27Å; R107-F109 PolarHBondContact O-N 2.99Å; F109-E111 VanDerWaalsContact C-N 3.3Å; F109-E111 PolarHBondContact O-N 3.23Å; F109-N112 PolarHBondContact O-N 3.13Å; F109-F113 HydrophobicContact CD2-CB 4.28Å; F109-F113 HydrophobicContact CD2-CD2 4.15Å; F109-F113 HydrophobicContact CD2-CG 4.49Å; F109-F113 HydrophobicContact CE2-CB 4.15Å; F109-F113 AromaticContact CE2-CD2 3.52Å; F109-F113 HydrophobicContact CE2-CD2 3.52Å; F109-F113 HydrophobicContact CE2-CE2 4.14Å; F109-F113 AromaticContact CE2-CG 3.93Å; F109-F113 HydrophobicContact CE2-CG 3.93Å; F109-F113 HydrophobicContact CZ-CD2 4.29Å; F109-F113 HydrophobicContact CZ-CG 4.38Å; F109-F113 WeakPolarHBondContact O-CB 3.49Å; F109-F113 PolarHBondContact O-N 2.8Å; F109-Y133 AromaticContact CE1-CD2 3.89Å; F109-Y133 HydrophobicContact CE1-CD2 3.89Å; F109-Y133 HydrophobicContact CE1-CE1 4.43Å; F109-Y133 AromaticContact CE1-CE2 3.59Å; F109-Y133 HydrophobicContact CE1-CE2 3.59Å; F109-Y133 HydrophobicContact CE1-CG 4.45Å; F109-Y133 AromaticContact CE1-CZ 3.88Å; F109-Y133 HydrophobicContact CE2-CE2 4.22Å; F109-Y133 AromaticContact CZ-CD2 3.95Å; F109-Y133 HydrophobicContact CZ-CD2 3.95Å; F109-Y133 AromaticContact CZ-CE2 3.28Å; F109-Y133 HydrophobicContact CZ-CE2 3.28Å; F109-Y133 AromaticContact CZ-CZ 3.71Å; F109-L150 HydrophobicContact CE1-CD1 3.66Å; F109-L150 HydrophobicContact CZ-CD1 4.14Å; F109-H154 HydrophobicContact CE2-CB 4.25Å; F109-H154 WeakPolarHBondContact CE2-O 3.21Å; F109-H154 HydrophobicContact CZ-CB 4.03Å; F109-V155 HydrophobicContact CE1-CG2 3.95Å; F109-V155 HydrophobicContact CE2-CG2 4.21Å; F109-V155 HydrophobicContact CZ-CB 4.48Å; F109-V155 HydrophobicContact CZ-CG2 3.7Å; F109-F158 HydrophobicContact CB-CD1 3.83Å; F109-F158 HydrophobicContact CB-CE1 3.95Å; F109-F158 HydrophobicContact CD2-CB 3.68Å; F109-F158 AromaticContact CD2-CD1 3.81Å; F109-F158 HydrophobicContact CD2-CD1 3.81Å; F109-F158 AromaticContact CD2-CG 3.8Å; F109-F158 HydrophobicContact CD2-CG 3.8Å; F109-F158 HydrophobicContact CE2-CB 4.1Å; F109-F158 HydrophobicContact CG-CD1 4.33Å
110	V	85.8	Confident	74.9	Confident	7 Å²	7	78.9 Å²	78.9	4%	0.042	39%	0.389	C	S	.	.	H	α-helix	trans	-62.1	-36	-177.8	174.6	0	0	0	0	112.4	F106 R107 L137 M184	F106-V110 HydrophobicContact CD1-CG2 4.24Å; F106-V110 HydrophobicContact CD2-CG2 4.47Å; F106-V110 HydrophobicContact CE1-CG2 3.83Å; F106-V110 HydrophobicContact CE2-CG2 4.08Å; F106-V110 HydrophobicContact CZ-CG2 3.75Å; F106-V110 WeakPolarHBondContact O-CG2 3.24Å; F106-V110 PolarHBondContact O-N 2.75Å; R107-V110 PolarHBondContact O-N 3.25Å; V110-L137 HydrophobicContact CG1-CD1 4.03Å; V110-M184 HydrophobicContact CB-CE 3.75Å; V110-M184 HydrophobicContact CB-SD 4.02Å; V110-M184 HydrophobicContact CG1-CE 3.54Å; V110-M184 HydrophobicContact CG1-SD 4.08Å; V110-M184 HydrophobicContact CG2-SD 4.3Å
111	E	84.4	Confident	72.5	Confident	125 Å²	125	84.9 Å²	84.9	58%	0.584	42%	0.419	S	S	*	.	H	α-helix	trans	-78.5	-40.3	-180	-70.9	-178	162.3	0	0	114.2	R107 F109 M184	R107-E111 WeakPolarHBondContact O-CG 3.15Å; R107-E111 PolarHBondContact O-N 3.28Å; F109-E111 VanDerWaalsContact C-N 3.3Å; F109-E111 PolarHBondContact O-N 3.23Å; E111-M184 HydrophobicContact CG-CE 4.04Å
112	N	83.4	Confident	69.9	Low	95 Å²	95	85.7 Å²	85.7	51%	0.508	44%	0.436	S	S	.	.	H	α-helix	trans	-100.6	-14.6	-168.6	-61.7	-58.3	0	0	0	114.1	R108 F109 R114 F158	R108-N112 VanDerWaalsContact O-CB 3.24Å; R108-N112 WeakPolarHBondContact O-CB 3.44Å; R108-N112 PolarHBondContact O-N 3.37Å; R108-N112 PolarHBondContact O-ND2 3.25Å; F109-N112 PolarHBondContact O-N 3.13Å; N112-R114 PolarHBondContact O-N 2.9Å; N112-F158 HydrophobicContact CB-CE2 4.08Å; N112-F158 HydrophobicContact CB-CZ 4.29Å
113	F	80.1	Confident	67.4	Low	13 Å²	13	94 Å²	94	6%	0.057	47%	0.474	C	S	.	.			trans	-61.9	125	-175.6	-175.2	-96.1	0	0	0	111.8	F109 Y133 H154	F109-F113 HydrophobicContact CD2-CB 4.28Å; F109-F113 HydrophobicContact CD2-CD2 4.15Å; F109-F113 HydrophobicContact CD2-CG 4.49Å; F109-F113 HydrophobicContact CE2-CB 4.15Å; F109-F113 AromaticContact CE2-CD2 3.52Å; F109-F113 HydrophobicContact CE2-CD2 3.52Å; F109-F113 HydrophobicContact CE2-CE2 4.14Å; F109-F113 AromaticContact CE2-CG 3.93Å; F109-F113 HydrophobicContact CE2-CG 3.93Å; F109-F113 HydrophobicContact CZ-CD2 4.29Å; F109-F113 HydrophobicContact CZ-CG 4.38Å; F109-F113 WeakPolarHBondContact O-CB 3.49Å; F109-F113 PolarHBondContact O-N 2.8Å; F113-Y133 HydrophobicContact CB-CD2 4.11Å; F113-Y133 HydrophobicContact CB-CE2 4.45Å; F113-Y133 AromaticContact CD1-CD2 3.71Å; F113-Y133 HydrophobicContact CD1-CD2 3.71Å; F113-Y133 AromaticContact CD1-CE2 3.54Å; F113-Y133 HydrophobicContact CD1-CE2 3.54Å; F113-Y133 HydrophobicContact CE1-CD2 4.48Å; F113-Y133 AromaticContact CE1-CE2 3.93Å; F113-Y133 HydrophobicContact CE1-CE2 3.93Å; F113-Y133 HydrophobicContact CG-CD2 4.09Å; F113-Y133 AromaticContact CG-CE2 3.98Å; F113-Y133 HydrophobicContact CG-CE2 3.98Å; F113-H154 HydrophobicContact CD2-CB 4.4Å; F113-H154 HydrophobicContact CE1-CB 4.08Å; F113-H154 AromaticContact CE1-CG 3.81Å; F113-H154 AromaticContact CE1-ND1 3.69Å; F113-H154 HydrophobicContact CE2-CB 3.59Å; F113-H154 HydrophobicContact CZ-CB 3.41Å; F113-H154 VanDerWaalsContact CZ-CB 3.41Å; F113-H154 AromaticContact CZ-CD2 3.67Å; F113-H154 AromaticContact CZ-CG 3.3Å; F113-H154 AromaticContact CZ-ND1 3.69Å
114	R	71.6	Confident	64.6	Low	220 Å²	220	98 Å²	98	83%	0.83	50%	0.504	S	S	*	.			trans	-129.7	128.5	169.2	-63.3	-177.2	-178.2	-173.9	0.8	106.9	N112 S116	N112-R114 PolarHBondContact O-N 2.9Å; R114-S116 PolarHBondContact O-N 3.28Å
115	S	63.1	Low	61.9	Low	33 Å²	33	99.1 Å²	99.1	23%	0.231	52%	0.522	C	S	.	.			trans	-61.1	131.2	174	45.2	0	0	0	0	109.8	E117	S115-E117 VanDerWaalsContact C-N 3.25Å; S115-E117 PolarHBondContact O-N 3.35Å
116	S	54.7	Low	59.2	Low	112 Å²	112	105.8 Å²	105.8	78%	0.783	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-83	12.3	-174.7	52.2	0	0	0	0	114.6	R114 D118	R114-S116 PolarHBondContact O-N 3.28Å; S116-D118 PolarHBondContact O-N 3.44Å
117	E	49.9	Very low	56.5	Low	168 Å²	168	114.7 Å²	114.7	79%	0.785	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-80.2	-0.4	-177.3	-64	-174.3	162.2	0	0	113.8	S115	S115-E117 VanDerWaalsContact C-N 3.25Å; S115-E117 PolarHBondContact O-N 3.35Å
118	D	41.5	Very low	53.7	Low	137 Å²	137	116 Å²	116	73%	0.733	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-98.5	8	-170.2	-70.6	-26.1	0	0	0	115.7	S116	S116-D118 PolarHBondContact O-N 3.44Å
119	E	41.5	Very low	51	Low	202 Å²	202	111.8 Å²	111.8	94%	0.944	62%	0.623	S	S	*	*	S	Bend	trans	-89.1	-3.6	179.8	-73.8	-157	161.8	0	0	115.1
120	S	34.7	Very low	48.8	Very low	89 Å²	89	121.6 Å²	121.6	62%	0.622	66%	0.66	S	S	*	*	S	Bend	trans	-121.8	116.5	173.2	50.2	0	0	0	0	111.7
121	D	35.3	Very low	47.3	Very low	149 Å²	149	123.5 Å²	123.5	80%	0.797	68%	0.677	S	S	*	*			trans	90.3	87.4	160.1	-54.9	-25.6	0	0	0	119.8	E123	D121-E123 PolarHBondContact O-N 2.85Å
122	S	31.9	Very low	46.6	Very low	116 Å²	116	119.3 Å²	119.3	81%	0.811	66%	0.662	S	S	*	*				17.2	89	128.1	-32.8	0	0	0	0	118.8
123	E	35	Very low	46.5	Very low	178 Å²	178	115.3 Å²	115.3	83%	0.832	64%	0.639	S	S	*	*				169.3	137.4	128.4	-93.8	-179	-169.1	0	0	110	D121 S125	D121-E123 PolarHBondContact O-N 2.85Å; E123-S125 PolarHBondContact O-N 2.94Å
124	P	29.7	Very low	46.6	Very low	127 Å²	127	120.6 Å²	120.6	83%	0.825	66%	0.662	S	S	*	*			trans	-81	84.3	-178.6	33.9	-30.6	0	0	0	109.2	I126	P124-I126 PolarHBondContact O-N 3.46Å
125	S	31.6	Very low	47.2	Very low	103 Å²	103	114 Å²	114	72%	0.72	64%	0.641	S	S	*	*			trans	-73.9	112.5	168.2	42.3	0	0	0	0	109.6	E123 E127	E123-S125 PolarHBondContact O-N 2.94Å; S125-E127 PolarHBondContact O-N 3.23Å
126	I	33.2	Very low	48.1	Very low	154 Å²	154	115.2 Å²	115.2	79%	0.79	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.6	126	171.2	-62.2	160.5	0	0	0	106.6	P124	P124-I126 PolarHBondContact O-N 3.46Å
127	E	32	Very low	49.5	Very low	192 Å²	192	110.1 Å²	110.1	90%	0.897	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	100.6	11.9	176.1	-60.4	164.7	-174.1	0	0	119.1	S125	S125-E127 PolarHBondContact O-N 3.23Å
128	G	31.4	Very low	51.2	Low	67 Å²	67	104 Å²	104	69%	0.691	58%	0.581	S	S	*	*			trans	-102.4	86.9	162.6	0	0	0	0	0	112.2	R130	G128-R130 PolarHBondContact O-N 3.39Å; G128-R130 VanDerWaalsContact O-N 3.13Å
129	G	31.9	Very low	53.2	Low	58 Å²	58	102.9 Å²	102.9	60%	0.598	57%	0.572	S	S	*	*			trans	-65.9	106.6	-168.5	0	0	0	0	0	115.4	A131	G129-A131 PolarHBondContact O-N 2.96Å
130	R	42.4	Very low	55.2	Low	208 Å²	208	93.8 Å²	93.8	79%	0.785	53%	0.53	S	S	*	.			trans	-14.6	100	156.1	-58.5	170.2	-177.2	165.7	1.1	114	G128 S132 Q135	G128-R130 PolarHBondContact O-N 3.39Å; G128-R130 VanDerWaalsContact O-N 3.13Å; R130-S132 PolarHBondContact O-N 3.44Å; R130-Q135 PolarHBondContact O-OE1 3.48Å
131	A	54.3	Low	57.6	Low	47 Å²	47	93 Å²	93	39%	0.388	51%	0.514	S	S	.	.			trans	-81.1	61.6	-178.2	0	0	0	0	0	112.7	G129	G129-A131 PolarHBondContact O-N 2.96Å
132	S	69.2	Low	60	Low	38 Å²	38	92.9 Å²	92.9	27%	0.266	51%	0.508	S	S	.	.			trans	-80.6	139.4	165.3	66.6	0	0	0	0	110	R130 K134 Q135 K136	R130-S132 PolarHBondContact O-N 3.44Å; S132-K134 PolarHBondContact O-N 3.48Å; S132-Q135 WeakPolarHBondContact O-CA 3.5Å; S132-Q135 WeakPolarHBondContact O-CB 3.38Å; S132-Q135 PolarHBondContact O-N 2.9Å; S132-Q135 VanDerWaalsContact OG-CB 3.27Å; S132-Q135 WeakPolarHBondContact OG-CB 3.45Å; S132-Q135 PolarHBondContact OG-N 3.24Å; S132-Q135 VanDerWaalsContact OG-N 3.16Å; S132-K136 PolarHBondContact O-N 3.44Å
133	Y	82.4	Confident	62.5	Low	10 Å²	10	90.6 Å²	90.6	4%	0.039	49%	0.489	C	S	.	.	H	α-helix	trans	-60.7	-28.2	174.7	-73.7	-84.1	0	0	0	112.1	F109 F113 K136 L137 L150 H154	F109-Y133 AromaticContact CE1-CD2 3.89Å; F109-Y133 HydrophobicContact CE1-CD2 3.89Å; F109-Y133 HydrophobicContact CE1-CE1 4.43Å; F109-Y133 AromaticContact CE1-CE2 3.59Å; F109-Y133 HydrophobicContact CE1-CE2 3.59Å; F109-Y133 HydrophobicContact CE1-CG 4.45Å; F109-Y133 AromaticContact CE1-CZ 3.88Å; F109-Y133 HydrophobicContact CE2-CE2 4.22Å; F109-Y133 AromaticContact CZ-CD2 3.95Å; F109-Y133 HydrophobicContact CZ-CD2 3.95Å; F109-Y133 AromaticContact CZ-CE2 3.28Å; F109-Y133 HydrophobicContact CZ-CE2 3.28Å; F109-Y133 AromaticContact CZ-CZ 3.71Å; F113-Y133 HydrophobicContact CB-CD2 4.11Å; F113-Y133 HydrophobicContact CB-CE2 4.45Å; F113-Y133 AromaticContact CD1-CD2 3.71Å; F113-Y133 HydrophobicContact CD1-CD2 3.71Å; F113-Y133 AromaticContact CD1-CE2 3.54Å; F113-Y133 HydrophobicContact CD1-CE2 3.54Å; F113-Y133 HydrophobicContact CE1-CD2 4.48Å; F113-Y133 AromaticContact CE1-CE2 3.93Å; F113-Y133 HydrophobicContact CE1-CE2 3.93Å; F113-Y133 HydrophobicContact CG-CD2 4.09Å; F113-Y133 AromaticContact CG-CE2 3.98Å; F113-Y133 HydrophobicContact CG-CE2 3.98Å; Y133-K136 HydrophobicContact CD1-CD 4.24Å; Y133-K136 HydrophobicContact CE1-CD 4.5Å; Y133-K136 WeakPolarHBondContact O-CB 3.43Å; Y133-K136 PolarHBondContact O-N 3.48Å; Y133-L137 WeakPolarHBondContact O-CG 3.21Å; Y133-L137 PolarHBondContact O-N 2.66Å; Y133-L150 HydrophobicContact CD1-CD1 4.45Å; Y133-L150 HydrophobicContact CE1-CD1 3.56Å; Y133-H154 HydrophobicContact CE2-CB 4.32Å; Y133-H154 AromaticContact CE2-ND1 3.99Å; Y133-H154 AromaticContact CZ-ND1 3.81Å; Y133-H154 WeakPolarHBondContact OH-CB 2.83Å; Y133-H154 PolarHBondContact OH-ND1 3.48Å
134	K	82.3	Confident	64.6	Low	125 Å²	125	88.9 Å²	88.9	54%	0.543	48%	0.481	S	S	.	.	H	α-helix	trans	-61.2	-41.2	170	-171.3	173.1	-176.7	169.7	0	112.7	S132 L137 C138	S132-K134 PolarHBondContact O-N 3.48Å; K134-L137 PolarHBondContact O-N 3.36Å; K134-C138 PolarHBondContact O-N 2.86Å; K134-C138 PolarHBondContact O-SG 3.22Å
135	Q	82.9	Confident	67.1	Low	81 Å²	81	88.3 Å²	88.3	38%	0.379	47%	0.467	S	S	.	.	H	α-helix	trans	-68.2	-38.2	174.4	-179	168.6	-24.7	0	0	111.5	R130 S132 L137 C138 E139	R130-Q135 PolarHBondContact O-OE1 3.48Å; S132-Q135 WeakPolarHBondContact O-CA 3.5Å; S132-Q135 WeakPolarHBondContact O-CB 3.38Å; S132-Q135 PolarHBondContact O-N 2.9Å; S132-Q135 VanDerWaalsContact OG-CB 3.27Å; S132-Q135 WeakPolarHBondContact OG-CB 3.45Å; S132-Q135 PolarHBondContact OG-N 3.24Å; S132-Q135 VanDerWaalsContact OG-N 3.16Å; Q135-L137 VanDerWaalsContact C-N 3.32Å; Q135-L137 PolarHBondContact O-N 3.22Å; Q135-C138 CarbonylContact O-C 3.6Å; Q135-C138 WeakPolarHBondContact O-CB 3.35Å; Q135-C138 PolarHBondContact O-N 2.84Å; Q135-C138 VanDerWaalsContact O-N 3.13Å; Q135-E139 PolarHBondContact O-N 3.46Å
136	K	82.5	Confident	69.5	Low	59 Å²	59	85.2 Å²	85.2	26%	0.257	44%	0.444	S	S	.	.	H	α-helix	trans	-59.5	-41.3	171.8	-71.6	-172.6	171.3	-174.8	0	112	S132 Y133 C138 E139 V140 E149	S132-K136 PolarHBondContact O-N 3.44Å; Y133-K136 HydrophobicContact CD1-CD 4.24Å; Y133-K136 HydrophobicContact CE1-CD 4.5Å; Y133-K136 WeakPolarHBondContact O-CB 3.43Å; Y133-K136 PolarHBondContact O-N 3.48Å; K136-C138 VanDerWaalsContact C-N 3.33Å; K136-C138 PolarHBondContact O-N 2.89Å; K136-E139 WeakPolarHBondContact O-CB 3.34Å; K136-E139 PolarHBondContact O-N 2.92Å; K136-V140 VanDerWaalsContact O-CB 3.3Å; K136-V140 WeakPolarHBondContact O-CB 3.25Å; K136-V140 WeakPolarHBondContact O-CG2 3.21Å; K136-V140 PolarHBondContact O-N 3.35Å; K136-E149 PolarHBondContact NZ-O 2.89Å
137	L	84.7	Confident	72	Confident	5 Å²	5	79.3 Å²	79.3	3%	0.026	42%	0.415	C	S	.	.	H	α-helix	trans	-62.7	-39.1	173.8	-71.7	170.8	0	0	0	112.3	V110 Y133 K134 Q135 Y141 I148 L181 F185 I188 L198	V110-L137 HydrophobicContact CG1-CD1 4.03Å; Y133-L137 WeakPolarHBondContact O-CG 3.21Å; Y133-L137 PolarHBondContact O-N 2.66Å; K134-L137 PolarHBondContact O-N 3.36Å; Q135-L137 VanDerWaalsContact C-N 3.32Å; Q135-L137 PolarHBondContact O-N 3.22Å; L137-Y141 PolarHBondContact O-N 3.15Å; L137-I148 HydrophobicContact CD2-CD1 3.56Å; L137-L181 HydrophobicContact CD2-CD1 4.42Å; L137-L181 HydrophobicContact CD2-CD2 4.03Å; L137-L181 HydrophobicContact CD2-CG 4.22Å; L137-F185 HydrophobicContact CD2-CD2 4.28Å; L137-I188 HydrophobicContact CD1-CD1 4.13Å; L137-L198 HydrophobicContact CD2-CD1 4.16Å
138	C	84.3	Confident	74.6	Confident	39 Å²	39	70.6 Å²	70.6	26%	0.264	38%	0.375	S	S	.	.	H	α-helix	trans	-63.4	-45	172.3	-65.8	0	0	0	0	111.3	K134 Q135 K136 Y141 H142 Y189	K134-C138 PolarHBondContact O-N 2.86Å; K134-C138 PolarHBondContact O-SG 3.22Å; Q135-C138 CarbonylContact O-C 3.6Å; Q135-C138 WeakPolarHBondContact O-CB 3.35Å; Q135-C138 PolarHBondContact O-N 2.84Å; Q135-C138 VanDerWaalsContact O-N 3.13Å; K136-C138 VanDerWaalsContact C-N 3.33Å; K136-C138 PolarHBondContact O-N 2.89Å; C138-Y141 WeakPolarHBondContact O-CB 3.31Å; C138-Y141 PolarHBondContact O-N 2.91Å; C138-H142 PolarHBondContact O-N 3.45Å; C138-H142 PolarHBondContact O-ND1 2.95Å; C138-Y189 PolarHBondContact SG-OH 2.71Å
139	E	84.4	Confident	77.3	Confident	114 Å²	114	71.5 Å²	71.5	53%	0.533	36%	0.361	S	S	.	.	H	α-helix	trans	-60.1	-49.2	178.4	-177.2	174.1	-168.6	0	0	110.9	Q135 K136 Y141 H142 T143	Q135-E139 PolarHBondContact O-N 3.46Å; K136-E139 WeakPolarHBondContact O-CB 3.34Å; K136-E139 PolarHBondContact O-N 2.92Å; E139-Y141 PolarHBondContact O-N 3.15Å; E139-H142 CarbonylContact O-C 3.51Å; E139-H142 WeakPolarHBondContact O-CA 3.08Å; E139-H142 PolarHBondContact O-N 3.27Å; E139-T143 HydrophobicContact CG-CG2 4.04Å; E139-T143 WeakPolarHBondContact O-CG2 3.29Å; E139-T143 PolarHBondContact O-N 2.98Å; E139-T143 PolarHBondContact O-OG1 3.38Å; E139-T143 VanDerWaalsContact O-OG1 3.1Å
140	V	83.6	Confident	79.9	Confident	10 Å²	10	69 Å²	69	6%	0.061	33%	0.334	C	S	.	.	H	α-helix	trans	-52.3	-41.2	173.3	160.5	0	0	0	0	112.5	K136 H142 T143 Q144 E145 I148 F185 L198	K136-V140 VanDerWaalsContact O-CB 3.3Å; K136-V140 WeakPolarHBondContact O-CB 3.25Å; K136-V140 WeakPolarHBondContact O-CG2 3.21Å; K136-V140 PolarHBondContact O-N 3.35Å; V140-H142 VanDerWaalsContact C-N 3.32Å; V140-H142 PolarHBondContact O-N 3.27Å; V140-T143 WeakPolarHBondContact CA-OG1 3.16Å; V140-Q144 VanDerWaalsContact O-CA 3.27Å; V140-Q144 WeakPolarHBondContact O-CA 3.44Å; V140-Q144 PolarHBondContact O-N 2.83Å; V140-E145 WeakPolarHBondContact CG1-O 2.75Å; V140-I148 HydrophobicContact CG2-CD1 4.11Å; V140-I148 HydrophobicContact CG2-CG1 3.79Å; V140-F185 HydrophobicContact CG1-CE2 4.44Å; V140-L198 HydrophobicContact CG1-CD1 4.16Å; V140-L198 HydrophobicContact CG1-CD2 3.43Å; V140-L198 VanDerWaalsContact CG1-CD2 3.43Å; V140-L198 HydrophobicContact CG1-CG 4.46Å
141	Y	84	Confident	82.1	Confident	74 Å²	74	60 Å²	60	29%	0.29	30%	0.301	S	S	.	.	H	α-helix	trans	-62.5	-38.1	175.6	179	-98.8	0	0	0	112.6	L137 C138 E139 F185 Y189	L137-Y141 PolarHBondContact O-N 3.15Å; C138-Y141 WeakPolarHBondContact O-CB 3.31Å; C138-Y141 PolarHBondContact O-N 2.91Å; E139-Y141 PolarHBondContact O-N 3.15Å; Y141-F185 HydrophobicContact CD2-CE2 4.33Å; Y141-F185 AromaticContact CD2-CZ 3.91Å; Y141-F185 HydrophobicContact CD2-CZ 3.91Å; Y141-Y189 HydrophobicContact CD1-CD1 4.45Å; Y141-Y189 HydrophobicContact CD1-CE1 4.15Å; Y141-Y189 HydrophobicContact CD2-CD1 4.05Å; Y141-Y189 AromaticContact CD2-CD2 3.91Å; Y141-Y189 HydrophobicContact CD2-CD2 3.91Å; Y141-Y189 HydrophobicContact CD2-CE1 4.44Å; Y141-Y189 HydrophobicContact CD2-CE2 4.29Å; Y141-Y189 AromaticContact CD2-CG 3.77Å; Y141-Y189 HydrophobicContact CD2-CG 3.77Å; Y141-Y189 HydrophobicContact CE1-CD1 4.37Å; Y141-Y189 HydrophobicContact CE1-CE1 4.29Å; Y141-Y189 AromaticContact CE2-CD1 3.97Å; Y141-Y189 HydrophobicContact CE2-CD1 3.97Å; Y141-Y189 AromaticContact CE2-CG 3.95Å; Y141-Y189 HydrophobicContact CE2-CG 3.95Å; Y141-Y189 HydrophobicContact CG-CD1 4.3Å; Y141-Y189 HydrophobicContact CG-CD2 4.16Å; Y141-Y189 HydrophobicContact CG-CE1 4.22Å; Y141-Y189 HydrophobicContact CG-CE2 4.06Å; Y141-Y189 HydrophobicContact CG-CG 4.27Å
142	H	85.7	Confident	83.6	Confident	146 Å²	146	57.8 Å²	57.8	68%	0.676	28%	0.283	S	S	*	.	H	α-helix	trans	-80.6	-40.8	179.7	-66.3	84.8	0	0	0	112.6	C138 E139 V140 Q144	C138-H142 PolarHBondContact O-N 3.45Å; C138-H142 PolarHBondContact O-ND1 2.95Å; E139-H142 CarbonylContact O-C 3.51Å; E139-H142 WeakPolarHBondContact O-CA 3.08Å; E139-H142 PolarHBondContact O-N 3.27Å; V140-H142 VanDerWaalsContact C-N 3.32Å; V140-H142 PolarHBondContact O-N 3.27Å; H142-Q144 VanDerWaalsContact C-N 3.32Å
143	T	84.8	Confident	84.4	Confident	67 Å²	67	61 Å²	61	41%	0.411	29%	0.294	S	S	.	.	H	α-helix	trans	-77.7	-19.3	-180	60.5	0	0	0	0	112.4	E139 V140 E145	E139-T143 HydrophobicContact CG-CG2 4.04Å; E139-T143 WeakPolarHBondContact O-CG2 3.29Å; E139-T143 PolarHBondContact O-N 2.98Å; E139-T143 PolarHBondContact O-OG1 3.38Å; E139-T143 VanDerWaalsContact O-OG1 3.1Å; V140-T143 WeakPolarHBondContact CA-OG1 3.16Å; T143-E145 PolarHBondContact O-N 3.16Å; T143-E145 PolarHBondContact OG1-N 3.39Å
144	Q	80.3	Confident	84.7	Confident	142 Å²	142	63 Å²	63	66%	0.664	30%	0.303	S	S	*	.			trans	57.7	26.2	-171.4	-57.4	-174.2	-20.5	0	0	113.2	V140 H142 I196	V140-Q144 VanDerWaalsContact O-CA 3.27Å; V140-Q144 WeakPolarHBondContact O-CA 3.44Å; V140-Q144 PolarHBondContact O-N 2.83Å; H142-Q144 VanDerWaalsContact C-N 3.32Å; Q144-I196 HydrophobicContact CB-CD1 4.27Å; Q144-I196 HydrophobicContact CG-CD1 4.31Å
145	E	81.6	Confident	85	Confident	115 Å²	115	57 Å²	57	54%	0.537	28%	0.278	S	S	.	.			trans	-71	142.9	172.8	-72.2	-177.3	170.1	0	0	110.4	V140 T143	V140-E145 WeakPolarHBondContact CG1-O 2.75Å; T143-E145 PolarHBondContact O-N 3.16Å; T143-E145 PolarHBondContact OG1-N 3.39Å
146	T	82.2	Confident	85.2	Confident	38 Å²	38	56.3 Å²	56.3	23%	0.233	27%	0.273	C	S	.	.			trans	-98.4	-3.4	-176.8	46.5	0	0	0	0	112.4	I196 L198 Q199	T146-I196 HydrophobicContact CG2-CG2 3.92Å; T146-L198 CarbonylContact O-C 3.55Å; T146-L198 WeakPolarHBondContact O-CA 3.18Å; T146-Q199 PolarHBondContact O-N 3.01Å
147	V	85.1	Confident	85.4	Confident	31 Å²	31	57.6 Å²	57.6	19%	0.188	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	128	-169.1	175.2	0	0	0	0	108.7	Q199 K201	V147-Q199 WeakPolarHBondContact CA-O 3.46Å; V147-K201 HydrophobicContact CG1-CB 4.34Å; V147-K201 HydrophobicContact CG1-CD 3.41Å; V147-K201 VanDerWaalsContact CG1-CD 3.41Å; V147-K201 HydrophobicContact CG1-CG 3.82Å
148	I	87	Confident	85.5	Confident	8 Å²	8	61.6 Å²	61.6	4%	0.041	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	119.9	175.5	-65.5	178.2	0	0	0	108.7	L137 V140 L181 L198 Q199 I200 K201	L137-I148 HydrophobicContact CD2-CD1 3.56Å; V140-I148 HydrophobicContact CG2-CD1 4.11Å; V140-I148 HydrophobicContact CG2-CG1 3.79Å; I148-L181 HydrophobicContact CD1-CD1 3.8Å; I148-L181 HydrophobicContact CD1-CD2 3.65Å; I148-L181 HydrophobicContact CD1-CG 4.32Å; I148-L181 HydrophobicContact CG2-CD1 4.49Å; I148-L198 HydrophobicContact CD1-CB 4.43Å; I148-L198 HydrophobicContact CD1-CD1 4.06Å; I148-Q199 PolarHBondContact N-O 2.91Å; I148-I200 WeakPolarHBondContact O-CA 3.45Å; I148-K201 PolarHBondContact O-N 3.31Å
149	E	87	Confident	85.6	Confident	87 Å²	87	61.8 Å²	61.8	41%	0.407	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	117.7	176.6	-58.6	-176.7	165.2	0	0	109.9	K136 F203 H360	K136-E149 PolarHBondContact NZ-O 2.89Å; E149-F203 HydrophobicContact CB-CD1 3.93Å; E149-F203 HydrophobicContact CB-CE1 3.68Å; E149-H360 IonicContact OE1-CE1 3.1Å; E149-H360 PolarHBondContact OE1-CE1 2.85Å
150	L	87.9	Confident	85.9	Confident	5 Å²	5	61.7 Å²	61.7	3%	0.026	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	110.8	-179.9	176.7	68.4	0	0	0	109.6	F106 F109 Y133 L152 V155 I200 K201 P202 F203	F106-L150 HydrophobicContact CE2-CD2 4.44Å; F109-L150 HydrophobicContact CE1-CD1 3.66Å; F109-L150 HydrophobicContact CZ-CD1 4.14Å; Y133-L150 HydrophobicContact CD1-CD1 4.45Å; Y133-L150 HydrophobicContact CE1-CD1 3.56Å; L150-L152 PolarHBondContact O-N 3.29Å; L150-V155 HydrophobicContact CD1-CG2 3.84Å; L150-V155 HydrophobicContact CD2-CG2 4.09Å; L150-V155 HydrophobicContact CG-CG2 4.06Å; L150-I200 HydrophobicContact CB-CG2 3.64Å; L150-I200 HydrophobicContact CD2-CG2 3.75Å; L150-I200 HydrophobicContact CG-CG2 4.34Å; L150-K201 PolarHBondContact N-O 3.19Å; L150-P202 CarbonylContact O-C 3.57Å; L150-P202 VanDerWaalsContact O-CA 3.25Å; L150-P202 WeakPolarHBondContact O-CA 3.35Å; L150-F203 VanDerWaalsContact C-CD1 3.5Å; L150-F203 VanDerWaalsContact C-CE1 3.47Å; L150-F203 VanDerWaalsContact O-CD1 3.3Å; L150-F203 WeakPolarHBondContact O-CD1 3.22Å; L150-F203 PolarHBondContact O-N 3.25Å
151	D	87.7	Confident	86.3	Confident	19 Å²	19	65.4 Å²	65.4	10%	0.102	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	123.8	170.7	-161.6	-34.2	0	0	0	109.8	Q153 H154 F203 N204	D151-Q153 VanDerWaalsContact C-N 3.28Å; D151-Q153 PolarHBondContact O-N 2.7Å; D151-Q153 WeakPolarHBondContact OD1-CB 3.49Å; D151-Q153 PolarHBondContact OD1-N 2.57Å; D151-H154 PolarHBondContact O-N 2.79Å; D151-F203 HydrophobicContact CB-CE1 3.94Å; D151-F203 HydrophobicContact CB-CE2 4Å; D151-F203 HydrophobicContact CB-CZ 3.55Å; D151-F203 VanDerWaalsContact N-CE1 3.31Å; D151-N204 PolarHBondContact OD1-ND2 3.17Å; D151-N204 PolarHBondContact OD2-ND2 2.99Å
152	L	86.9	Confident	86.5	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-72.8	-20.9	178.6	-66.1	173.3	0	0	0	113	L150 H154 V155 K156 Y163 I166 P202 F203 A205 L222	L150-L152 PolarHBondContact O-N 3.29Å; L152-H154 VanDerWaalsContact C-N 3.31Å; L152-V155 PolarHBondContact O-N 3.31Å; L152-K156 WeakPolarHBondContact O-CB 3.24Å; L152-K156 PolarHBondContact O-N 3.26Å; L152-Y163 HydrophobicContact CB-CD2 4.11Å; L152-Y163 HydrophobicContact CB-CE2 3.83Å; L152-I166 HydrophobicContact CD2-CD1 4.37Å; L152-I166 HydrophobicContact CD2-CG2 3.89Å; L152-P202 HydrophobicContact CD1-CB 4.19Å; L152-P202 HydrophobicContact CD2-CB 3.76Å; L152-P202 HydrophobicContact CG-CB 3.97Å; L152-F203 WeakPolarHBondContact CB-O 3.03Å; L152-F203 WeakPolarHBondContact CG-O 3.4Å; L152-F203 PolarHBondContact N-O 3.13Å; L152-A205 HydrophobicContact CD1-CB 4.05Å; L152-L222 HydrophobicContact CD1-CD2 3.54Å
153	Q	86.1	Confident	86.8	Confident	106 Å²	106	55.7 Å²	55.7	50%	0.495	28%	0.284	S	S	.	.	H	α-helix	trans	-65.5	-38.2	174.4	-64.8	-171.2	-2.2	0	0	111.4	D151 V155 K156 S157 N204	D151-Q153 VanDerWaalsContact C-N 3.28Å; D151-Q153 PolarHBondContact O-N 2.7Å; D151-Q153 WeakPolarHBondContact OD1-CB 3.49Å; D151-Q153 PolarHBondContact OD1-N 2.57Å; Q153-V155 VanDerWaalsContact C-N 3.34Å; Q153-K156 PolarHBondContact O-N 3.37Å; Q153-S157 PolarHBondContact O-N 3.39Å; Q153-N204 WeakPolarHBondContact CG-ND2 3.33Å; Q153-N204 PolarHBondContact NE2-ND2 2.81Å; Q153-N204 PolarHBondContact NE2-OD1 3.31Å
154	H	87.7	Confident	87.1	Confident	51 Å²	51	56.4 Å²	56.4	24%	0.236	28%	0.283	C	S	.	.	H	α-helix	trans	-63.8	-41.2	174	-64.8	175	0	0	0	111.9	F109 F113 Y133 D151 L152 K156 S157 F158	F109-H154 HydrophobicContact CE2-CB 4.25Å; F109-H154 WeakPolarHBondContact CE2-O 3.21Å; F109-H154 HydrophobicContact CZ-CB 4.03Å; F113-H154 HydrophobicContact CD2-CB 4.4Å; F113-H154 HydrophobicContact CE1-CB 4.08Å; F113-H154 AromaticContact CE1-CG 3.81Å; F113-H154 AromaticContact CE1-ND1 3.69Å; F113-H154 HydrophobicContact CE2-CB 3.59Å; F113-H154 HydrophobicContact CZ-CB 3.41Å; F113-H154 VanDerWaalsContact CZ-CB 3.41Å; F113-H154 AromaticContact CZ-CD2 3.67Å; F113-H154 AromaticContact CZ-CG 3.3Å; F113-H154 AromaticContact CZ-ND1 3.69Å; Y133-H154 HydrophobicContact CE2-CB 4.32Å; Y133-H154 AromaticContact CE2-ND1 3.99Å; Y133-H154 AromaticContact CZ-ND1 3.81Å; Y133-H154 WeakPolarHBondContact OH-CB 2.83Å; Y133-H154 PolarHBondContact OH-ND1 3.48Å; D151-H154 PolarHBondContact O-N 2.79Å; L152-H154 VanDerWaalsContact C-N 3.31Å; H154-K156 VanDerWaalsContact C-N 3.34Å; H154-S157 PolarHBondContact O-N 3.28Å; H154-S157 PolarHBondContact O-OG 3.37Å; H154-F158 PolarHBondContact O-N 3.11Å
155	V	87.9	Confident	87.6	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.006	26%	0.26	C	S	.	.	H	α-helix	trans	-63.2	-45.9	176	-178.6	0	0	0	0	109.7	F109 L150 L152 Q153 S157 F158 D159 L162 I166	F109-V155 HydrophobicContact CE1-CG2 3.95Å; F109-V155 HydrophobicContact CE2-CG2 4.21Å; F109-V155 HydrophobicContact CZ-CB 4.48Å; F109-V155 HydrophobicContact CZ-CG2 3.7Å; L150-V155 HydrophobicContact CD1-CG2 3.84Å; L150-V155 HydrophobicContact CD2-CG2 4.09Å; L150-V155 HydrophobicContact CG-CG2 4.06Å; L152-V155 PolarHBondContact O-N 3.31Å; Q153-V155 VanDerWaalsContact C-N 3.34Å; V155-S157 VanDerWaalsContact C-N 3.34Å; V155-S157 PolarHBondContact O-N 2.61Å; V155-F158 PolarHBondContact O-N 3.47Å; V155-D159 CarbonylContact O-C 3.47Å; V155-D159 PolarHBondContact O-N 2.9Å; V155-D159 VanDerWaalsContact O-O 3.08Å; V155-L162 HydrophobicContact CG1-CB 4.26Å; V155-L162 HydrophobicContact CG1-CD2 3.95Å; V155-L162 HydrophobicContact CG1-CG 3.97Å; V155-I166 HydrophobicContact CG1-CD1 4.11Å
156	K	88	Confident	88	Confident	66 Å²	66	46.1 Å²	46.1	29%	0.287	24%	0.235	S	C	.	.	H	α-helix	trans	-60	-40.6	178.9	-173.5	178.6	176.2	-179.7	0	112.7	L152 Q153 H154 F158 Y163 E206	L152-K156 WeakPolarHBondContact O-CB 3.24Å; L152-K156 PolarHBondContact O-N 3.26Å; Q153-K156 PolarHBondContact O-N 3.37Å; H154-K156 VanDerWaalsContact C-N 3.34Å; K156-F158 VanDerWaalsContact C-N 3.29Å; K156-F158 PolarHBondContact O-N 2.55Å; K156-Y163 HydrophobicContact CB-CD1 4.47Å; K156-Y163 HydrophobicContact CB-CD2 3.87Å; K156-Y163 HydrophobicContact CB-CE2 4.41Å; K156-Y163 HydrophobicContact CB-CG 3.92Å; K156-Y163 HydrophobicContact CD-CD1 4.36Å; K156-Y163 HydrophobicContact CD-CE1 4.28Å; K156-Y163 HydrophobicContact CG-CD1 4.28Å; K156-Y163 HydrophobicContact CG-CG 4.21Å; K156-E206 IonicContact NZ-OE1 2.66Å; K156-E206 PolarHBondContact NZ-OE1 2.92Å; K156-E206 IonicContact NZ-OE2 3.57Å; K156-E206 PolarHBondContact NZ-OE2 3.33Å
157	S	86.9	Confident	88.5	Confident	86 Å²	86	45.5 Å²	45.5	60%	0.601	23%	0.231	S	C	*	.	H	α-helix	trans	-68.5	-28.6	-179.6	65	0	0	0	0	113.1	Q153 H154 V155	Q153-S157 PolarHBondContact O-N 3.39Å; H154-S157 PolarHBondContact O-N 3.28Å; H154-S157 PolarHBondContact O-OG 3.37Å; V155-S157 VanDerWaalsContact C-N 3.34Å; V155-S157 PolarHBondContact O-N 2.61Å
158	F	85.8	Confident	88.8	Confident	88 Å²	88	47.1 Å²	47.1	39%	0.386	24%	0.239	S	C	.	.	H	α-helix	trans	-89.4	-48.9	178.9	-173.9	-97	0	0	0	112.3	R108 F109 N112 H154 V155 K156	R108-F158 HydrophobicContact CB-CE1 4.22Å; R108-F158 HydrophobicContact CB-CZ 4.22Å; F109-F158 HydrophobicContact CB-CD1 3.83Å; F109-F158 HydrophobicContact CB-CE1 3.95Å; F109-F158 HydrophobicContact CD2-CB 3.68Å; F109-F158 AromaticContact CD2-CD1 3.81Å; F109-F158 HydrophobicContact CD2-CD1 3.81Å; F109-F158 AromaticContact CD2-CG 3.8Å; F109-F158 HydrophobicContact CD2-CG 3.8Å; F109-F158 HydrophobicContact CE2-CB 4.1Å; F109-F158 HydrophobicContact CG-CD1 4.33Å; N112-F158 HydrophobicContact CB-CE2 4.08Å; N112-F158 HydrophobicContact CB-CZ 4.29Å; H154-F158 PolarHBondContact O-N 3.11Å; V155-F158 PolarHBondContact O-N 3.47Å; K156-F158 VanDerWaalsContact C-N 3.29Å; K156-F158 PolarHBondContact O-N 2.55Å
159	D	88	Confident	89	Confident	44 Å²	44	51.5 Å²	51.5	24%	0.235	26%	0.255	C	S	.	.			trans	-145.7	106.2	-178.3	-171.5	-1.9	0	0	0	111.8	V155 V161 L162 Y163	V155-D159 CarbonylContact O-C 3.47Å; V155-D159 PolarHBondContact O-N 2.9Å; V155-D159 VanDerWaalsContact O-O 3.08Å; D159-V161 VanDerWaalsContact C-N 3.28Å; D159-V161 PolarHBondContact O-N 3.41Å; D159-V161 WeakPolarHBondContact OD1-CB 3.34Å; D159-V161 PolarHBondContact OD1-N 2.82Å; D159-L162 HydrophobicContact CB-CB 4.15Å; D159-Y163 PolarHBondContact O-N 2.73Å
160	E	89.6	Confident	89.2	Confident	112 Å²	112	47.3 Å²	47.3	52%	0.523	24%	0.236	S	C	.	.	H	α-helix	trans	-66.2	-30.6	177.6	-156.8	-168.1	156.9	0	0	112.2	Y163 H164	E160-Y163 WeakPolarHBondContact O-CB 2.86Å; E160-Y163 PolarHBondContact O-N 3.02Å; E160-H164 PolarHBondContact O-CD2 3.1Å; E160-H164 PolarHBondContact O-N 3.38Å; E160-H164 IonicContact OE1-CD2 4Å; E160-H164 IonicContact OE1-CE1 3.89Å; E160-H164 IonicContact OE1-NE2 2.99Å; E160-H164 PolarHBondContact OE1-NE2 3.29Å
161	V	91.3	Very high	89.1	Confident	88 Å²	88	49.7 Å²	49.7	53%	0.533	25%	0.249	S	C	.	.	H	α-helix	trans	-68.9	-46.8	-177.4	-179.3	0	0	0	0	110	D159 Y163 H164 Q165	D159-V161 VanDerWaalsContact C-N 3.28Å; D159-V161 PolarHBondContact O-N 3.41Å; D159-V161 WeakPolarHBondContact OD1-CB 3.34Å; D159-V161 PolarHBondContact OD1-N 2.82Å; V161-Y163 VanDerWaalsContact C-N 3.28Å; V161-Y163 PolarHBondContact O-N 3.01Å; V161-H164 PolarHBondContact O-N 2.61Å; V161-Q165 VanDerWaalsContact O-CG 3.27Å; V161-Q165 WeakPolarHBondContact O-CG 3.45Å; V161-Q165 PolarHBondContact O-N 3.03Å
162	L	89.6	Confident	89	Confident	2 Å²	2	52 Å²	52	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-60.1	-41.2	175.6	-178.6	60.6	0	0	0	111.1	V102 F106 V155 D159 Q165 I166	V102-L162 HydrophobicContact CG1-CD1 4.01Å; F106-L162 HydrophobicContact CB-CD2 4.4Å; F106-L162 HydrophobicContact CD2-CD2 4.32Å; V155-L162 HydrophobicContact CG1-CB 4.26Å; V155-L162 HydrophobicContact CG1-CD2 3.95Å; V155-L162 HydrophobicContact CG1-CG 3.97Å; D159-L162 HydrophobicContact CB-CB 4.15Å; L162-Q165 PolarHBondContact O-N 3.09Å; L162-I166 HydrophobicContact CD1-CD1 4.25Å; L162-I166 HydrophobicContact CD1-CG1 4.41Å; L162-I166 HydrophobicContact CG-CD1 3.96Å; L162-I166 VanDerWaalsContact O-CG1 3.28Å; L162-I166 WeakPolarHBondContact O-CG1 3.45Å; L162-I166 PolarHBondContact O-N 3.4Å
163	Y	91.3	Very high	89.2	Confident	13 Å²	13	52.1 Å²	52.1	5%	0.051	26%	0.262	C	S	.	.	H	α-helix	trans	-57.8	-52.5	175.4	173.4	-96.4	0	0	0	112.3	L152 K156 D159 E160 V161 Q165 I166 V167 E206	L152-Y163 HydrophobicContact CB-CD2 4.11Å; L152-Y163 HydrophobicContact CB-CE2 3.83Å; K156-Y163 HydrophobicContact CB-CD1 4.47Å; K156-Y163 HydrophobicContact CB-CD2 3.87Å; K156-Y163 HydrophobicContact CB-CE2 4.41Å; K156-Y163 HydrophobicContact CB-CG 3.92Å; K156-Y163 HydrophobicContact CD-CD1 4.36Å; K156-Y163 HydrophobicContact CD-CE1 4.28Å; K156-Y163 HydrophobicContact CG-CD1 4.28Å; K156-Y163 HydrophobicContact CG-CG 4.21Å; D159-Y163 PolarHBondContact O-N 2.73Å; E160-Y163 WeakPolarHBondContact O-CB 2.86Å; E160-Y163 PolarHBondContact O-N 3.02Å; V161-Y163 VanDerWaalsContact C-N 3.28Å; V161-Y163 PolarHBondContact O-N 3.01Å; Y163-Q165 PolarHBondContact O-N 3.46Å; Y163-I166 PolarHBondContact O-N 3.12Å; Y163-V167 HydrophobicContact CD2-CG2 4.48Å; Y163-V167 HydrophobicContact CE1-CG2 4.07Å; Y163-V167 HydrophobicContact CE2-CG2 4.02Å; Y163-V167 WeakPolarHBondContact O-CG2 3.46Å; Y163-V167 PolarHBondContact O-N 2.83Å; Y163-E206 WeakPolarHBondContact OH-CB 3.18Å; Y163-E206 PolarHBondContact OH-N 3.37Å
164	H	91.1	Very high	89.3	Confident	82 Å²	82	47.9 Å²	47.9	38%	0.38	24%	0.242	S	C	.	.	H	α-helix	trans	-62	-34.3	179	-76.1	-59.5	0	0	0	112.5	E160 V161 N168	E160-H164 PolarHBondContact O-CD2 3.1Å; E160-H164 PolarHBondContact O-N 3.38Å; E160-H164 IonicContact OE1-CD2 4Å; E160-H164 IonicContact OE1-CE1 3.89Å; E160-H164 IonicContact OE1-NE2 2.99Å; E160-H164 PolarHBondContact OE1-NE2 3.29Å; V161-H164 PolarHBondContact O-N 2.61Å; H164-N168 WeakPolarHBondContact O-CB 2.93Å; H164-N168 PolarHBondContact O-N 3.42Å; H164-N168 PolarHBondContact O-ND2 2.64Å
165	Q	90.6	Very high	89.2	Confident	40 Å²	40	49.2 Å²	49.2	19%	0.187	25%	0.254	C	S	.	.	H	α-helix	trans	-64.6	-51.4	175	-71.6	176.6	1	0	0	110.3	I97 V161 L162 Y163 V167 N168 Y169 I173	I97-Q165 HydrophobicContact CG1-CG 4.34Å; V161-Q165 VanDerWaalsContact O-CG 3.27Å; V161-Q165 WeakPolarHBondContact O-CG 3.45Å; V161-Q165 PolarHBondContact O-N 3.03Å; L162-Q165 PolarHBondContact O-N 3.09Å; Y163-Q165 PolarHBondContact O-N 3.46Å; Q165-V167 VanDerWaalsContact C-N 3.28Å; Q165-V167 PolarHBondContact O-N 3.25Å; Q165-N168 PolarHBondContact O-N 3.15Å; Q165-Y169 PolarHBondContact O-N 2.92Å; Q165-I173 HydrophobicContact CB-CD1 3.57Å; Q165-I173 WeakPolarHBondContact O-CD1 3.41Å
166	I	91.1	Very high	89.3	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-56	-42.6	179.8	-67.6	163.7	0	0	0	111.5	L152 V155 L162 Y163 P170 I173 L177 L222	L152-I166 HydrophobicContact CD2-CD1 4.37Å; L152-I166 HydrophobicContact CD2-CG2 3.89Å; V155-I166 HydrophobicContact CG1-CD1 4.11Å; L162-I166 HydrophobicContact CD1-CD1 4.25Å; L162-I166 HydrophobicContact CD1-CG1 4.41Å; L162-I166 HydrophobicContact CG-CD1 3.96Å; L162-I166 VanDerWaalsContact O-CG1 3.28Å; L162-I166 WeakPolarHBondContact O-CG1 3.45Å; L162-I166 PolarHBondContact O-N 3.4Å; Y163-I166 PolarHBondContact O-N 3.12Å; I166-P170 WeakPolarHBondContact O-CA 3.36Å; I166-I173 HydrophobicContact CG1-CG2 3.71Å; I166-L177 HydrophobicContact CD1-CD1 3.99Å; I166-L177 HydrophobicContact CG1-CD1 4.11Å; I166-L222 HydrophobicContact CG2-CD2 4.46Å
167	V	91.8	Very high	89.3	Confident	25 Å²	25	48.1 Å²	48.1	15%	0.152	25%	0.248	C	C	.	.	H	α-helix	trans	-68.1	-41.9	-178.5	174	0	0	0	0	112	Y163 Q165 K221 L222	Y163-V167 HydrophobicContact CD2-CG2 4.48Å; Y163-V167 HydrophobicContact CE1-CG2 4.07Å; Y163-V167 HydrophobicContact CE2-CG2 4.02Å; Y163-V167 WeakPolarHBondContact O-CG2 3.46Å; Y163-V167 PolarHBondContact O-N 2.83Å; Q165-V167 VanDerWaalsContact C-N 3.28Å; Q165-V167 PolarHBondContact O-N 3.25Å; V167-K221 WeakPolarHBondContact O-CA 3.34Å; V167-L222 PolarHBondContact O-N 3.44Å
168	N	90.9	Very high	89.4	Confident	66 Å²	66	45.5 Å²	45.5	35%	0.353	23%	0.228	S	C	.	.	H	α-helix	trans	-82.3	-32.9	-175.2	-71.2	-49.8	0	0	0	113.6	H164 Q165	H164-N168 WeakPolarHBondContact O-CB 2.93Å; H164-N168 PolarHBondContact O-N 3.42Å; H164-N168 PolarHBondContact O-ND2 2.64Å; Q165-N168 PolarHBondContact O-N 3.15Å
169	Y	91.4	Very high	89.4	Confident	99 Å²	99	44.4 Å²	44.4	39%	0.388	22%	0.221	S	C	.	.			trans	-129.3	58.2	-176.1	-56.8	-77.7	0	0	0	112.5	T95 I97 Q165 N171 I173	T95-Y169 HydrophobicContact CG2-CD1 3.48Å; T95-Y169 VanDerWaalsContact CG2-CD1 3.48Å; T95-Y169 HydrophobicContact CG2-CD2 4.48Å; T95-Y169 HydrophobicContact CG2-CE1 3.49Å; T95-Y169 VanDerWaalsContact CG2-CE1 3.49Å; T95-Y169 HydrophobicContact CG2-CE2 4.46Å; T95-Y169 HydrophobicContact CG2-CG 3.99Å; I97-Y169 HydrophobicContact CD1-CD2 3.47Å; I97-Y169 VanDerWaalsContact CD1-CD2 3.47Å; I97-Y169 HydrophobicContact CD1-CE2 4.14Å; I97-Y169 HydrophobicContact CD1-CG 3.87Å; Q165-Y169 PolarHBondContact O-N 2.92Å; Y169-N171 PolarHBondContact O-N 2.77Å; Y169-I173 WeakPolarHBondContact O-CB 3.39Å; Y169-I173 WeakPolarHBondContact O-CD1 3.5Å; Y169-I173 WeakPolarHBondContact O-CG1 3.3Å; Y169-I173 PolarHBondContact O-N 3.33Å
170	P	91.1	Very high	89.4	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.8	-35.8	-173.8	25.1	-35.4	0	0	0	113.6	I166 D172 I174 N220 L222 I333	I166-P170 WeakPolarHBondContact O-CA 3.36Å; P170-D172 PolarHBondContact O-N 2.93Å; P170-I174 HydrophobicContact CB-CD1 3.84Å; P170-I174 HydrophobicContact CB-CG1 4.49Å; P170-I174 WeakPolarHBondContact O-CB 3.48Å; P170-I174 WeakPolarHBondContact O-CD1 3.17Å; P170-I174 WeakPolarHBondContact O-CG1 3.32Å; P170-I174 PolarHBondContact O-N 2.99Å; P170-N220 VanDerWaalsContact CD-O 3.24Å; P170-N220 WeakPolarHBondContact CD-O 3.33Å; P170-N220 WeakPolarHBondContact CG-O 3.41Å; P170-L222 HydrophobicContact CB-CB 4.31Å; P170-L222 HydrophobicContact CB-CD1 4.34Å; P170-L222 HydrophobicContact CG-CB 4.36Å; P170-I333 HydrophobicContact CB-CD1 3.88Å; P170-I333 HydrophobicContact CB-CG1 4.1Å; P170-I333 HydrophobicContact CG-CD1 3.84Å; P170-I333 HydrophobicContact CG-CG1 3.89Å; P170-I333 HydrophobicContact CG-CG2 4.21Å
171	N	86.7	Confident	89.4	Confident	54 Å²	54	37.4 Å²	37.4	29%	0.289	19%	0.187	S	C	.	.	H	α-helix	trans	-60.9	-47	-176	-68.3	-43.8	0	0	0	112.7	Y169 T175 I333 R335	Y169-N171 PolarHBondContact O-N 2.77Å; N171-T175 WeakPolarHBondContact O-CG2 3.33Å; N171-T175 PolarHBondContact O-OG1 2.93Å; N171-T175 VanDerWaalsContact O-OG1 3.08Å; N171-I333 WeakPolarHBondContact OD1-CD1 3.41Å; N171-R335 PolarHBondContact OD1-NH2 3.18Å
172	D	86.5	Confident	89.2	Confident	69 Å²	69	34.2 Å²	34.2	37%	0.369	17%	0.167	S	C	.	.	H	α-helix	trans	-82.7	-35.6	-175.2	-56.1	-35.1	0	0	0	111	I92 P170 T175 Y176	I92-D172 HydrophobicContact CD1-CB 3.94Å; P170-D172 PolarHBondContact O-N 2.93Å; D172-T175 PolarHBondContact O-OG1 3.01Å; D172-Y176 WeakPolarHBondContact O-CB 3.07Å; D172-Y176 PolarHBondContact O-N 2.83Å
173	I	89.6	Confident	89.1	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-77.3	-43.8	-176.4	-65	165.4	0	0	0	111	I97 Q165 I166 Y169 T175 Y176 L177	I97-I173 HydrophobicContact CD1-CD1 3.84Å; I97-I173 HydrophobicContact CD1-CG1 4.27Å; Q165-I173 HydrophobicContact CB-CD1 3.57Å; Q165-I173 WeakPolarHBondContact O-CD1 3.41Å; I166-I173 HydrophobicContact CG1-CG2 3.71Å; Y169-I173 WeakPolarHBondContact O-CB 3.39Å; Y169-I173 WeakPolarHBondContact O-CD1 3.5Å; Y169-I173 WeakPolarHBondContact O-CG1 3.3Å; Y169-I173 PolarHBondContact O-N 3.33Å; I173-T175 VanDerWaalsContact C-N 3.3Å; I173-T175 PolarHBondContact O-N 3.48Å; I173-Y176 CarbonylContact O-C 3.56Å; I173-Y176 WeakPolarHBondContact O-CA 3.31Å; I173-Y176 PolarHBondContact O-N 2.76Å; I173-L177 HydrophobicContact CG2-CD1 3.88Å; I173-L177 HydrophobicContact CG2-CD2 4.47Å; I173-L177 HydrophobicContact CG2-CG 3.84Å; I173-L177 VanDerWaalsContact O-CG 3.28Å; I173-L177 WeakPolarHBondContact O-CG 3.22Å; I173-L177 PolarHBondContact O-N 2.95Å
174	I	88.6	Confident	88.7	Confident	17 Å²	17	36.1 Å²	36.1	9%	0.087	18%	0.177	C	C	.	.	H	α-helix	trans	-61.8	-42.4	-177.7	-66.5	172	0	0	0	110.6	P170 Y176 L177 D178 P202 I359	P170-I174 HydrophobicContact CB-CD1 3.84Å; P170-I174 HydrophobicContact CB-CG1 4.49Å; P170-I174 WeakPolarHBondContact O-CB 3.48Å; P170-I174 WeakPolarHBondContact O-CD1 3.17Å; P170-I174 WeakPolarHBondContact O-CG1 3.32Å; P170-I174 PolarHBondContact O-N 2.99Å; I174-Y176 VanDerWaalsContact C-N 3.26Å; I174-Y176 PolarHBondContact O-N 3.45Å; I174-L177 PolarHBondContact O-N 3.21Å; I174-D178 VanDerWaalsContact O-CG 3.3Å; I174-D178 PolarHBondContact O-N 3.26Å; I174-P202 HydrophobicContact CD1-CG 3.78Å; I174-P202 HydrophobicContact CG1-CG 4.31Å; I174-I359 HydrophobicContact CD1-CD1 3.4Å
175	T	86.7	Confident	88.4	Confident	78 Å²	78	32.2 Å²	32.2	48%	0.479	16%	0.159	S	C	.	.	H	α-helix	trans	-62.8	-35.1	176.1	53.7	0	0	0	0	112.1	N171 D172 I173 Y179	N171-T175 WeakPolarHBondContact O-CG2 3.33Å; N171-T175 PolarHBondContact O-OG1 2.93Å; N171-T175 VanDerWaalsContact O-OG1 3.08Å; D172-T175 PolarHBondContact O-OG1 3.01Å; I173-T175 VanDerWaalsContact C-N 3.3Å; I173-T175 PolarHBondContact O-N 3.48Å; T175-Y179 PolarHBondContact O-N 3.35Å
176	Y	88	Confident	88.2	Confident	43 Å²	43	33.5 Å²	33.5	17%	0.169	16%	0.162	C	C	.	.	H	α-helix	trans	-74.6	-36.7	174.8	-165.9	-113.2	0	0	0	112.9	L99 V102 E103 D172 I173 I174 D178 Y179 T180	L99-Y176 HydrophobicContact CB-CE1 4.17Å; L99-Y176 HydrophobicContact CB-CE2 4.34Å; L99-Y176 HydrophobicContact CD2-CD1 4.07Å; L99-Y176 HydrophobicContact CD2-CD2 4.02Å; L99-Y176 HydrophobicContact CD2-CE1 4.12Å; L99-Y176 HydrophobicContact CD2-CE2 4.11Å; L99-Y176 HydrophobicContact CD2-CG 4.01Å; L99-Y176 VanDerWaalsContact O-CE1 3.26Å; L99-Y176 WeakPolarHBondContact O-CE1 3.4Å; L99-Y176 PolarHBondContact O-OH 3.32Å; V102-Y176 HydrophobicContact CB-CD1 4.37Å; V102-Y176 HydrophobicContact CB-CE1 4.29Å; V102-Y176 HydrophobicContact CG1-CD1 4Å; V102-Y176 HydrophobicContact CG1-CE1 4.33Å; E103-Y176 HydrophobicContact CB-CE1 3.99Å; E103-Y176 PolarHBondContact OE2-OH 3.14Å; D172-Y176 WeakPolarHBondContact O-CB 3.07Å; D172-Y176 PolarHBondContact O-N 2.83Å; I173-Y176 CarbonylContact O-C 3.56Å; I173-Y176 WeakPolarHBondContact O-CA 3.31Å; I173-Y176 PolarHBondContact O-N 2.76Å; I174-Y176 VanDerWaalsContact C-N 3.26Å; I174-Y176 PolarHBondContact O-N 3.45Å; Y176-D178 VanDerWaalsContact C-N 3.34Å; Y176-Y179 HydrophobicContact CE2-CD1 4.29Å; Y176-Y179 WeakPolarHBondContact O-CB 3.37Å; Y176-Y179 PolarHBondContact O-N 2.86Å; Y176-T180 HydrophobicContact CD1-CG2 4.3Å; Y176-T180 HydrophobicContact CE1-CG2 4.03Å; Y176-T180 WeakPolarHBondContact O-CG2 3.46Å; Y176-T180 PolarHBondContact O-N 3.32Å; Y176-T180 PolarHBondContact O-OG1 2.82Å
177	L	89.1	Confident	87.9	Confident	2 Å²	2	38.7 Å²	38.7	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-62.5	-43.1	174.2	-68.8	179.8	0	0	0	110.8	V102 F106 I166 I173 I174 Y179 T180 L181 I200	V102-L177 HydrophobicContact CG1-CD2 4.46Å; F106-L177 HydrophobicContact CB-CD2 3.88Å; F106-L177 HydrophobicContact CD1-CD2 3.93Å; F106-L177 HydrophobicContact CD2-CD2 3.44Å; F106-L177 VanDerWaalsContact CD2-CD2 3.44Å; F106-L177 HydrophobicContact CE1-CD2 4.3Å; F106-L177 HydrophobicContact CE2-CD2 3.86Å; F106-L177 HydrophobicContact CG-CD2 3.46Å; F106-L177 VanDerWaalsContact CG-CD2 3.46Å; F106-L177 HydrophobicContact CZ-CD2 4.26Å; I166-L177 HydrophobicContact CD1-CD1 3.99Å; I166-L177 HydrophobicContact CG1-CD1 4.11Å; I173-L177 HydrophobicContact CG2-CD1 3.88Å; I173-L177 HydrophobicContact CG2-CD2 4.47Å; I173-L177 HydrophobicContact CG2-CG 3.84Å; I173-L177 VanDerWaalsContact O-CG 3.28Å; I173-L177 WeakPolarHBondContact O-CG 3.22Å; I173-L177 PolarHBondContact O-N 2.95Å; I174-L177 PolarHBondContact O-N 3.21Å; L177-Y179 VanDerWaalsContact C-N 3.29Å; L177-Y179 PolarHBondContact O-N 3.36Å; L177-T180 WeakPolarHBondContact CA-OG1 3.32Å; L177-T180 PolarHBondContact O-N 3.12Å; L177-T180 PolarHBondContact O-OG1 2.76Å; L177-L181 WeakPolarHBondContact O-CB 3.2Å; L177-L181 PolarHBondContact O-N 3.08Å; L177-I200 VanDerWaalsContact C-CD1 3.49Å; L177-I200 HydrophobicContact CB-CD1 3.56Å; L177-I200 WeakPolarHBondContact O-CD1 3.21Å
178	D	88.8	Confident	87.5	Confident	31 Å²	31	40.6 Å²	40.6	17%	0.166	20%	0.195	C	C	.	.	H	α-helix	trans	-56.9	-45.1	174.3	-70	-16.7	0	0	0	111.2	I174 Y176 L181 N182 I200	I174-D178 VanDerWaalsContact O-CG 3.3Å; I174-D178 PolarHBondContact O-N 3.26Å; Y176-D178 VanDerWaalsContact C-N 3.34Å; D178-L181 PolarHBondContact O-N 3.04Å; D178-N182 WeakPolarHBondContact O-CB 3.29Å; D178-N182 PolarHBondContact O-N 3.46Å; D178-N182 PolarHBondContact O-ND2 3.04Å; D178-I200 WeakPolarHBondContact OD1-CB 3.4Å; D178-I200 PolarHBondContact OD1-N 3.2Å
179	Y	86.8	Confident	87.1	Confident	65 Å²	65	39.7 Å²	39.7	26%	0.255	19%	0.187	S	C	.	.	H	α-helix	trans	-57.8	-52.7	175.3	169.6	-81.6	0	0	0	111.4	Y48 T175 Y176 L177 L181 N182 E183	Y48-Y179 HydrophobicContact CD2-CD2 4.23Å; Y48-Y179 AromaticContact CD2-CE2 3.37Å; Y48-Y179 HydrophobicContact CD2-CE2 3.37Å; Y48-Y179 HydrophobicContact CE2-CD2 4.22Å; Y48-Y179 AromaticContact CE2-CE2 3.16Å; Y48-Y179 HydrophobicContact CE2-CE2 3.16Å; Y48-Y179 AromaticContact CE2-CZ 3.59Å; Y48-Y179 VanDerWaalsContact CE2-OH 3.26Å; Y48-Y179 WeakPolarHBondContact CE2-OH 3.46Å; Y48-Y179 HydrophobicContact CG-CE2 4.34Å; Y48-Y179 AromaticContact CZ-CE2 3.99Å; Y48-Y179 AromaticContact CZ-CZ 4Å; Y48-Y179 PolarHBondContact OH-OH 3.41Å; Y48-Y179 VanDerWaalsContact OH-OH 3.08Å; T175-Y179 PolarHBondContact O-N 3.35Å; Y176-Y179 HydrophobicContact CE2-CD1 4.29Å; Y176-Y179 WeakPolarHBondContact O-CB 3.37Å; Y176-Y179 PolarHBondContact O-N 2.86Å; L177-Y179 VanDerWaalsContact C-N 3.29Å; L177-Y179 PolarHBondContact O-N 3.36Å; Y179-L181 VanDerWaalsContact C-N 3.29Å; Y179-L181 PolarHBondContact O-N 3.2Å; Y179-N182 PolarHBondContact O-N 3.34Å; Y179-E183 VanDerWaalsContact CE1-OE2 3.24Å; Y179-E183 WeakPolarHBondContact CE1-OE2 3.46Å; Y179-E183 PolarHBondContact O-N 2.97Å; Y179-E183 PolarHBondContact OH-OE2 3.35Å
180	T	87.7	Confident	86.6	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-64.3	-36.2	-176.7	57.5	0	0	0	0	112.1	E103 F106 Y176 L177 E183 M184	E103-T180 HydrophobicContact CB-CG2 4.02Å; E103-T180 HydrophobicContact CG-CG2 3.78Å; F106-T180 WeakPolarHBondContact CD1-OG1 3.22Å; F106-T180 WeakPolarHBondContact CE1-OG1 3.39Å; Y176-T180 HydrophobicContact CD1-CG2 4.3Å; Y176-T180 HydrophobicContact CE1-CG2 4.03Å; Y176-T180 WeakPolarHBondContact O-CG2 3.46Å; Y176-T180 PolarHBondContact O-N 3.32Å; Y176-T180 PolarHBondContact O-OG1 2.82Å; L177-T180 WeakPolarHBondContact CA-OG1 3.32Å; L177-T180 PolarHBondContact O-N 3.12Å; L177-T180 PolarHBondContact O-OG1 2.76Å; T180-E183 PolarHBondContact O-N 2.97Å; T180-M184 WeakPolarHBondContact O-CG 3.38Å; T180-M184 PolarHBondContact O-N 3.27Å
181	L	87.9	Confident	85.7	Confident	8 Å²	8	47 Å²	47	4%	0.042	23%	0.232	C	C	.	.	H	α-helix	trans	-69.7	-40.3	178.1	-172.7	145.5	0	0	0	111.7	F106 L137 I148 L177 D178 Y179 E183 M184 F185 L198 I200	F106-L181 HydrophobicContact CE1-CB 4.13Å; F106-L181 HydrophobicContact CZ-CD1 4.35Å; L137-L181 HydrophobicContact CD2-CD1 4.42Å; L137-L181 HydrophobicContact CD2-CD2 4.03Å; L137-L181 HydrophobicContact CD2-CG 4.22Å; I148-L181 HydrophobicContact CD1-CD1 3.8Å; I148-L181 HydrophobicContact CD1-CD2 3.65Å; I148-L181 HydrophobicContact CD1-CG 4.32Å; I148-L181 HydrophobicContact CG2-CD1 4.49Å; L177-L181 WeakPolarHBondContact O-CB 3.2Å; L177-L181 PolarHBondContact O-N 3.08Å; D178-L181 PolarHBondContact O-N 3.04Å; Y179-L181 VanDerWaalsContact C-N 3.29Å; Y179-L181 PolarHBondContact O-N 3.2Å; L181-E183 VanDerWaalsContact C-N 3.31Å; L181-M184 PolarHBondContact O-N 2.89Å; L181-F185 WeakPolarHBondContact O-CB 3.35Å; L181-F185 PolarHBondContact O-N 3.17Å; L181-L198 HydrophobicContact CD2-CB 3.35Å; L181-L198 HydrophobicContact CD2-CD1 3.39Å; L181-L198 HydrophobicContact CD2-CG 3.98Å; L181-I200 HydrophobicContact CB-CD1 3.91Å; L181-I200 HydrophobicContact CB-CG1 4.46Å; L181-I200 HydrophobicContact CD1-CD1 3.72Å; L181-I200 HydrophobicContact CD1-CG1 3.7Å; L181-I200 HydrophobicContact CG-CD1 4.42Å
182	N	87.8	Confident	84.8	Confident	21 Å²	21	44.8 Å²	44.8	11%	0.112	22%	0.221	C	C	.	.	H	α-helix	trans	-62.9	-40.5	174	-77.7	-56.6	0	0	0	111.1	D178 Y179 F185 Y186 L198	D178-N182 WeakPolarHBondContact O-CB 3.29Å; D178-N182 PolarHBondContact O-N 3.46Å; D178-N182 PolarHBondContact O-ND2 3.04Å; Y179-N182 PolarHBondContact O-N 3.34Å; N182-F185 WeakPolarHBondContact O-CB 3.44Å; N182-F185 PolarHBondContact O-N 3.48Å; N182-Y186 HydrophobicContact CB-CE2 4.1Å; N182-Y186 WeakPolarHBondContact O-CD2 3.43Å; N182-Y186 VanDerWaalsContact O-CG 3.27Å; N182-Y186 PolarHBondContact O-N 3.37Å; N182-L198 PolarHBondContact ND2-O 3.15Å; N182-L198 WeakPolarHBondContact OD1-CB 3.38Å; N182-L198 PolarHBondContact OD1-N 3.12Å
183	E	87	Confident	83.4	Confident	49 Å²	49	47.4 Å²	47.4	23%	0.229	23%	0.23	C	C	.	.	H	α-helix	trans	-60.6	-48.4	174.9	-163.5	179.7	154.4	0	0	111.9	R107 Y179 T180 L181 F185 Y186 E187	R107-E183 IonicContact CZ-OE1 2.77Å; R107-E183 IonicContact NH2-OE1 3.37Å; R107-E183 PolarHBondContact NH2-OE1 2.91Å; R107-E183 IonicContact NH2-OE2 3.95Å; R107-E183 PolarHBondContact NH2-OE2 3Å; Y179-E183 VanDerWaalsContact CE1-OE2 3.24Å; Y179-E183 WeakPolarHBondContact CE1-OE2 3.46Å; Y179-E183 PolarHBondContact O-N 2.97Å; Y179-E183 PolarHBondContact OH-OE2 3.35Å; T180-E183 PolarHBondContact O-N 2.97Å; L181-E183 VanDerWaalsContact C-N 3.31Å; E183-F185 VanDerWaalsContact C-N 3.29Å; E183-F185 PolarHBondContact O-N 2.99Å; E183-Y186 PolarHBondContact O-N 3.2Å; E183-E187 WeakPolarHBondContact O-CG 3.45Å; E183-E187 PolarHBondContact O-N 2.67Å
184	M	83.8	Confident	81.8	Confident	6 Å²	6	58.8 Å²	58.8	3%	0.03	27%	0.273	C	S	.	.	H	α-helix	trans	-59.7	-39.2	174.5	-69.8	-175.4	74.7	0	0	112.4	R107 V110 E111 T180 L181 Y186 E187 I188	R107-M184 HydrophobicContact CB-SD 4.3Å; R107-M184 HydrophobicContact CG-CG 4.16Å; R107-M184 HydrophobicContact CG-SD 3.82Å; V110-M184 HydrophobicContact CB-CE 3.75Å; V110-M184 HydrophobicContact CB-SD 4.02Å; V110-M184 HydrophobicContact CG1-CE 3.54Å; V110-M184 HydrophobicContact CG1-SD 4.08Å; V110-M184 HydrophobicContact CG2-SD 4.3Å; E111-M184 HydrophobicContact CG-CE 4.04Å; T180-M184 WeakPolarHBondContact O-CG 3.38Å; T180-M184 PolarHBondContact O-N 3.27Å; L181-M184 PolarHBondContact O-N 2.89Å; M184-Y186 VanDerWaalsContact C-N 3.34Å; M184-E187 PolarHBondContact O-N 3.43Å; M184-I188 VanDerWaalsContact O-CG1 3.3Å; M184-I188 WeakPolarHBondContact O-CG1 3.39Å; M184-I188 PolarHBondContact O-N 3.06Å; M184-I188 VanDerWaalsContact O-N 3.1Å
185	F	85.5	Confident	80.5	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.7	-39.8	177.8	-175.2	-105.8	0	0	0	111.7	L137 V140 Y141 L181 N182 E183 I188 Y189 S192 L198	L137-F185 HydrophobicContact CD2-CD2 4.28Å; V140-F185 HydrophobicContact CG1-CE2 4.44Å; Y141-F185 HydrophobicContact CD2-CE2 4.33Å; Y141-F185 AromaticContact CD2-CZ 3.91Å; Y141-F185 HydrophobicContact CD2-CZ 3.91Å; L181-F185 WeakPolarHBondContact O-CB 3.35Å; L181-F185 PolarHBondContact O-N 3.17Å; N182-F185 WeakPolarHBondContact O-CB 3.44Å; N182-F185 PolarHBondContact O-N 3.48Å; E183-F185 VanDerWaalsContact C-N 3.29Å; E183-F185 PolarHBondContact O-N 2.99Å; F185-I188 PolarHBondContact O-N 3.11Å; F185-Y189 HydrophobicContact CD2-CD2 4.1Å; F185-Y189 AromaticContact CE2-CD2 3.85Å; F185-Y189 HydrophobicContact CE2-CD2 3.85Å; F185-Y189 HydrophobicContact CE2-CE2 4.4Å; F185-Y189 HydrophobicContact CZ-CD2 4.41Å; F185-Y189 PolarHBondContact O-N 3.18Å; F185-S192 WeakPolarHBondContact CE1-OG 3.37Å; F185-L198 HydrophobicContact CB-CD1 3.8Å; F185-L198 HydrophobicContact CD1-CD1 4Å; F185-L198 HydrophobicContact CD2-CD1 3.57Å; F185-L198 HydrophobicContact CE1-CD1 4.43Å; F185-L198 HydrophobicContact CE2-CD1 4.04Å; F185-L198 HydrophobicContact CG-CD1 3.52Å; F185-L198 HydrophobicContact CZ-CD1 4.44Å
186	Y	84.4	Confident	79.5	Confident	67 Å²	67	58.6 Å²	58.6	26%	0.263	28%	0.275	S	S	.	.	H	α-helix	trans	-69.7	-32	175.7	-62.8	-42.2	0	0	0	113.3	N182 E183 M184 Y189 P190 Q193	N182-Y186 HydrophobicContact CB-CE2 4.1Å; N182-Y186 WeakPolarHBondContact O-CD2 3.43Å; N182-Y186 VanDerWaalsContact O-CG 3.27Å; N182-Y186 PolarHBondContact O-N 3.37Å; E183-Y186 PolarHBondContact O-N 3.2Å; M184-Y186 VanDerWaalsContact C-N 3.34Å; Y186-Y189 CarbonylContact O-C 3.58Å; Y186-P190 WeakPolarHBondContact O-CA 3.29Å; Y186-Q193 HydrophobicContact CD1-CG 4.15Å; Y186-Q193 HydrophobicContact CG-CG 4.49Å
187	E	85.4	Confident	78.8	Confident	110 Å²	110	58.9 Å²	58.9	51%	0.514	28%	0.278	S	S	.	.	H	α-helix	trans	-65.1	-41.6	172.9	-73	173.2	-169.8	0	0	111.9	R107 E183 M184	R107-E187 IonicContact CZ-OE1 3.71Å; R107-E187 VanDerWaalsContact NH1-CD 3.34Å; R107-E187 IonicContact NH1-OE1 3.25Å; R107-E187 PolarHBondContact NH1-OE1 3.34Å; R107-E187 IonicContact NH1-OE2 3.24Å; R107-E187 PolarHBondContact NH1-OE2 3.33Å; R107-E187 IonicContact NH2-OE1 2.79Å; E183-E187 WeakPolarHBondContact O-CG 3.45Å; E183-E187 PolarHBondContact O-N 2.67Å; M184-E187 PolarHBondContact O-N 3.43Å
188	I	83.7	Confident	78.5	Confident	65 Å²	65	58.8 Å²	58.8	33%	0.333	28%	0.278	S	S	.	.	H	α-helix	trans	-75.3	-41.5	179.8	-60.2	165.9	0	0	0	110.9	L137 M184 F185	L137-I188 HydrophobicContact CD1-CD1 4.13Å; M184-I188 VanDerWaalsContact O-CG1 3.3Å; M184-I188 WeakPolarHBondContact O-CG1 3.39Å; M184-I188 PolarHBondContact O-N 3.06Å; M184-I188 VanDerWaalsContact O-N 3.1Å; F185-I188 PolarHBondContact O-N 3.11Å
189	Y	83.1	Confident	78.4	Confident	48 Å²	48	60.1 Å²	60.1	19%	0.188	28%	0.283	C	S	.	.			trans	-128.4	78.9	-174.9	-61	-68.9	0	0	0	111.9	C138 Y141 F185 Y186 E191 S192	C138-Y189 PolarHBondContact SG-OH 2.71Å; Y141-Y189 HydrophobicContact CD1-CD1 4.45Å; Y141-Y189 HydrophobicContact CD1-CE1 4.15Å; Y141-Y189 HydrophobicContact CD2-CD1 4.05Å; Y141-Y189 AromaticContact CD2-CD2 3.91Å; Y141-Y189 HydrophobicContact CD2-CD2 3.91Å; Y141-Y189 HydrophobicContact CD2-CE1 4.44Å; Y141-Y189 HydrophobicContact CD2-CE2 4.29Å; Y141-Y189 AromaticContact CD2-CG 3.77Å; Y141-Y189 HydrophobicContact CD2-CG 3.77Å; Y141-Y189 HydrophobicContact CE1-CD1 4.37Å; Y141-Y189 HydrophobicContact CE1-CE1 4.29Å; Y141-Y189 AromaticContact CE2-CD1 3.97Å; Y141-Y189 HydrophobicContact CE2-CD1 3.97Å; Y141-Y189 AromaticContact CE2-CG 3.95Å; Y141-Y189 HydrophobicContact CE2-CG 3.95Å; Y141-Y189 HydrophobicContact CG-CD1 4.3Å; Y141-Y189 HydrophobicContact CG-CD2 4.16Å; Y141-Y189 HydrophobicContact CG-CE1 4.22Å; Y141-Y189 HydrophobicContact CG-CE2 4.06Å; Y141-Y189 HydrophobicContact CG-CG 4.27Å; F185-Y189 HydrophobicContact CD2-CD2 4.1Å; F185-Y189 AromaticContact CE2-CD2 3.85Å; F185-Y189 HydrophobicContact CE2-CD2 3.85Å; F185-Y189 HydrophobicContact CE2-CE2 4.4Å; F185-Y189 HydrophobicContact CZ-CD2 4.41Å; F185-Y189 PolarHBondContact O-N 3.18Å; Y186-Y189 CarbonylContact O-C 3.58Å; Y189-E191 PolarHBondContact O-N 2.8Å; Y189-E191 VanDerWaalsContact O-N 3.08Å; Y189-S192 PolarHBondContact O-N 3.4Å; Y189-S192 VanDerWaalsContact O-N 3.12Å; Y189-S192 PolarHBondContact O-OG 2.86Å
190	P	79.4	Confident	78.4	Confident	78 Å²	78	57.2 Å²	57.2	51%	0.506	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-61.9	-21.8	-178.5	22.9	-33.5	0	0	0	113.6	Y186 S192 Q193	Y186-P190 WeakPolarHBondContact O-CA 3.29Å; P190-S192 PolarHBondContact O-N 2.84Å; P190-Q193 WeakPolarHBondContact O-CG 3.48Å
191	E	73	Confident	78.5	Confident	174 Å²	174	58.2 Å²	58.2	81%	0.813	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-69	-19.5	178.8	-58.8	-173	173.2	0	0	113.6	Y189	Y189-E191 PolarHBondContact O-N 2.8Å; Y189-E191 VanDerWaalsContact O-N 3.08Å
192	S	67.5	Low	78.6	Confident	8 Å²	8	58 Å²	58	6%	0.056	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-88.2	0.7	-172.9	69.5	0	0	0	0	115	F185 Y189 P190 R194 S195	F185-S192 WeakPolarHBondContact CE1-OG 3.37Å; Y189-S192 PolarHBondContact O-N 3.4Å; Y189-S192 VanDerWaalsContact O-N 3.12Å; Y189-S192 PolarHBondContact O-OG 2.86Å; P190-S192 PolarHBondContact O-N 2.84Å; S192-R194 PolarHBondContact O-N 3.4Å; S192-S195 PolarHBondContact O-N 3.42Å
193	Q	57.3	Low	78.6	Confident	123 Å²	123	58.4 Å²	58.4	58%	0.575	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	-3.8	-165.4	-98.9	179.4	-8.9	0	0	119.2	Y186 P190	Y186-Q193 HydrophobicContact CD1-CG 4.15Å; Y186-Q193 HydrophobicContact CG-CG 4.49Å; P190-Q193 WeakPolarHBondContact O-CG 3.48Å
194	R	55.6	Low	78.3	Confident	242 Å²	242	58.3 Å²	58.3	91%	0.913	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-141.7	-2.8	-171.3	-66	-173.9	179.7	165.1	1.1	116.7	S192	S192-R194 PolarHBondContact O-N 3.4Å
195	S	62.2	Low	78	Confident	73 Å²	73	58.2 Å²	58.2	51%	0.51	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.2	-22.5	-168.7	50.2	0	0	0	0	115.8	S192	S192-S195 PolarHBondContact O-N 3.42Å
196	I	66.1	Low	77.5	Confident	18 Å²	18	63.7 Å²	63.7	9%	0.092	30%	0.302	C	S	.	.			trans	-135.7	121.1	-170.3	-52.5	176.5	0	0	0	108.3	Q144 T146 L198	Q144-I196 HydrophobicContact CB-CD1 4.27Å; Q144-I196 HydrophobicContact CG-CD1 4.31Å; T146-I196 HydrophobicContact CG2-CG2 3.92Å; I196-L198 HydrophobicContact CG2-CD2 3.78Å; I196-L198 HydrophobicContact CG2-CG 4.45Å
197	E	72.5	Confident	76.8	Confident	48 Å²	48	66 Å²	66	22%	0.224	32%	0.316	C	S	.	.			trans	-104.3	126.2	165.2	-79.5	160.4	-133.5	0	0	107.4	S41	S41-E197 VanDerWaalsContact CB-CD 3.46Å; S41-E197 WeakPolarHBondContact CB-OE1 3.34Å; S41-E197 PolarHBondContact N-OE2 3.13Å
198	L	83.1	Confident	76.5	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.005	32%	0.315	C	S	.	.			trans	-90.7	138.1	179.2	-58.9	176.5	0	0	0	109.6	L137 V140 T146 I148 L181 N182 F185 I196	L137-L198 HydrophobicContact CD2-CD1 4.16Å; V140-L198 HydrophobicContact CG1-CD1 4.16Å; V140-L198 HydrophobicContact CG1-CD2 3.43Å; V140-L198 VanDerWaalsContact CG1-CD2 3.43Å; V140-L198 HydrophobicContact CG1-CG 4.46Å; T146-L198 CarbonylContact O-C 3.55Å; T146-L198 WeakPolarHBondContact O-CA 3.18Å; I148-L198 HydrophobicContact CD1-CB 4.43Å; I148-L198 HydrophobicContact CD1-CD1 4.06Å; L181-L198 HydrophobicContact CD2-CB 3.35Å; L181-L198 HydrophobicContact CD2-CD1 3.39Å; L181-L198 HydrophobicContact CD2-CG 3.98Å; N182-L198 PolarHBondContact ND2-O 3.15Å; N182-L198 WeakPolarHBondContact OD1-CB 3.38Å; N182-L198 PolarHBondContact OD1-N 3.12Å; F185-L198 HydrophobicContact CB-CD1 3.8Å; F185-L198 HydrophobicContact CD1-CD1 4Å; F185-L198 HydrophobicContact CD2-CD1 3.57Å; F185-L198 HydrophobicContact CE1-CD1 4.43Å; F185-L198 HydrophobicContact CE2-CD1 4.04Å; F185-L198 HydrophobicContact CG-CD1 3.52Å; F185-L198 HydrophobicContact CZ-CD1 4.44Å; I196-L198 HydrophobicContact CG2-CD2 3.78Å; I196-L198 HydrophobicContact CG2-CG 4.45Å
199	Q	85.7	Confident	76.3	Confident	58 Å²	58	64.3 Å²	64.3	27%	0.271	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	133.4	176.5	-66.3	-177.5	-15.1	0	0	109.5	T146 V147 I148	T146-Q199 PolarHBondContact O-N 3.01Å; V147-Q199 WeakPolarHBondContact CA-O 3.46Å; I148-Q199 PolarHBondContact N-O 2.91Å
200	I	88.7	Confident	76.2	Confident	5 Å²	5	63.1 Å²	63.1	3%	0.026	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	129.6	176.1	-63.8	166.4	0	0	0	109	F106 I148 L150 L177 D178 L181 P202	F106-I200 HydrophobicContact CE1-CD1 4.24Å; F106-I200 HydrophobicContact CZ-CD1 3.72Å; I148-I200 WeakPolarHBondContact O-CA 3.45Å; L150-I200 HydrophobicContact CB-CG2 3.64Å; L150-I200 HydrophobicContact CD2-CG2 3.75Å; L150-I200 HydrophobicContact CG-CG2 4.34Å; L177-I200 VanDerWaalsContact C-CD1 3.49Å; L177-I200 HydrophobicContact CB-CD1 3.56Å; L177-I200 WeakPolarHBondContact O-CD1 3.21Å; D178-I200 WeakPolarHBondContact OD1-CB 3.4Å; D178-I200 PolarHBondContact OD1-N 3.2Å; L181-I200 HydrophobicContact CB-CD1 3.91Å; L181-I200 HydrophobicContact CB-CG1 4.46Å; L181-I200 HydrophobicContact CD1-CD1 3.72Å; L181-I200 HydrophobicContact CD1-CG1 3.7Å; L181-I200 HydrophobicContact CG-CD1 4.42Å; I200-P202 WeakPolarHBondContact O-CD 3.46Å
201	K	88.6	Confident	76.6	Confident	21 Å²	21	59.9 Å²	59.9	9%	0.091	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	95.5	171.8	-69.2	-171.5	-174.7	-179.6	0	109	V147 I148 L150 S317 I359 H360	V147-K201 HydrophobicContact CG1-CB 4.34Å; V147-K201 HydrophobicContact CG1-CD 3.41Å; V147-K201 VanDerWaalsContact CG1-CD 3.41Å; V147-K201 HydrophobicContact CG1-CG 3.82Å; I148-K201 PolarHBondContact O-N 3.31Å; L150-K201 PolarHBondContact N-O 3.19Å; K201-S317 PolarHBondContact NZ-OG 3.41Å; K201-I359 HydrophobicContact CB-CG2 4.43Å; K201-I359 VanDerWaalsContact CD-O 3.29Å; K201-I359 WeakPolarHBondContact CD-O 3.43Å; K201-I359 HydrophobicContact CG-CG2 4.38Å; K201-H360 HydrophobicContact CB-CB 4.29Å
202	P	89.9	Confident	77.2	Confident	2 Å²	2	55.5 Å²	55.5	1%	0.013	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	135.9	172.3	26.5	-35.2	0	0	0	111	L150 L152 I174 I200 L222 I359	L150-P202 CarbonylContact O-C 3.57Å; L150-P202 VanDerWaalsContact O-CA 3.25Å; L150-P202 WeakPolarHBondContact O-CA 3.35Å; L152-P202 HydrophobicContact CD1-CB 4.19Å; L152-P202 HydrophobicContact CD2-CB 3.76Å; L152-P202 HydrophobicContact CG-CB 3.97Å; I174-P202 HydrophobicContact CD1-CG 3.78Å; I174-P202 HydrophobicContact CG1-CG 4.31Å; I200-P202 WeakPolarHBondContact O-CD 3.46Å; P202-L222 HydrophobicContact CB-CD2 4.45Å; P202-L222 HydrophobicContact CG-CD2 4.43Å; P202-I359 HydrophobicContact CG-CG2 4.21Å
203	F	87.2	Confident	78.2	Confident	30 Å²	30	59 Å²	59	13%	0.132	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	165.8	174.4	72.3	-86.1	0	0	0	111	E149 L150 D151 L152 H360 L362	E149-F203 HydrophobicContact CB-CD1 3.93Å; E149-F203 HydrophobicContact CB-CE1 3.68Å; L150-F203 VanDerWaalsContact C-CD1 3.5Å; L150-F203 VanDerWaalsContact C-CE1 3.47Å; L150-F203 VanDerWaalsContact O-CD1 3.3Å; L150-F203 WeakPolarHBondContact O-CD1 3.22Å; L150-F203 PolarHBondContact O-N 3.25Å; D151-F203 HydrophobicContact CB-CE1 3.94Å; D151-F203 HydrophobicContact CB-CE2 4Å; D151-F203 HydrophobicContact CB-CZ 3.55Å; D151-F203 VanDerWaalsContact N-CE1 3.31Å; L152-F203 WeakPolarHBondContact CB-O 3.03Å; L152-F203 WeakPolarHBondContact CG-O 3.4Å; L152-F203 PolarHBondContact N-O 3.13Å; F203-H360 HydrophobicContact CB-CB 4.3Å; F203-H360 WeakPolarHBondContact CB-CD2 3.2Å; F203-L362 HydrophobicContact CD2-CD1 4.1Å
204	N	80.9	Confident	79.7	Confident	47 Å²	47	54.4 Å²	54.4	25%	0.251	26%	0.264	S	S	.	.			trans	63.7	60.1	173.8	-164.1	22.7	0	0	0	114.9	D151 Q153	D151-N204 PolarHBondContact OD1-ND2 3.17Å; D151-N204 PolarHBondContact OD2-ND2 2.99Å; Q153-N204 WeakPolarHBondContact CG-ND2 3.33Å; Q153-N204 PolarHBondContact NE2-ND2 2.81Å; Q153-N204 PolarHBondContact NE2-OD1 3.31Å
205	A	77.8	Confident	81.4	Confident	5 Å²	5	48.3 Å²	48.3	4%	0.041	25%	0.246	C	C	.	.			trans	-69.9	147.7	167.9	0	0	0	0	0	110.7	L152 Q207	L152-A205 HydrophobicContact CD1-CB 4.05Å; A205-Q207 VanDerWaalsContact C-N 3.27Å; A205-Q207 PolarHBondContact O-N 3.13Å
206	E	74.8	Confident	82.7	Confident	114 Å²	114	49.8 Å²	49.8	53%	0.533	25%	0.254	S	S	.	.	S	Bend	trans	-58.2	-37.4	-176.7	176.8	174.8	-148.6	0	0	113.3	K156 Y163	K156-E206 IonicContact NZ-OE1 2.66Å; K156-E206 PolarHBondContact NZ-OE1 2.92Å; K156-E206 IonicContact NZ-OE2 3.57Å; K156-E206 PolarHBondContact NZ-OE2 3.33Å; Y163-E206 WeakPolarHBondContact OH-CB 3.18Å; Y163-E206 PolarHBondContact OH-N 3.37Å
207	Q	71.3	Confident	83.9	Confident	115 Å²	115	54.7 Å²	54.7	54%	0.537	28%	0.28	S	S	.	.			trans	-97.5	103.7	-177.6	-67.2	-178.2	-11.5	0	0	110	A205 Y209	A205-Q207 VanDerWaalsContact C-N 3.27Å; A205-Q207 PolarHBondContact O-N 3.13Å; Q207-Y209 HydrophobicContact CB-CD2 4.19Å; Q207-Y209 HydrophobicContact CB-CE2 3.6Å; Q207-Y209 VanDerWaalsContact O-CD2 3.28Å; Q207-Y209 WeakPolarHBondContact O-CD2 3.34Å; Q207-Y209 PolarHBondContact O-N 3Å; Q207-Y209 PolarHBondContact OE1-OH 3.44Å
208	I	77.3	Confident	84.7	Confident	96 Å²	96	52.9 Å²	52.9	49%	0.492	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	112.4	164.9	-57.7	176.1	0	0	0	107.2	S224 N226	I208-S224 WeakPolarHBondContact CA-O 3.41Å; I208-N226 HydrophobicContact CG2-CB 4.46Å
209	Y	79.9	Confident	85.2	Confident	44 Å²	44	55.4 Å²	55.4	17%	0.173	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	135	179.1	-70.2	-99	0	0	0	110.1	Q207 L214 I223 S224	Q207-Y209 HydrophobicContact CB-CD2 4.19Å; Q207-Y209 HydrophobicContact CB-CE2 3.6Å; Q207-Y209 VanDerWaalsContact O-CD2 3.28Å; Q207-Y209 WeakPolarHBondContact O-CD2 3.34Å; Q207-Y209 PolarHBondContact O-N 3Å; Q207-Y209 PolarHBondContact OE1-OH 3.44Å; Y209-L214 HydrophobicContact CG-CD2 4.42Å; Y209-I223 HydrophobicContact CD2-CB 4.22Å; Y209-I223 HydrophobicContact CD2-CG2 4.13Å; Y209-I223 HydrophobicContact CE2-CG2 4.09Å; Y209-S224 PolarHBondContact N-O 3.12Å
210	G	82	Confident	85.4	Confident	24 Å²	24	56.5 Å²	56.5	25%	0.247	29%	0.293	C	S	.	.			trans	-71.2	149.5	161.9	0	0	0	0	0	109.7	R212 T213	G210-R212 PolarHBondContact O-N 3.42Å; G210-R212 VanDerWaalsContact O-N 3.09Å; G210-T213 PolarHBondContact N-OG1 2.75Å; G210-T213 PolarHBondContact O-N 3.47Å; G210-T213 PolarHBondContact O-OG1 3.24Å
211	M	86.7	Confident	85.5	Confident	10 Å²	10	58.9 Å²	58.9	5%	0.049	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-63.3	-22.2	-177.4	-50.7	-177.9	-177.8	0	0	112.8	I225 N226 L294 Q295 E296 V310	M211-I225 HydrophobicContact CE-CG2 3.91Å; M211-I225 HydrophobicContact CG-CG2 3.73Å; M211-N226 WeakPolarHBondContact CE-O 3.47Å; M211-L294 HydrophobicContact CE-CB 3.78Å; M211-Q295 WeakPolarHBondContact CE-O 3.35Å; M211-E296 HydrophobicContact CB-CG 3.68Å; M211-E296 WeakPolarHBondContact CB-OE1 3.34Å; M211-E296 HydrophobicContact CE-CG 4.46Å; M211-E296 HydrophobicContact CG-CG 3.62Å; M211-E296 HydrophobicContact SD-CB 4.43Å; M211-E296 HydrophobicContact SD-CG 3.56Å; M211-E296 VanDerWaalsContact SD-CG 3.56Å; M211-E296 PolarHBondContact SD-N 3.01Å; M211-V310 HydrophobicContact CB-CG2 4.04Å; M211-V310 HydrophobicContact CG-CG2 4.08Å; M211-V310 HydrophobicContact SD-CB 4.3Å; M211-V310 HydrophobicContact SD-CG2 3.79Å
212	R	87	Confident	85.7	Confident	81 Å²	81	58 Å²	58	31%	0.306	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-76.5	-25.7	175.2	-48.9	-161.8	175.9	-101.8	-14.9	114.5	G210 L214 E296 A306 L308	G210-R212 PolarHBondContact O-N 3.42Å; G210-R212 VanDerWaalsContact O-N 3.09Å; R212-L214 VanDerWaalsContact C-N 3.3Å; R212-E296 WeakPolarHBondContact CG-OE1 3.31Å; R212-E296 IonicContact CZ-OE2 3.18Å; R212-E296 PolarHBondContact N-OE1 3.47Å; R212-E296 IonicContact NE-OE1 2.64Å; R212-E296 IonicContact NE-OE2 3.49Å; R212-E296 PolarHBondContact NE-OE2 2.98Å; R212-E296 VanDerWaalsContact NE-OE2 3.1Å; R212-E296 IonicContact NH2-OE2 3.36Å; R212-E296 PolarHBondContact NH2-OE2 3.36Å; R212-A306 PolarHBondContact NH2-O 3.02Å; R212-L308 HydrophobicContact CB-CD1 4.43Å; R212-L308 HydrophobicContact CG-CD1 3.83Å
213	T	88.2	Confident	85.9	Confident	81 Å²	81	58 Å²	58	50%	0.497	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-91	7.4	-174.1	56.3	0	0	0	0	112.6	G210 E215	G210-T213 PolarHBondContact N-OG1 2.75Å; G210-T213 PolarHBondContact O-N 3.47Å; G210-T213 PolarHBondContact O-OG1 3.24Å; T213-E215 PolarHBondContact O-N 3.26Å
214	L	88.5	Confident	86.1	Confident	28 Å²	28	56.9 Å²	56.9	15%	0.147	30%	0.295	C	S	.	.			trans	-71.3	112.5	177.5	-66.7	174.6	0	0	0	110.6	Y209 R212 I223 I225 Y334	Y209-L214 HydrophobicContact CG-CD2 4.42Å; R212-L214 VanDerWaalsContact C-N 3.3Å; L214-I223 HydrophobicContact CD2-CD1 3.78Å; L214-I225 HydrophobicContact CD1-CD1 3.68Å; L214-I225 HydrophobicContact CD2-CD1 3.87Å; L214-I225 HydrophobicContact CG-CD1 4.19Å; L214-Y334 HydrophobicContact CD1-CE2 4.29Å
215	E	90.1	Very high	86.6	Confident	114 Å²	114	54.7 Å²	54.7	53%	0.533	28%	0.283	S	S	.	.			trans	-95.8	157.6	178.3	-66.6	-171.7	166.6	0	0	111.6	T213 D217 D218	T213-E215 PolarHBondContact O-N 3.26Å; E215-D217 PolarHBondContact O-N 3.49Å; E215-D218 PolarHBondContact O-N 3.42Å
216	P	91.1	Very high	87.1	Confident	103 Å²	103	55.6 Å²	55.6	67%	0.669	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-60.3	-22.7	172.5	-23.1	34.5	0	0	0	113.7	D218 I219	P216-D218 PolarHBondContact O-N 2.97Å; P216-I219 HydrophobicContact CB-CD1 4.47Å; P216-I219 WeakPolarHBondContact O-CB 3.44Å; P216-I219 WeakPolarHBondContact O-CD1 3.43Å; P216-I219 WeakPolarHBondContact O-CG1 3.35Å; P216-I219 PolarHBondContact O-N 2.89Å
217	D	90.7	Very high	87.8	Confident	121 Å²	121	50.1 Å²	50.1	65%	0.647	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-70.4	-16.2	179.7	-72.2	-2.9	0	0	0	112.7	E215 I219 K221	E215-D217 PolarHBondContact O-N 3.49Å; D217-I219 VanDerWaalsContact C-N 3.35Å; D217-K221 WeakPolarHBondContact O-CE 3.42Å; D217-K221 PolarHBondContact O-NZ 3.2Å
218	D	90.2	Very high	88.5	Confident	11 Å²	11	45.5 Å²	45.5	6%	0.059	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-92.3	3.3	-180	-59.1	-36.5	0	0	0	113.3	E215 P216 N220 K221 I223	E215-D218 PolarHBondContact O-N 3.42Å; P216-D218 PolarHBondContact O-N 2.97Å; D218-N220 PolarHBondContact O-N 3.46Å; D218-K221 PolarHBondContact O-N 3.32Å; D218-K221 VanDerWaalsContact O-N 3.09Å; D218-K221 IonicContact OD1-NZ 3.86Å; D218-K221 PolarHBondContact OD1-NZ 3.14Å; D218-I223 HydrophobicContact CB-CG2 4.45Å
219	I	92.1	Very high	89.1	Confident	53 Å²	53	41 Å²	41	27%	0.272	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60	132.9	173	-64.6	170	0	0	0	109.2	P216 D217 K221 Y334	P216-I219 HydrophobicContact CB-CD1 4.47Å; P216-I219 WeakPolarHBondContact O-CB 3.44Å; P216-I219 WeakPolarHBondContact O-CD1 3.43Å; P216-I219 WeakPolarHBondContact O-CG1 3.35Å; P216-I219 PolarHBondContact O-N 2.89Å; D217-I219 VanDerWaalsContact C-N 3.35Å; I219-K221 PolarHBondContact O-N 2.83Å; I219-Y334 HydrophobicContact CB-CD1 4.48Å; I219-Y334 HydrophobicContact CG1-CD1 3.82Å; I219-Y334 HydrophobicContact CG1-CE1 3.9Å
220	N	90.9	Very high	89.4	Confident	82 Å²	82	40.3 Å²	40.3	44%	0.439	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	67	7.8	-175.2	-55.2	-45.4	0	0	0	116.1	P170 D218 Y334	P170-N220 VanDerWaalsContact CD-O 3.24Å; P170-N220 WeakPolarHBondContact CD-O 3.33Å; P170-N220 WeakPolarHBondContact CG-O 3.41Å; D218-N220 PolarHBondContact O-N 3.46Å; N220-Y334 PolarHBondContact N-O 3.47Å
221	K	91.2	Very high	89.5	Confident	54 Å²	54	40.1 Å²	40.1	24%	0.235	21%	0.208	C	C	.	.	S	Bend	trans	-91	162.2	169.7	-59.2	-172.8	-161.9	148.2	0	111.6	V167 D217 D218 I219 I333 Y334	V167-K221 WeakPolarHBondContact O-CA 3.34Å; D217-K221 WeakPolarHBondContact O-CE 3.42Å; D217-K221 PolarHBondContact O-NZ 3.2Å; D218-K221 PolarHBondContact O-N 3.32Å; D218-K221 VanDerWaalsContact O-N 3.09Å; D218-K221 IonicContact OD1-NZ 3.86Å; D218-K221 PolarHBondContact OD1-NZ 3.14Å; I219-K221 PolarHBondContact O-N 2.83Å; K221-I333 WeakPolarHBondContact O-CA 3.48Å; K221-Y334 PolarHBondContact O-N 2.91Å
222	L	92.5	Very high	89.5	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	123.3	170.8	-165.4	74.1	0	0	0	109.6	L152 I166 V167 P170 P202 T331 I333 I359	L152-L222 HydrophobicContact CD1-CD2 3.54Å; I166-L222 HydrophobicContact CG2-CD2 4.46Å; V167-L222 PolarHBondContact O-N 3.44Å; P170-L222 HydrophobicContact CB-CB 4.31Å; P170-L222 HydrophobicContact CB-CD1 4.34Å; P170-L222 HydrophobicContact CG-CB 4.36Å; P202-L222 HydrophobicContact CB-CD2 4.45Å; P202-L222 HydrophobicContact CG-CD2 4.43Å; L222-T331 HydrophobicContact CD1-CG2 4.06Å; L222-T331 HydrophobicContact CD2-CG2 4.13Å; L222-T331 HydrophobicContact CG-CG2 4.01Å; L222-I333 HydrophobicContact CD1-CG1 4.42Å; L222-I359 HydrophobicContact CD1-CD1 3.75Å
223	I	92.8	Very high	89.5	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	147.5	179.2	58.5	165	0	0	0	110.6	Y209 L214 D218 I225 T331 G332 Y334 I356	Y209-I223 HydrophobicContact CD2-CB 4.22Å; Y209-I223 HydrophobicContact CD2-CG2 4.13Å; Y209-I223 HydrophobicContact CE2-CG2 4.09Å; L214-I223 HydrophobicContact CD2-CD1 3.78Å; D218-I223 HydrophobicContact CB-CG2 4.45Å; I223-I225 HydrophobicContact CD1-CD1 3.82Å; I223-I225 HydrophobicContact CD1-CG1 4.03Å; I223-T331 WeakPolarHBondContact O-CA 3.31Å; I223-G332 WeakPolarHBondContact CG1-O 3.35Å; I223-G332 PolarHBondContact N-O 3.33Å; I223-G332 PolarHBondContact O-N 3.27Å; I223-Y334 HydrophobicContact CD1-CD2 4.27Å; I223-Y334 HydrophobicContact CD1-CG 4.21Å; I223-I356 HydrophobicContact CD1-CD1 3.82Å; I223-I356 HydrophobicContact CD1-CG1 4.12Å
224	S	92.2	Very high	89.4	Confident	5 Å²	5	35.8 Å²	35.8	4%	0.035	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123	170	-66.2	0	0	0	0	108.9	I208 Y209 V330 T331	I208-S224 WeakPolarHBondContact CA-O 3.41Å; Y209-S224 PolarHBondContact N-O 3.12Å; S224-V330 CarbonylContact C-O 3.6Å; S224-V330 WeakPolarHBondContact CA-O 3.49Å; S224-T331 PolarHBondContact OG-OG1 2.95Å
225	I	91.3	Very high	89.5	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	139.8	178.7	-59.9	-168.3	0	0	0	110	M211 L214 I223 T329 V330 I356	M211-I225 HydrophobicContact CE-CG2 3.91Å; M211-I225 HydrophobicContact CG-CG2 3.73Å; L214-I225 HydrophobicContact CD1-CD1 3.68Å; L214-I225 HydrophobicContact CD2-CD1 3.87Å; L214-I225 HydrophobicContact CG-CD1 4.19Å; I223-I225 HydrophobicContact CD1-CD1 3.82Å; I223-I225 HydrophobicContact CD1-CG1 4.03Å; I225-T329 CarbonylContact O-C 3.52Å; I225-T329 WeakPolarHBondContact O-CA 3.38Å; I225-V330 PolarHBondContact N-O 3.29Å; I225-V330 PolarHBondContact O-N 3.37Å; I225-I356 HydrophobicContact CD1-CD1 3.31Å; I225-I356 HydrophobicContact CG1-CD1 4.14Å
226	N	89.4	Confident	89.5	Confident	23 Å²	23	34.9 Å²	34.9	12%	0.123	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	138.7	171.6	-67.9	-6.7	0	0	0	111.3	I208 M211 F297 T329	I208-N226 HydrophobicContact CG2-CB 4.46Å; M211-N226 WeakPolarHBondContact CE-O 3.47Å; N226-F297 HydrophobicContact CB-CD2 4.16Å; N226-F297 HydrophobicContact CB-CE2 3.59Å; N226-F297 HydrophobicContact CB-CZ 4.26Å; N226-T329 VanDerWaalsContact OD1-CB 3.27Å; N226-T329 WeakPolarHBondContact OD1-CB 3.39Å; N226-T329 WeakPolarHBondContact OD1-CG2 3.29Å
227	G	87.7	Confident	89.5	Confident	0 Å²	0	34 Å²	34	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.7	163.7	174.1	0	0	0	0	0	114.8	Q295 I328	G227-Q295 CarbonylContact C-O 3.56Å; G227-Q295 WeakPolarHBondContact CA-O 3.27Å; G227-I328 PolarHBondContact N-O 2.82Å; G227-I328 PolarHBondContact O-N 3.35Å; G227-I328 VanDerWaalsContact O-O 3.11Å
228	M	87.2	Confident	89.4	Confident	18 Å²	18	32.6 Å²	32.6	9%	0.089	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	140.5	172.4	62.1	179.7	178.3	0	0	111.1	I230 L294 Q295 F297 D326	M228-I230 PolarHBondContact O-N 3.5Å; M228-L294 CarbonylContact O-C 3.55Å; M228-L294 WeakPolarHBondContact O-CA 3.49Å; M228-Q295 HydrophobicContact CE-CB 3.83Å; M228-Q295 HydrophobicContact CE-CG 3.79Å; M228-Q295 HydrophobicContact CG-CB 3.79Å; M228-Q295 PolarHBondContact N-O 3.02Å; M228-Q295 PolarHBondContact O-N 3.49Å; M228-F297 HydrophobicContact CB-CD1 4.27Å; M228-F297 HydrophobicContact CB-CE1 4.17Å; M228-D326 WeakPolarHBondContact CA-O 3.48Å
229	V	88.7	Confident	89.3	Confident	2 Å²	2	34.1 Å²	34.1	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	116.1	-175	-179.6	0	0	0	0	109.9	V292 L294 V322 G325 D326 I328	V229-V292 HydrophobicContact CB-CG1 4.41Å; V229-V292 HydrophobicContact CG1-CG1 3.48Å; V229-V292 VanDerWaalsContact CG1-CG1 3.48Å; V229-V292 HydrophobicContact CG2-CG1 4.18Å; V229-L294 HydrophobicContact CB-CD2 4.18Å; V229-L294 HydrophobicContact CG2-CD2 3.38Å; V229-V322 HydrophobicContact CB-CG1 4.01Å; V229-V322 HydrophobicContact CG1-CG1 4.03Å; V229-V322 HydrophobicContact CG2-CG1 3.2Å; V229-G325 PolarHBondContact O-N 3.35Å; V229-D326 WeakPolarHBondContact CG2-O 3.46Å; V229-D326 PolarHBondContact N-O 2.85Å; V229-I328 HydrophobicContact CG2-CD1 3.74Å; V229-I328 HydrophobicContact CG2-CG1 4.01Å; V229-I328 HydrophobicContact CG2-CG2 4.36Å
230	I	86.1	Confident	89	Confident	28 Å²	28	33.4 Å²	33.4	14%	0.144	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	-46.1	177.3	-54.4	178.5	0	0	0	110.2	M228 K293 Q295 Q496	M228-I230 PolarHBondContact O-N 3.5Å; I230-K293 PolarHBondContact N-O 3.38Å; I230-Q295 HydrophobicContact CD1-CB 3.74Å; I230-Q295 HydrophobicContact CD1-CG 4.07Å; I230-Q295 VanDerWaalsContact CD1-OE1 3.3Å; I230-Q295 HydrophobicContact CG1-CB 3.72Å; I230-Q295 HydrophobicContact CG1-CG 4.46Å; I230-Q496 HydrophobicContact CG2-CG 3.72Å
231	R	85.8	Confident	89	Confident	21 Å²	21	30.5 Å²	30.5	8%	0.079	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	148.6	-172	62.7	177.8	-157.3	171.1	14	111.2	K293 D487 V494	R231-K293 HydrophobicContact CG-CB 3.88Å; R231-K293 HydrophobicContact CG-CG 4.22Å; R231-K293 VanDerWaalsContact NE-CD 3.31Å; R231-K293 PolarHBondContact O-N 3.11Å; R231-D487 IonicContact CZ-OD1 3.64Å; R231-D487 IonicContact NH1-OD1 2.66Å; R231-D487 PolarHBondContact NH1-OD1 3.11Å; R231-D487 IonicContact NH2-OD1 2.95Å; R231-D487 PolarHBondContact NH2-OD1 3.36Å; R231-V494 HydrophobicContact CB-CG1 3.79Å
232	A	86.6	Confident	89.1	Confident	23 Å²	23	28 Å²	28	19%	0.19	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	138.4	168.2	0	0	0	0	0	108.7	V292	A232-V292 HydrophobicContact CB-CG2 4.18Å
233	T	86.9	Confident	89.1	Confident	6 Å²	6	29 Å²	29	4%	0.037	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-76.8	166.2	170.5	63.4	0	0	0	0	110.5	Q290 I291 T490	T233-Q290 WeakPolarHBondContact O-CG 3.32Å; T233-Q290 PolarHBondContact O-NE2 2.95Å; T233-I291 HydrophobicContact CG2-CB 3.96Å; T233-I291 PolarHBondContact N-O 3.33Å; T233-I291 PolarHBondContact OG1-N 2.98Å; T233-I291 PolarHBondContact OG1-O 2.95Å; T233-T490 HydrophobicContact CG2-CG2 4.28Å
234	G	85.9	Confident	89.1	Confident	52 Å²	52	29.4 Å²	29.4	54%	0.536	17%	0.166	S	C	.	.	P	Polyproline II helix	trans	-64.9	173.1	161	0	0	0	0	0	111.9
235	L	89.8	Confident	89.1	Confident	83 Å²	83	31.9 Å²	31.9	44%	0.435	18%	0.177	S	C	.	.	P	Polyproline II helix	trans	-65.4	130	177.1	-49.6	178	0	0	0	111	V319	L235-V319 HydrophobicContact CD2-CB 4.34Å; L235-V319 HydrophobicContact CD2-CG1 2.97Å; L235-V319 HydrophobicContact CG-CG1 4.47Å
236	I	90.1	Very high	89.1	Confident	40 Å²	40	31.8 Å²	31.8	21%	0.205	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	117.8	175.4	-56.2	174.4	0	0	0	107.5	R289 I291 T490	I236-R289 WeakPolarHBondContact CA-O 3.33Å; I236-R289 WeakPolarHBondContact CB-O 3.46Å; I236-R289 PolarHBondContact N-O 3.33Å; I236-R289 PolarHBondContact O-N 3.43Å; I236-I291 HydrophobicContact CD1-CD1 3.94Å; I236-I291 HydrophobicContact CD1-CG1 4.28Å; I236-T490 HydrophobicContact CD1-CG2 3.97Å
237	P	91.4	Very high	89	Confident	84 Å²	84	36.2 Å²	36.2	55%	0.545	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	132.3	177.3	29	-33.2	0	0	0	110.8	F286 G287	P237-F286 HydrophobicContact CB-CB 4.03Å; P237-F286 HydrophobicContact CB-CD1 4.07Å; P237-F286 HydrophobicContact CB-CG 4.17Å; P237-G287 WeakPolarHBondContact CA-O 3.47Å
238	E	88.9	Confident	89.1	Confident	92 Å²	92	41.8 Å²	41.8	43%	0.43	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	127.7	176.8	-177	165.4	173	0	0	110.6	R240 F286 G287 R289	E238-R240 PolarHBondContact O-N 2.77Å; E238-F286 CarbonylContact O-C 3.5Å; E238-F286 WeakPolarHBondContact O-CA 3.41Å; E238-G287 PolarHBondContact N-O 2.87Å; E238-G287 PolarHBondContact O-N 3.47Å; E238-R289 WeakPolarHBondContact OE2-CD 3.38Å; E238-R289 IonicContact OE2-NE 2.72Å; E238-R289 PolarHBondContact OE2-NE 3.36Å
239	M	88	Confident	89.3	Confident	42 Å²	42	43.2 Å²	43.2	21%	0.207	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	125.8	-174	-169.8	176.2	-64.7	0	0	111.2	A242 V257 I262 L279 F286	M239-A242 HydrophobicContact SD-CB 3.98Å; M239-V257 HydrophobicContact CG-CG2 4.38Å; M239-V257 WeakPolarHBondContact O-CG2 3.28Å; M239-I262 HydrophobicContact SD-CD1 3.75Å; M239-L279 HydrophobicContact CE-CD2 4.26Å; M239-L279 HydrophobicContact SD-CD1 4.41Å; M239-F286 HydrophobicContact CB-CD1 4Å; M239-F286 HydrophobicContact CB-CE1 3.94Å; M239-F286 HydrophobicContact CE-CE1 3.72Å; M239-F286 HydrophobicContact CE-CZ 3.89Å; M239-F286 HydrophobicContact CG-CE1 4.26Å
240	R	86.5	Confident	89.2	Confident	39 Å²	39	50.4 Å²	50.4	15%	0.147	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	-41.7	173.7	-71.2	-167.3	169.5	162.5	5.4	113.1	S39 E238 V257 I285 D316	S39-R240 WeakPolarHBondContact OG-CD 3.41Å; E238-R240 PolarHBondContact O-N 2.77Å; R240-V257 WeakPolarHBondContact O-CG2 3.21Å; R240-V257 PolarHBondContact O-N 3.37Å; R240-I285 PolarHBondContact N-O 3.27Å; R240-D316 IonicContact CZ-OD1 3.14Å; R240-D316 IonicContact CZ-OD2 2.62Å; R240-D316 IonicContact NH1-OD1 3.23Å; R240-D316 IonicContact NH1-OD2 3.62Å; R240-D316 PolarHBondContact NH1-OD2 3.1Å; R240-D316 IonicContact NH2-OD1 3.69Å; R240-D316 PolarHBondContact NH2-OD1 2.88Å; R240-D316 VanDerWaalsContact NH2-OD1 3.14Å; R240-D316 IonicContact NH2-OD2 2.77Å; R240-D316 PolarHBondContact NH2-OD2 3.03Å
241	E	91	Very high	89.3	Confident	21 Å²	21	49.7 Å²	49.7	10%	0.098	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	119.7	178.2	-66	-177.9	-153.7	0	0	110.1	S39 F256 S284 I285	S39-E241 VanDerWaalsContact CB-OE1 3.32Å; S39-E241 WeakPolarHBondContact CB-OE1 3.27Å; E241-F256 HydrophobicContact CG-CD1 3.5Å; E241-F256 VanDerWaalsContact CG-CD1 3.5Å; E241-F256 HydrophobicContact CG-CE1 3.33Å; E241-F256 HydrophobicContact CG-CG 4.34Å; E241-F256 HydrophobicContact CG-CZ 4.05Å; E241-F256 WeakPolarHBondContact OE1-CE1 3.4Å; E241-F256 WeakPolarHBondContact OE1-CZ 3.34Å; E241-S284 CarbonylContact O-C 3.43Å; E241-S284 WeakPolarHBondContact O-CA 3.22Å; E241-S284 WeakPolarHBondContact O-CB 3.33Å; E241-I285 HydrophobicContact CB-CB 4Å; E241-I285 HydrophobicContact CB-CD1 4.46Å; E241-I285 HydrophobicContact CB-CG1 4.17Å; E241-I285 HydrophobicContact CG-CB 4.39Å; E241-I285 HydrophobicContact CG-CD1 4.39Å; E241-I285 PolarHBondContact N-O 3.18Å; E241-I285 PolarHBondContact O-N 3.01Å; E241-I285 WeakPolarHBondContact OE2-CD1 3.43Å
242	A	91.4	Very high	89.5	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	127.7	173.1	0	0	0	0	0	110.3	M239 F244 T254 V255 I262 L279	M239-A242 HydrophobicContact SD-CB 3.98Å; A242-F244 HydrophobicContact CB-CD2 4.26Å; A242-F244 HydrophobicContact CB-CE2 3.64Å; A242-F244 HydrophobicContact CB-CZ 4.16Å; A242-T254 CarbonylContact O-C 3.51Å; A242-T254 WeakPolarHBondContact O-CA 3.37Å; A242-V255 PolarHBondContact N-O 3.34Å; A242-V255 PolarHBondContact O-N 3.25Å; A242-I262 HydrophobicContact CB-CG2 3.66Å; A242-L279 HydrophobicContact CB-CD1 3.66Å
243	F	93.6	Very high	89.7	Confident	27 Å²	27	53 Å²	53	12%	0.118	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	116.5	173	-174.5	-82.8	0	0	0	109.7	E245 T254 V280 R283	F243-E245 HydrophobicContact CE1-CB 4.43Å; F243-T254 HydrophobicContact CD2-CG2 3.68Å; F243-T254 HydrophobicContact CE2-CG2 4.4Å; F243-T254 HydrophobicContact CG-CG2 4.49Å; F243-V280 HydrophobicContact CD1-CB 3.9Å; F243-V280 HydrophobicContact CD1-CG2 4.19Å; F243-V280 HydrophobicContact CE1-CG2 4.49Å; F243-V280 PolarHBondContact O-N 3.24Å; F243-R283 HydrophobicContact CB-CB 3.93Å; F243-R283 HydrophobicContact CD1-CB 3.84Å; F243-R283 HydrophobicContact CD2-CB 4.13Å; F243-R283 HydrophobicContact CE1-CB 4.34Å; F243-R283 HydrophobicContact CG-CB 3.7Å
244	F	92.2	Very high	89.8	Confident	9 Å²	9	56.2 Å²	56.2	4%	0.039	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	139.7	176.9	-68.7	-80.3	0	0	0	111.3	A242 S252 T253 V255 I262 E264 P265 F277 V278 L279	A242-F244 HydrophobicContact CB-CD2 4.26Å; A242-F244 HydrophobicContact CB-CE2 3.64Å; A242-F244 HydrophobicContact CB-CZ 4.16Å; F244-S252 CarbonylContact O-C 3.47Å; F244-S252 VanDerWaalsContact O-CA 3.26Å; F244-S252 WeakPolarHBondContact O-CA 3.45Å; F244-T253 PolarHBondContact N-O 3.45Å; F244-T253 PolarHBondContact O-N 2.85Å; F244-V255 HydrophobicContact CD2-CB 4.32Å; F244-V255 HydrophobicContact CD2-CG2 3.93Å; F244-V255 HydrophobicContact CE2-CB 4.06Å; F244-V255 HydrophobicContact CE2-CG2 4.02Å; F244-I262 HydrophobicContact CE2-CG2 4.05Å; F244-I262 HydrophobicContact CZ-CG2 3.8Å; F244-E264 HydrophobicContact CD1-CG 4.46Å; F244-E264 HydrophobicContact CE1-CB 4.43Å; F244-E264 HydrophobicContact CE1-CG 3.96Å; F244-E264 HydrophobicContact CZ-CB 4.36Å; F244-E264 HydrophobicContact CZ-CG 4.33Å; F244-P265 HydrophobicContact CB-CG 4.42Å; F244-P265 HydrophobicContact CD2-CG 4.23Å; F244-P265 HydrophobicContact CG-CG 4.29Å; F244-F277 HydrophobicContact CB-CB 4.16Å; F244-F277 HydrophobicContact CB-CD1 3.71Å; F244-F277 HydrophobicContact CB-CE1 4.42Å; F244-F277 HydrophobicContact CB-CG 4.21Å; F244-F277 HydrophobicContact CD1-CB 4.12Å; F244-F277 HydrophobicContact CG-CB 4.45Å; F244-V278 CarbonylContact C-O 3.59Å; F244-V278 WeakPolarHBondContact CA-O 3.22Å; F244-L279 HydrophobicContact CD1-CB 4.16Å; F244-L279 HydrophobicContact CD1-CD1 4.41Å; F244-L279 HydrophobicContact CE1-CB 3.89Å; F244-L279 HydrophobicContact CE1-CD1 4.09Å; F244-L279 HydrophobicContact CZ-CD1 4.16Å
245	E	91.8	Very high	90	Very high	57 Å²	57	55.3 Å²	55.3	27%	0.266	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.8	173.1	-174.3	176.6	168.5	0	0	109.8	F243 F277 V278 V280	F243-E245 HydrophobicContact CE1-CB 4.43Å; E245-F277 WeakPolarHBondContact O-CA 3.41Å; E245-V278 PolarHBondContact N-O 3.46Å; E245-V278 PolarHBondContact O-N 3.38Å; E245-V280 HydrophobicContact CB-CG2 3.9Å
246	C	91.2	Very high	89.9	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	126.9	175.8	170.5	0	0	0	0	111.2	I248 K250 S251 C268 T276 F277	C246-I248 VanDerWaalsContact C-N 3.29Å; C246-I248 PolarHBondContact O-N 3.47Å; C246-I248 PolarHBondContact SG-N 2.99Å; C246-K250 WeakPolarHBondContact O-CA 3.31Å; C246-K250 PolarHBondContact O-N 3.37Å; C246-S251 PolarHBondContact N-O 2.95Å; C246-C268 HydrophobicContact CB-CB 4.35Å; C246-T276 PolarHBondContact SG-OG1 3.45Å; C246-T276 VanDerWaalsContact SG-OG1 3.34Å; C246-F277 HydrophobicContact CB-CD1 4.13Å; C246-F277 HydrophobicContact CB-CE1 4.03Å
247	N	89	Confident	89.6	Confident	116 Å²	116	53.5 Å²	53.5	62%	0.62	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-30.9	179.5	-84.3	-19	0	0	0	114.8	T276 V278	N247-T276 PolarHBondContact N-O 3.19Å; N247-V278 WeakPolarHBondContact ND2-CG2 3.42Å; N247-V278 VanDerWaalsContact OD1-CG2 3.26Å; N247-V278 WeakPolarHBondContact OD1-CG2 3.37Å
248	I	90.1	Very high	88.8	Confident	118 Å²	118	54.5 Å²	54.5	61%	0.605	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-58	-176.1	-57.2	-179.4	0	0	0	111.6	C246 T276	C246-I248 VanDerWaalsContact C-N 3.29Å; C246-I248 PolarHBondContact O-N 3.47Å; C246-I248 PolarHBondContact SG-N 2.99Å; I248-T276 HydrophobicContact CD1-CG2 3.79Å; I248-T276 HydrophobicContact CG1-CG2 4.11Å
249	C	89.4	Confident	87.9	Confident	47 Å²	47	59.7 Å²	59.7	32%	0.318	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-1.4	-173.5	65.3	0	0	0	0	114.9	S251 C268 C271	C249-S251 PolarHBondContact O-N 3.42Å; C249-S251 VanDerWaalsContact O-N 3.14Å; C249-S251 PolarHBondContact SG-OG 3.4Å; C249-C268 PolarHBondContact SG-SG 2.98Å; C249-C271 HydrophobicContact CB-CB 4.15Å
250	K	87.5	Confident	87	Confident	153 Å²	153	61 Å²	61	67%	0.665	33%	0.329	S	S	*	.			trans	56.8	24.1	-178.4	-56	-174.1	178.5	-177.7	0	114.9	C246 S252	C246-K250 WeakPolarHBondContact O-CA 3.31Å; C246-K250 PolarHBondContact O-N 3.37Å; K250-S252 PolarHBondContact O-N 3.44Å
251	S	88.5	Confident	86.8	Confident	13 Å²	13	65.9 Å²	65.9	9%	0.091	35%	0.354	C	S	.	.			trans	-71.2	128.3	171.8	61.6	0	0	0	0	108.9	C246 C249 C268	C246-S251 PolarHBondContact N-O 2.95Å; C249-S251 PolarHBondContact O-N 3.42Å; C249-S251 VanDerWaalsContact O-N 3.14Å; C249-S251 PolarHBondContact SG-OG 3.4Å; S251-C268 PolarHBondContact OG-SG 3.41Å
252	S	90.1	Very high	86.6	Confident	73 Å²	73	68.4 Å²	68.4	51%	0.51	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	145.2	175.5	53.1	0	0	0	0	111.9	F244 K250	F244-S252 CarbonylContact O-C 3.47Å; F244-S252 VanDerWaalsContact O-CA 3.26Å; F244-S252 WeakPolarHBondContact O-CA 3.45Å; K250-S252 PolarHBondContact O-N 3.44Å
253	T	90	Very high	86.4	Confident	42 Å²	42	73 Å²	73	26%	0.258	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	135.7	172.7	-54.1	0	0	0	0	108.4	F244	F244-T253 PolarHBondContact N-O 3.45Å; F244-T253 PolarHBondContact O-N 2.85Å
254	T	90.2	Very high	86	Confident	73 Å²	73	76.2 Å²	76.2	45%	0.448	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	140.6	174.5	48.7	0	0	0	0	110	A242 F243	A242-T254 CarbonylContact O-C 3.51Å; A242-T254 WeakPolarHBondContact O-CA 3.37Å; F243-T254 HydrophobicContact CD2-CG2 3.68Å; F243-T254 HydrophobicContact CE2-CG2 4.4Å; F243-T254 HydrophobicContact CG-CG2 4.49Å
255	V	89.3	Confident	85.6	Confident	32 Å²	32	77.1 Å²	77.1	19%	0.194	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	130	177.4	-178	0	0	0	0	108.8	A242 F244 P265	A242-V255 PolarHBondContact N-O 3.34Å; A242-V255 PolarHBondContact O-N 3.25Å; F244-V255 HydrophobicContact CD2-CB 4.32Å; F244-V255 HydrophobicContact CD2-CG2 3.93Å; F244-V255 HydrophobicContact CE2-CB 4.06Å; F244-V255 HydrophobicContact CE2-CG2 4.02Å; V255-P265 HydrophobicContact CG2-CG 4.44Å
256	F	87.5	Confident	85.4	Confident	46 Å²	46	79.2 Å²	79.2	20%	0.202	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	145.9	175.4	-68.5	-87.8	0	0	0	110.9	A42 E241 E258	A42-F256 HydrophobicContact CB-CD1 4.4Å; A42-F256 HydrophobicContact CB-CE1 3.48Å; A42-F256 VanDerWaalsContact CB-CE1 3.48Å; A42-F256 HydrophobicContact CB-CE2 3.81Å; A42-F256 HydrophobicContact CB-CZ 3.15Å; E241-F256 HydrophobicContact CG-CD1 3.5Å; E241-F256 VanDerWaalsContact CG-CD1 3.5Å; E241-F256 HydrophobicContact CG-CE1 3.33Å; E241-F256 HydrophobicContact CG-CG 4.34Å; E241-F256 HydrophobicContact CG-CZ 4.05Å; E241-F256 WeakPolarHBondContact OE1-CE1 3.4Å; E241-F256 WeakPolarHBondContact OE1-CZ 3.34Å; F256-E258 PolarHBondContact O-N 3.01Å
257	V	83.3	Confident	85.3	Confident	40 Å²	40	83.5 Å²	83.5	24%	0.242	46%	0.456	C	S	.	.			trans	-80.6	112.3	172.8	-173.2	0	0	0	0	108.8	M239 R240 I262	M239-V257 HydrophobicContact CG-CG2 4.38Å; M239-V257 WeakPolarHBondContact O-CG2 3.28Å; R240-V257 WeakPolarHBondContact O-CG2 3.21Å; R240-V257 PolarHBondContact O-N 3.37Å; V257-I262 HydrophobicContact CB-CG1 4.47Å; V257-I262 HydrophobicContact CG1-CG1 4.11Å; V257-I262 HydrophobicContact CG2-CD1 4.27Å; V257-I262 HydrophobicContact CG2-CG1 3.72Å
258	E	74.9	Confident	85.1	Confident	104 Å²	104	78 Å²	78	49%	0.486	43%	0.427	S	S	.	.	B	Isolated β-bridge	trans	-103.3	125.5	176.6	-67.9	176.1	-171.9	0	0	108.7	R46 F256 G260 Q261	R46-E258 IonicContact NH1-OE1 3.22Å; R46-E258 PolarHBondContact NH1-OE1 3.21Å; F256-E258 PolarHBondContact O-N 3.01Å; E258-G260 PolarHBondContact O-N 3.45Å; E258-Q261 PolarHBondContact N-O 3.27Å; E258-Q261 PolarHBondContact O-N 2.69Å
259	F	70	Confident	84.9	Confident	201 Å²	201	77.1 Å²	77.1	88%	0.882	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.2	35.9	178.2	-55.4	-77.7	0	0	0	114.8	Q261	F259-Q261 PolarHBondContact O-N 3.35Å
260	G	70.3	Confident	84.7	Confident	70 Å²	70	80.7 Å²	80.7	72%	0.722	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	9.1	-179.5	0	0	0	0	0	114.8	E258	E258-G260 PolarHBondContact O-N 3.45Å
261	Q	82.4	Confident	84.5	Confident	142 Å²	142	75.6 Å²	75.6	66%	0.664	43%	0.426	S	S	*	.	B	Isolated β-bridge	trans	-108.8	125.3	175	-62.1	-173.3	15.4	0	0	110.2	E258 F259	E258-Q261 PolarHBondContact N-O 3.27Å; E258-Q261 PolarHBondContact O-N 2.69Å; F259-Q261 PolarHBondContact O-N 3.35Å
262	I	85.8	Confident	84.3	Confident	74 Å²	74	80.9 Å²	80.9	38%	0.379	45%	0.454	S	S	.	.			trans	-93.3	108.9	172	-53.8	172.2	0	0	0	106.6	M239 A242 F244 V257 E264	M239-I262 HydrophobicContact SD-CD1 3.75Å; A242-I262 HydrophobicContact CB-CG2 3.66Å; F244-I262 HydrophobicContact CE2-CG2 4.05Å; F244-I262 HydrophobicContact CZ-CG2 3.8Å; V257-I262 HydrophobicContact CB-CG1 4.47Å; V257-I262 HydrophobicContact CG1-CG1 4.11Å; V257-I262 HydrophobicContact CG2-CD1 4.27Å; V257-I262 HydrophobicContact CG2-CG1 3.72Å; I262-E264 PolarHBondContact O-N 3Å
263	V	86.5	Confident	84.1	Confident	97 Å²	97	78.5 Å²	78.5	59%	0.588	44%	0.437	S	S	*	.			trans	-83	113.7	176.1	-177.8	0	0	0	0	108.7
264	E	86.6	Confident	84	Confident	94 Å²	94	84.2 Å²	84.2	44%	0.439	46%	0.458	S	S	.	.			trans	-72.7	130.7	174.9	-172.8	-174.9	152.5	0	0	110.3	F244 I262 T266	F244-E264 HydrophobicContact CD1-CG 4.46Å; F244-E264 HydrophobicContact CE1-CB 4.43Å; F244-E264 HydrophobicContact CE1-CG 3.96Å; F244-E264 HydrophobicContact CZ-CB 4.36Å; F244-E264 HydrophobicContact CZ-CG 4.33Å; I262-E264 PolarHBondContact O-N 3Å; E264-T266 PolarHBondContact O-N 2.95Å
265	P	84.4	Confident	83.6	Confident	28 Å²	28	85.3 Å²	85.3	18%	0.182	47%	0.469	C	S	.	.			trans	-67	121	174	24.9	-29.5	0	0	0	110.1	F244 V255 L267 F277	F244-P265 HydrophobicContact CB-CG 4.42Å; F244-P265 HydrophobicContact CD2-CG 4.23Å; F244-P265 HydrophobicContact CG-CG 4.29Å; V255-P265 HydrophobicContact CG2-CG 4.44Å; P265-L267 PolarHBondContact O-N 3.35Å; P265-F277 HydrophobicContact CB-CD2 4.06Å; P265-F277 HydrophobicContact CB-CE2 3.85Å; P265-F277 HydrophobicContact CB-CZ 4.47Å; P265-F277 HydrophobicContact CG-CB 4.4Å; P265-F277 HydrophobicContact CG-CD1 4.33Å; P265-F277 HydrophobicContact CG-CD2 3.65Å; P265-F277 HydrophobicContact CG-CE1 4.48Å; P265-F277 HydrophobicContact CG-CE2 3.76Å; P265-F277 HydrophobicContact CG-CG 3.89Å; P265-F277 HydrophobicContact CG-CZ 4.18Å; P265-F277 WeakPolarHBondContact O-CD2 3.27Å
266	T	86.7	Confident	83.5	Confident	100 Å²	100	84.7 Å²	84.7	61%	0.613	47%	0.465	S	S	*	.	S	Bend	trans	-76.3	-22.4	-175	53.5	0	0	0	0	114.2	E264 K274 S275	E264-T266 PolarHBondContact O-N 2.95Å; T266-K274 WeakPolarHBondContact O-CA 3.26Å; T266-S275 PolarHBondContact O-N 2.83Å
267	L	88.4	Confident	83.6	Confident	90 Å²	90	83.2 Å²	83.2	47%	0.471	46%	0.459	S	S	.	.	B	Isolated β-bridge	trans	-128.5	126	-171.9	-71.9	161.5	0	0	0	109.9	P265 K274 F277	P265-L267 PolarHBondContact O-N 3.35Å; L267-K274 HydrophobicContact CD2-CG 3.67Å; L267-F277 WeakPolarHBondContact O-CE2 3.42Å
268	C	85.4	Confident	84	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	47%	0.465	C	S	.	.			trans	-73	126.7	171.7	174.5	0	0	0	0	110.9	C246 C249 S251 N270 C271 N272 S273 F277	C246-C268 HydrophobicContact CB-CB 4.35Å; C249-C268 PolarHBondContact SG-SG 2.98Å; S251-C268 PolarHBondContact OG-SG 3.41Å; C268-N270 VanDerWaalsContact C-N 3.25Å; C268-N270 PolarHBondContact O-N 3.32Å; C268-N270 PolarHBondContact SG-N 2.83Å; C268-C271 VanDerWaalsContact CB-SG 3.58Å; C268-C271 PolarHBondContact SG-SG 2.8Å; C268-N272 VanDerWaalsContact O-CA 3.27Å; C268-N272 WeakPolarHBondContact O-CA 3.31Å; C268-N272 PolarHBondContact O-N 2.76Å; C268-N272 PolarHBondContact O-OD1 2.83Å; C268-S273 PolarHBondContact N-O 2.97Å; C268-S273 VanDerWaalsContact N-O 3.15Å; C268-F277 HydrophobicContact CB-CE2 4Å; C268-F277 HydrophobicContact CB-CZ 4.1Å
269	T	85.8	Confident	84.8	Confident	101 Å²	101	82.7 Å²	82.7	62%	0.62	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-32.4	179.4	51.3	0	0	0	0	113.7
270	N	84.2	Confident	85.8	Confident	121 Å²	121	74.9 Å²	74.9	65%	0.647	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-40	-174.1	-75.3	-1.3	0	0	0	113.5	C268	C268-N270 VanDerWaalsContact C-N 3.25Å; C268-N270 PolarHBondContact O-N 3.32Å; C268-N270 PolarHBondContact SG-N 2.83Å
271	C	84.8	Confident	86.8	Confident	46 Å²	46	74.3 Å²	74.3	31%	0.311	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	-1.6	-175	65.8	0	0	0	0	114.5	C249 C268 S273	C249-C271 HydrophobicContact CB-CB 4.15Å; C268-C271 VanDerWaalsContact CB-SG 3.58Å; C268-C271 PolarHBondContact SG-SG 2.8Å; C271-S273 PolarHBondContact O-N 2.91Å; C271-S273 PolarHBondContact SG-OG 3.45Å
272	N	84.8	Confident	87.3	Confident	125 Å²	125	74.8 Å²	74.8	67%	0.668	42%	0.42	S	S	*	.			trans	52.3	18.2	-178.1	-68.5	-29.1	0	0	0	114.6	C268	C268-N272 VanDerWaalsContact O-CA 3.27Å; C268-N272 WeakPolarHBondContact O-CA 3.31Å; C268-N272 PolarHBondContact O-N 2.76Å; C268-N272 PolarHBondContact O-OD1 2.83Å
273	S	84.9	Confident	87.5	Confident	23 Å²	23	78.9 Å²	78.9	16%	0.161	43%	0.431	C	S	.	.			trans	-75.4	138.2	174.6	63.5	0	0	0	0	109.5	C268 C271 T276	C268-S273 PolarHBondContact N-O 2.97Å; C268-S273 VanDerWaalsContact N-O 3.15Å; C271-S273 PolarHBondContact O-N 2.91Å; C271-S273 PolarHBondContact SG-OG 3.45Å; S273-T276 WeakPolarHBondContact OG-CB 3.43Å; S273-T276 WeakPolarHBondContact OG-CG2 3.2Å; S273-T276 PolarHBondContact OG-OG1 2.96Å
274	K	87.1	Confident	87.8	Confident	162 Å²	162	74.8 Å²	74.8	70%	0.704	41%	0.407	S	S	*	.	B	Isolated β-bridge	trans	-82.6	140.2	177.1	-67.7	179.4	179	-176.7	0	109.6	T266 L267 T276	T266-K274 WeakPolarHBondContact O-CA 3.26Å; L267-K274 HydrophobicContact CD2-CG 3.67Å; K274-T276 PolarHBondContact O-N 3.47Å
275	S	83.5	Confident	88	Confident	96 Å²	96	72.3 Å²	72.3	67%	0.671	40%	0.396	S	S	*	.	S	Bend	trans	51.3	48.4	170.5	62.2	0	0	0	0	114.5	T266	T266-S275 PolarHBondContact O-N 2.83Å
276	T	86.8	Confident	88.3	Confident	19 Å²	19	75 Å²	75	12%	0.117	41%	0.405	C	S	.	.			trans	-110.1	-1.4	179.6	49.3	0	0	0	0	113.9	C246 N247 I248 S273 K274	C246-T276 PolarHBondContact SG-OG1 3.45Å; C246-T276 VanDerWaalsContact SG-OG1 3.34Å; N247-T276 PolarHBondContact N-O 3.19Å; I248-T276 HydrophobicContact CD1-CG2 3.79Å; I248-T276 HydrophobicContact CG1-CG2 4.11Å; S273-T276 WeakPolarHBondContact OG-CB 3.43Å; S273-T276 WeakPolarHBondContact OG-CG2 3.2Å; S273-T276 PolarHBondContact OG-OG1 2.96Å; K274-T276 PolarHBondContact O-N 3.47Å
277	F	89	Confident	88.4	Confident	14 Å²	14	70.5 Å²	70.5	6%	0.061	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	137.7	-179.1	-77.5	-75.1	0	0	0	111.6	F244 E245 C246 P265 L267 C268	F244-F277 HydrophobicContact CB-CB 4.16Å; F244-F277 HydrophobicContact CB-CD1 3.71Å; F244-F277 HydrophobicContact CB-CE1 4.42Å; F244-F277 HydrophobicContact CB-CG 4.21Å; F244-F277 HydrophobicContact CD1-CB 4.12Å; F244-F277 HydrophobicContact CG-CB 4.45Å; E245-F277 WeakPolarHBondContact O-CA 3.41Å; C246-F277 HydrophobicContact CB-CD1 4.13Å; C246-F277 HydrophobicContact CB-CE1 4.03Å; P265-F277 HydrophobicContact CB-CD2 4.06Å; P265-F277 HydrophobicContact CB-CE2 3.85Å; P265-F277 HydrophobicContact CB-CZ 4.47Å; P265-F277 HydrophobicContact CG-CB 4.4Å; P265-F277 HydrophobicContact CG-CD1 4.33Å; P265-F277 HydrophobicContact CG-CD2 3.65Å; P265-F277 HydrophobicContact CG-CE1 4.48Å; P265-F277 HydrophobicContact CG-CE2 3.76Å; P265-F277 HydrophobicContact CG-CG 3.89Å; P265-F277 HydrophobicContact CG-CZ 4.18Å; P265-F277 WeakPolarHBondContact O-CD2 3.27Å; L267-F277 WeakPolarHBondContact O-CE2 3.42Å; C268-F277 HydrophobicContact CB-CE2 4Å; C268-F277 HydrophobicContact CB-CZ 4.1Å
278	V	90.9	Very high	88.6	Confident	62 Å²	62	69.2 Å²	69.2	38%	0.376	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	132.6	173.4	176.5	0	0	0	0	108.1	F244 E245 N247 V280	F244-V278 CarbonylContact C-O 3.59Å; F244-V278 WeakPolarHBondContact CA-O 3.22Å; E245-V278 PolarHBondContact N-O 3.46Å; E245-V278 PolarHBondContact O-N 3.38Å; N247-V278 WeakPolarHBondContact ND2-CG2 3.42Å; N247-V278 VanDerWaalsContact OD1-CG2 3.26Å; N247-V278 WeakPolarHBondContact OD1-CG2 3.37Å; V278-V280 PolarHBondContact O-N 2.98Å
279	L	91.9	Very high	88.8	Confident	71 Å²	71	71.6 Å²	71.6	37%	0.372	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	121.1	174.1	179.8	67.1	0	0	0	110	M239 A242 F244	M239-L279 HydrophobicContact CE-CD2 4.26Å; M239-L279 HydrophobicContact SD-CD1 4.41Å; A242-L279 HydrophobicContact CB-CD1 3.66Å; F244-L279 HydrophobicContact CD1-CB 4.16Å; F244-L279 HydrophobicContact CD1-CD1 4.41Å; F244-L279 HydrophobicContact CE1-CB 3.89Å; F244-L279 HydrophobicContact CE1-CD1 4.09Å; F244-L279 HydrophobicContact CZ-CD1 4.16Å
280	V	92.2	Very high	89	Confident	37 Å²	37	67 Å²	67	22%	0.224	35%	0.352	C	S	.	.			trans	-100.6	92.6	173.9	-173.5	0	0	0	0	108.9	F243 E245 V278 N282 R283 S284	F243-V280 HydrophobicContact CD1-CB 3.9Å; F243-V280 HydrophobicContact CD1-CG2 4.19Å; F243-V280 HydrophobicContact CE1-CG2 4.49Å; F243-V280 PolarHBondContact O-N 3.24Å; E245-V280 HydrophobicContact CB-CG2 3.9Å; V278-V280 PolarHBondContact O-N 2.98Å; V280-N282 PolarHBondContact O-N 3.2Å; V280-N282 VanDerWaalsContact O-N 3.16Å; V280-R283 HydrophobicContact CG1-CB 4.31Å; V280-R283 HydrophobicContact CG1-CG 4.2Å; V280-R283 PolarHBondContact O-N 3.15Å; V280-R283 VanDerWaalsContact O-N 3.11Å; V280-S284 PolarHBondContact O-N 3.03Å
281	S	90.3	Very high	89.4	Confident	59 Å²	59	61.5 Å²	61.5	41%	0.413	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-25.7	-176.8	61.1	0	0	0	0	114.4	R283 S284 F286	S281-R283 PolarHBondContact O-N 3.36Å; S281-S284 VanDerWaalsContact C-OG 3.32Å; S281-S284 WeakPolarHBondContact CA-OG 3.46Å; S281-S284 PolarHBondContact O-OG 3.23Å; S281-F286 WeakPolarHBondContact O-CE2 3.03Å; S281-F286 WeakPolarHBondContact O-CZ 3.49Å
282	N	92.6	Very high	89.8	Confident	151 Å²	151	59.3 Å²	59.3	81%	0.807	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-15.7	-179.1	-66.2	-12.5	0	0	0	112.7	V280	V280-N282 PolarHBondContact O-N 3.2Å; V280-N282 VanDerWaalsContact O-N 3.16Å
283	R	91.4	Very high	90.1	Very high	161 Å²	161	55.7 Å²	55.7	61%	0.608	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	-6.3	178.9	-70.2	-172.9	175.5	-178.3	0.3	113.2	F243 V280 S281	F243-R283 HydrophobicContact CB-CB 3.93Å; F243-R283 HydrophobicContact CD1-CB 3.84Å; F243-R283 HydrophobicContact CD2-CB 4.13Å; F243-R283 HydrophobicContact CE1-CB 4.34Å; F243-R283 HydrophobicContact CG-CB 3.7Å; V280-R283 HydrophobicContact CG1-CB 4.31Å; V280-R283 HydrophobicContact CG1-CG 4.2Å; V280-R283 PolarHBondContact O-N 3.15Å; V280-R283 VanDerWaalsContact O-N 3.11Å; S281-R283 PolarHBondContact O-N 3.36Å
284	S	91	Very high	90.4	Very high	11 Å²	11	54.7 Å²	54.7	8%	0.077	28%	0.279	C	S	.	.	S	Bend	trans	-69.2	150.6	171.3	44.2	0	0	0	0	111.1	E241 V280 S281 F286	E241-S284 CarbonylContact O-C 3.43Å; E241-S284 WeakPolarHBondContact O-CA 3.22Å; E241-S284 WeakPolarHBondContact O-CB 3.33Å; V280-S284 PolarHBondContact O-N 3.03Å; S281-S284 VanDerWaalsContact C-OG 3.32Å; S281-S284 WeakPolarHBondContact CA-OG 3.46Å; S281-S284 PolarHBondContact O-OG 3.23Å; S284-F286 WeakPolarHBondContact O-CD2 2.77Å; S284-F286 WeakPolarHBondContact O-CE2 3.46Å; S284-F286 WeakPolarHBondContact OG-CE2 3.28Å; S284-F286 WeakPolarHBondContact OG-CZ 3.23Å
285	I	91.8	Very high	90.6	Very high	42 Å²	42	48.8 Å²	48.8	22%	0.215	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	132.7	174.4	-54.7	-173.7	0	0	0	108.2	R240 E241	R240-I285 PolarHBondContact N-O 3.27Å; E241-I285 HydrophobicContact CB-CB 4Å; E241-I285 HydrophobicContact CB-CD1 4.46Å; E241-I285 HydrophobicContact CB-CG1 4.17Å; E241-I285 HydrophobicContact CG-CB 4.39Å; E241-I285 HydrophobicContact CG-CD1 4.39Å; E241-I285 PolarHBondContact N-O 3.18Å; E241-I285 PolarHBondContact O-N 3.01Å; E241-I285 WeakPolarHBondContact OE2-CD1 3.43Å
286	F	90.7	Very high	90.8	Very high	84 Å²	84	44.4 Å²	44.4	37%	0.368	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	141.7	177	-59.3	-90.5	0	0	0	110	P237 E238 M239 S281 S284	P237-F286 HydrophobicContact CB-CB 4.03Å; P237-F286 HydrophobicContact CB-CD1 4.07Å; P237-F286 HydrophobicContact CB-CG 4.17Å; E238-F286 CarbonylContact O-C 3.5Å; E238-F286 WeakPolarHBondContact O-CA 3.41Å; M239-F286 HydrophobicContact CB-CD1 4Å; M239-F286 HydrophobicContact CB-CE1 3.94Å; M239-F286 HydrophobicContact CE-CE1 3.72Å; M239-F286 HydrophobicContact CE-CZ 3.89Å; M239-F286 HydrophobicContact CG-CE1 4.26Å; S281-F286 WeakPolarHBondContact O-CE2 3.03Å; S281-F286 WeakPolarHBondContact O-CZ 3.49Å; S284-F286 WeakPolarHBondContact O-CD2 2.77Å; S284-F286 WeakPolarHBondContact O-CE2 3.46Å; S284-F286 WeakPolarHBondContact OG-CE2 3.28Å; S284-F286 WeakPolarHBondContact OG-CZ 3.23Å
287	G	89.2	Confident	90.6	Very high	5 Å²	5	44.2 Å²	44.2	5%	0.052	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	159.3	162.2	0	0	0	0	0	110.8	P237 E238	P237-G287 WeakPolarHBondContact CA-O 3.47Å; E238-G287 PolarHBondContact N-O 2.87Å; E238-G287 PolarHBondContact O-N 3.47Å
288	D	91.4	Very high	90	Very high	64 Å²	64	45.4 Å²	45.4	34%	0.342	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	126.3	179	-70.9	-35.1	0	0	0	109.4	D316 V319	D288-D316 PolarHBondContact N-OD1 3.15Å; D288-D316 PolarHBondContact O-N 3.02Å; D288-V319 HydrophobicContact CB-CG2 4.39Å
289	R	90.6	Very high	89.2	Confident	50 Å²	50	47.4 Å²	47.4	19%	0.189	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	133.8	174.5	-177	167.7	60.2	88.5	8	110.6	I236 E238 L314 L315	I236-R289 WeakPolarHBondContact CA-O 3.33Å; I236-R289 WeakPolarHBondContact CB-O 3.46Å; I236-R289 PolarHBondContact N-O 3.33Å; I236-R289 PolarHBondContact O-N 3.43Å; E238-R289 WeakPolarHBondContact OE2-CD 3.38Å; E238-R289 IonicContact OE2-NE 2.72Å; E238-R289 PolarHBondContact OE2-NE 3.36Å; R289-L314 WeakPolarHBondContact CA-O 3.26Å; R289-L315 HydrophobicContact CB-CD2 4.14Å; R289-L315 HydrophobicContact CG-CD2 4Å
290	Q	90.7	Very high	88.6	Confident	3 Å²	3	48.5 Å²	48.5	1%	0.014	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	142.4	174.7	-179.6	176.7	48.2	0	0	110.3	T233 V292 Y313 L314 V319 D320	T233-Q290 WeakPolarHBondContact O-CG 3.32Å; T233-Q290 PolarHBondContact O-NE2 2.95Å; Q290-V292 HydrophobicContact CG-CG2 4.32Å; Q290-Y313 WeakPolarHBondContact O-CA 3.45Å; Q290-L314 HydrophobicContact CB-CB 4.36Å; Q290-L314 PolarHBondContact N-O 2.87Å; Q290-L314 PolarHBondContact O-N 3.18Å; Q290-V319 HydrophobicContact CB-CB 4.41Å; Q290-V319 HydrophobicContact CB-CG1 3.63Å; Q290-V319 HydrophobicContact CB-CG2 4.14Å; Q290-V319 HydrophobicContact CG-CG1 4.39Å; Q290-D320 PolarHBondContact NE2-OD1 3.23Å
291	I	92.2	Very high	88	Confident	6 Å²	6	49.2 Å²	49.2	3%	0.031	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	121.4	-179.9	-53.8	177.9	0	0	0	108.1	T233 I236 Y313 E489	T233-I291 HydrophobicContact CG2-CB 3.96Å; T233-I291 PolarHBondContact N-O 3.33Å; T233-I291 PolarHBondContact OG1-N 2.98Å; T233-I291 PolarHBondContact OG1-O 2.95Å; I236-I291 HydrophobicContact CD1-CD1 3.94Å; I236-I291 HydrophobicContact CD1-CG1 4.28Å; I291-Y313 HydrophobicContact CB-CD1 4.21Å; I291-Y313 HydrophobicContact CB-CE1 4.24Å; I291-Y313 HydrophobicContact CD1-CD1 4.37Å; I291-Y313 HydrophobicContact CD1-CE1 3.78Å; I291-Y313 HydrophobicContact CG1-CD1 3.73Å; I291-Y313 HydrophobicContact CG1-CE1 3.65Å; I291-Y313 HydrophobicContact CG2-CD1 3.97Å; I291-Y313 HydrophobicContact CG2-CE1 3.76Å; I291-E489 WeakPolarHBondContact CD1-OE2 3.19Å
292	V	92	Very high	87.6	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	135.5	178.5	-178.9	0	0	0	0	108.6	V229 A232 Q290 L294 V312 L314	V229-V292 HydrophobicContact CB-CG1 4.41Å; V229-V292 HydrophobicContact CG1-CG1 3.48Å; V229-V292 VanDerWaalsContact CG1-CG1 3.48Å; V229-V292 HydrophobicContact CG2-CG1 4.18Å; A232-V292 HydrophobicContact CB-CG2 4.18Å; Q290-V292 HydrophobicContact CG-CG2 4.32Å; V292-L294 HydrophobicContact CG1-CD2 3.94Å; V292-V312 PolarHBondContact N-O 2.88Å; V292-V312 PolarHBondContact O-N 3.43Å; V292-L314 HydrophobicContact CG2-CD1 3.56Å; V292-L314 HydrophobicContact CG2-CG 3.95Å
293	K	91.7	Very high	87.1	Confident	48 Å²	48	47.5 Å²	47.5	21%	0.209	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	122.7	171	-71.6	-158.3	173.5	166.2	0	110.3	I230 R231	I230-K293 PolarHBondContact N-O 3.38Å; R231-K293 HydrophobicContact CG-CB 3.88Å; R231-K293 HydrophobicContact CG-CG 4.22Å; R231-K293 VanDerWaalsContact NE-CD 3.31Å; R231-K293 PolarHBondContact O-N 3.11Å
294	L	91.8	Very high	86.7	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	150.8	174.6	-56.7	-175.5	0	0	0	110.9	M211 M228 V229 V292 S309 V310 V312 I328 V330	M211-L294 HydrophobicContact CE-CB 3.78Å; M228-L294 CarbonylContact O-C 3.55Å; M228-L294 WeakPolarHBondContact O-CA 3.49Å; V229-L294 HydrophobicContact CB-CD2 4.18Å; V229-L294 HydrophobicContact CG2-CD2 3.38Å; V292-L294 HydrophobicContact CG1-CD2 3.94Å; L294-S309 CarbonylContact O-C 3.54Å; L294-S309 WeakPolarHBondContact O-CA 3.39Å; L294-S309 WeakPolarHBondContact O-CB 3.3Å; L294-V310 PolarHBondContact N-O 3Å; L294-V310 PolarHBondContact O-N 3.4Å; L294-V312 HydrophobicContact CD1-CG2 3.47Å; L294-V312 VanDerWaalsContact CD1-CG2 3.47Å; L294-V312 HydrophobicContact CG-CG2 3.77Å; L294-I328 HydrophobicContact CD1-CD1 4.07Å; L294-I328 HydrophobicContact CD1-CG1 4.28Å; L294-I328 HydrophobicContact CD2-CD1 3.53Å; L294-I328 HydrophobicContact CD2-CG1 3.89Å; L294-I328 HydrophobicContact CG-CD1 4.43Å; L294-V330 HydrophobicContact CD1-CB 4.36Å; L294-V330 HydrophobicContact CD1-CG2 3.64Å
295	Q	90.2	Very high	86.5	Confident	38 Å²	38	48.7 Å²	48.7	18%	0.178	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	147.2	172.5	-158.2	176.2	-41	0	0	109.7	M211 G227 M228 I230 P307	M211-Q295 WeakPolarHBondContact CE-O 3.35Å; G227-Q295 CarbonylContact C-O 3.56Å; G227-Q295 WeakPolarHBondContact CA-O 3.27Å; M228-Q295 HydrophobicContact CE-CB 3.83Å; M228-Q295 HydrophobicContact CE-CG 3.79Å; M228-Q295 HydrophobicContact CG-CB 3.79Å; M228-Q295 PolarHBondContact N-O 3.02Å; M228-Q295 PolarHBondContact O-N 3.49Å; I230-Q295 HydrophobicContact CD1-CB 3.74Å; I230-Q295 HydrophobicContact CD1-CG 4.07Å; I230-Q295 VanDerWaalsContact CD1-OE1 3.3Å; I230-Q295 HydrophobicContact CG1-CB 3.72Å; I230-Q295 HydrophobicContact CG1-CG 4.46Å; Q295-P307 HydrophobicContact CG-CB 3.6Å; Q295-P307 HydrophobicContact CG-CG 4.2Å
296	E	87.7	Confident	86.2	Confident	4 Å²	4	50.4 Å²	50.4	2%	0.019	30%	0.295	C	S	.	.			trans	-54.8	148.9	167.9	-63.6	174.5	165.9	0	0	110.9	M211 R212 M301 L308	M211-E296 HydrophobicContact CB-CG 3.68Å; M211-E296 WeakPolarHBondContact CB-OE1 3.34Å; M211-E296 HydrophobicContact CE-CG 4.46Å; M211-E296 HydrophobicContact CG-CG 3.62Å; M211-E296 HydrophobicContact SD-CB 4.43Å; M211-E296 HydrophobicContact SD-CG 3.56Å; M211-E296 VanDerWaalsContact SD-CG 3.56Å; M211-E296 PolarHBondContact SD-N 3.01Å; R212-E296 WeakPolarHBondContact CG-OE1 3.31Å; R212-E296 IonicContact CZ-OE2 3.18Å; R212-E296 PolarHBondContact N-OE1 3.47Å; R212-E296 IonicContact NE-OE1 2.64Å; R212-E296 IonicContact NE-OE2 3.49Å; R212-E296 PolarHBondContact NE-OE2 2.98Å; R212-E296 VanDerWaalsContact NE-OE2 3.1Å; R212-E296 IonicContact NH2-OE2 3.36Å; R212-E296 PolarHBondContact NH2-OE2 3.36Å; E296-M301 HydrophobicContact CB-CG 4.45Å; E296-L308 HydrophobicContact CG-CB 4.48Å; E296-L308 PolarHBondContact N-O 3.03Å
297	F	82.5	Confident	86	Confident	16 Å²	16	48.8 Å²	48.8	7%	0.07	29%	0.293	C	S	.	.			trans	-66.4	145.4	170.8	-66.8	-41.1	0	0	0	110.8	N226 M228 D299 E300 M301 R327 L364	N226-F297 HydrophobicContact CB-CD2 4.16Å; N226-F297 HydrophobicContact CB-CE2 3.59Å; N226-F297 HydrophobicContact CB-CZ 4.26Å; M228-F297 HydrophobicContact CB-CD1 4.27Å; M228-F297 HydrophobicContact CB-CE1 4.17Å; F297-D299 PolarHBondContact O-N 2.85Å; F297-D299 VanDerWaalsContact O-N 3.11Å; F297-E300 PolarHBondContact O-N 3.43Å; F297-E300 VanDerWaalsContact O-N 3.17Å; F297-M301 WeakPolarHBondContact O-CG 3.18Å; F297-R327 HydrophobicContact CE1-CB 3.76Å; F297-R327 HydrophobicContact CE1-CG 3.69Å; F297-R327 HydrophobicContact CZ-CB 3.91Å; F297-R327 HydrophobicContact CZ-CG 4.29Å; F297-L364 HydrophobicContact CE2-CD1 4Å; F297-L364 HydrophobicContact CZ-CD1 3.68Å
298	P	76.9	Confident	86.1	Confident	39 Å²	39	52 Å²	52	25%	0.253	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-24.4	178.2	25.8	-34.8	0	0	0	113
299	D	75.6	Confident	86.1	Confident	104 Å²	104	52.2 Å²	52.2	56%	0.556	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-30.5	-179.3	-58.2	-34.9	0	0	0	112.9	F297 M301	F297-D299 PolarHBondContact O-N 2.85Å; F297-D299 VanDerWaalsContact O-N 3.11Å; D299-M301 VanDerWaalsContact C-N 3.33Å
300	E	77.5	Confident	86.1	Confident	93 Å²	93	50.9 Å²	50.9	44%	0.435	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-3.7	179.8	-65.9	175.7	-175.3	0	0	112.3	F297	F297-E300 PolarHBondContact O-N 3.43Å; F297-E300 VanDerWaalsContact O-N 3.17Å
301	M	79.8	Confident	86.2	Confident	52 Å²	52	51.5 Å²	51.5	26%	0.256	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-76.9	129.4	-176.3	-73.7	176.9	59.1	0	0	111.8	E296 F297 D299 Q305 P307	E296-M301 HydrophobicContact CB-CG 4.45Å; F297-M301 WeakPolarHBondContact O-CG 3.18Å; D299-M301 VanDerWaalsContact C-N 3.33Å; M301-Q305 WeakPolarHBondContact CE-O 3.42Å; M301-P307 HydrophobicContact CE-CB 3.81Å; M301-P307 HydrophobicContact CE-CG 4.08Å; M301-P307 HydrophobicContact SD-CB 3.73Å; M301-P307 HydrophobicContact SD-CG 4.37Å
302	P	82.8	Confident	86.3	Confident	42 Å²	42	51.3 Å²	51.3	27%	0.273	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-67	139.2	167.8	26.6	-30.9	0	0	0	110.2	G304 Q305	P302-G304 PolarHBondContact O-N 2.94Å; P302-Q305 HydrophobicContact CG-CB 4.16Å; P302-Q305 HydrophobicContact CG-CG 4.17Å; P302-Q305 PolarHBondContact O-N 2.87Å
303	P	82.6	Confident	86.5	Confident	132 Å²	132	52 Å²	52	86%	0.857	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	135.2	-177.1	24.7	-33.7	0	0	0	111.4
304	G	82.2	Confident	86.6	Confident	91 Å²	91	49.9 Å²	49.9	94%	0.938	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.3	-4	176.4	0	0	0	0	0	115.8	P302	P302-G304 PolarHBondContact O-N 2.94Å
305	Q	86.8	Confident	86.5	Confident	106 Å²	106	51.8 Å²	51.8	50%	0.495	32%	0.32	S	S	.	.	S	Bend	trans	-98.5	145.6	174.1	-59.9	-172.6	9.3	0	0	111.3	M301 P302	M301-Q305 WeakPolarHBondContact CE-O 3.42Å; P302-Q305 HydrophobicContact CG-CB 4.16Å; P302-Q305 HydrophobicContact CG-CG 4.17Å; P302-Q305 PolarHBondContact O-N 2.87Å
306	A	86.1	Confident	86.2	Confident	78 Å²	78	51.8 Å²	51.8	65%	0.645	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-68.8	145.1	170.6	0	0	0	0	0	109.9	R212 L308	R212-A306 PolarHBondContact NH2-O 3.02Å; A306-L308 PolarHBondContact O-N 3.22Å
307	P	86.7	Confident	86.1	Confident	50 Å²	50	54.3 Å²	54.3	33%	0.325	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-63.5	134.3	177.1	23.4	-29	0	0	0	110.2	Q295 M301	Q295-P307 HydrophobicContact CG-CB 3.6Å; Q295-P307 HydrophobicContact CG-CG 4.2Å; M301-P307 HydrophobicContact CE-CB 3.81Å; M301-P307 HydrophobicContact CE-CG 4.08Å; M301-P307 HydrophobicContact SD-CB 3.73Å; M301-P307 HydrophobicContact SD-CG 4.37Å
308	L	89.9	Confident	86.3	Confident	74 Å²	74	54.1 Å²	54.1	39%	0.387	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-76.9	153.5	172.5	-62.6	-176.6	0	0	0	110.1	R212 E296 A306	R212-L308 HydrophobicContact CB-CD1 4.43Å; R212-L308 HydrophobicContact CG-CD1 3.83Å; E296-L308 HydrophobicContact CG-CB 4.48Å; E296-L308 PolarHBondContact N-O 3.03Å; A306-L308 PolarHBondContact O-N 3.22Å
309	S	91.1	Very high	86.9	Confident	68 Å²	68	53.2 Å²	53.2	48%	0.476	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	134.8	176.5	69.3	0	0	0	0	110.9	L294	L294-S309 CarbonylContact O-C 3.54Å; L294-S309 WeakPolarHBondContact O-CA 3.39Å; L294-S309 WeakPolarHBondContact O-CB 3.3Å
310	V	92	Very high	87.4	Confident	21 Å²	21	53 Å²	53	13%	0.127	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	140.8	177.3	179.2	0	0	0	0	109.6	M211 L294 I356	M211-V310 HydrophobicContact CB-CG2 4.04Å; M211-V310 HydrophobicContact CG-CG2 4.08Å; M211-V310 HydrophobicContact SD-CB 4.3Å; M211-V310 HydrophobicContact SD-CG2 3.79Å; L294-V310 PolarHBondContact N-O 3Å; L294-V310 PolarHBondContact O-N 3.4Å; V310-I356 HydrophobicContact CG1-CD1 3.65Å; V310-I356 HydrophobicContact CG1-CG1 3.96Å
311	S	93.3	Very high	87.8	Confident	17 Å²	17	52.6 Å²	52.6	12%	0.119	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	126.7	174	-53.9	0	0	0	0	109.4	F355 I356	S311-F355 VanDerWaalsContact O-CA 3.31Å; S311-F355 WeakPolarHBondContact O-CA 3.47Å; S311-F355 WeakPolarHBondContact O-CB 3.49Å; S311-I356 PolarHBondContact O-N 2.89Å
312	V	94.3	Very high	88.1	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.006	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	132.1	176.4	-176.8	0	0	0	0	108.8	V292 L294 L314 V330 I356 A358	V292-V312 PolarHBondContact N-O 2.88Å; V292-V312 PolarHBondContact O-N 3.43Å; L294-V312 HydrophobicContact CD1-CG2 3.47Å; L294-V312 VanDerWaalsContact CD1-CG2 3.47Å; L294-V312 HydrophobicContact CG-CG2 3.77Å; V312-L314 HydrophobicContact CG1-CD2 3.92Å; V312-V330 HydrophobicContact CG1-CG1 3.92Å; V312-I356 CarbonylContact C-O 3.55Å; V312-I356 VanDerWaalsContact CA-O 3.3Å; V312-I356 WeakPolarHBondContact CA-O 3.46Å; V312-I356 HydrophobicContact CG2-CB 4.25Å; V312-A358 HydrophobicContact CG1-CB 3.69Å
313	Y	94.3	Very high	88.2	Confident	17 Å²	17	53.6 Å²	53.6	7%	0.067	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	131.1	172.5	-67.3	-7	0	0	0	109.3	Q290 I291 F355 I356 A358	Q290-Y313 WeakPolarHBondContact O-CA 3.45Å; I291-Y313 HydrophobicContact CB-CD1 4.21Å; I291-Y313 HydrophobicContact CB-CE1 4.24Å; I291-Y313 HydrophobicContact CD1-CD1 4.37Å; I291-Y313 HydrophobicContact CD1-CE1 3.78Å; I291-Y313 HydrophobicContact CG1-CD1 3.73Å; I291-Y313 HydrophobicContact CG1-CE1 3.65Å; I291-Y313 HydrophobicContact CG2-CD1 3.97Å; I291-Y313 HydrophobicContact CG2-CE1 3.76Å; Y313-F355 AromaticContact CD2-CD2 3.43Å; Y313-F355 HydrophobicContact CD2-CD2 3.43Å; Y313-F355 VanDerWaalsContact CD2-CD2 3.43Å; Y313-F355 AromaticContact CD2-CE2 3.51Å; Y313-F355 HydrophobicContact CD2-CE2 3.51Å; Y313-F355 HydrophobicContact CD2-CG 4.26Å; Y313-F355 HydrophobicContact CD2-CZ 4.4Å; Y313-F355 HydrophobicContact CE2-CD1 4.43Å; Y313-F355 AromaticContact CE2-CD2 3.56Å; Y313-F355 HydrophobicContact CE2-CD2 3.56Å; Y313-F355 AromaticContact CE2-CE2 3.65Å; Y313-F355 HydrophobicContact CE2-CE2 3.65Å; Y313-F355 AromaticContact CE2-CG 3.96Å; Y313-F355 HydrophobicContact CE2-CG 3.96Å; Y313-F355 HydrophobicContact CE2-CZ 4.15Å; Y313-F355 AromaticContact CG-CD2 3.96Å; Y313-F355 HydrophobicContact CG-CD2 3.96Å; Y313-F355 HydrophobicContact CG-CE2 4.41Å; Y313-I356 PolarHBondContact N-O 3.33Å; Y313-A358 WeakPolarHBondContact O-CB 3.48Å; Y313-A358 PolarHBondContact O-N 3.14Å
314	L	93.6	Very high	88.2	Confident	2 Å²	2	49 Å²	49	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	134.5	173.9	-52.8	-172	0	0	0	108.1	R289 Q290 V292 V312 M318 V319 V322 A358 I361	R289-L314 WeakPolarHBondContact CA-O 3.26Å; Q290-L314 HydrophobicContact CB-CB 4.36Å; Q290-L314 PolarHBondContact N-O 2.87Å; Q290-L314 PolarHBondContact O-N 3.18Å; V292-L314 HydrophobicContact CG2-CD1 3.56Å; V292-L314 HydrophobicContact CG2-CG 3.95Å; V312-L314 HydrophobicContact CG1-CD2 3.92Å; L314-M318 HydrophobicContact CB-CB 4.25Å; L314-M318 WeakPolarHBondContact CD1-O 3.41Å; L314-V319 HydrophobicContact CB-CG2 4.3Å; L314-V322 HydrophobicContact CD1-CG2 4.46Å; L314-A358 HydrophobicContact CD2-CB 3.46Å; L314-A358 VanDerWaalsContact CD2-CB 3.46Å; L314-I361 HydrophobicContact CD1-CD1 3.79Å; L314-I361 HydrophobicContact CD2-CD1 3.42Å; L314-I361 VanDerWaalsContact CD2-CD1 3.42Å; L314-I361 HydrophobicContact CD2-CG1 4.26Å; L314-I361 HydrophobicContact CG-CD1 4.24Å
315	L	90.3	Very high	88	Confident	42 Å²	42	45.5 Å²	45.5	22%	0.22	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	141.3	-178.6	-62.6	172.4	0	0	0	110.4	R289 S317 M318 D357	R289-L315 HydrophobicContact CB-CD2 4.14Å; R289-L315 HydrophobicContact CG-CD2 4Å; L315-S317 PolarHBondContact O-N 3.19Å; L315-M318 PolarHBondContact O-N 3.02Å; L315-M318 VanDerWaalsContact O-N 3.07Å; L315-D357 WeakPolarHBondContact CD1-OD1 3.5Å
316	D	84.7	Confident	87.8	Confident	38 Å²	38	40.6 Å²	40.6	20%	0.203	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	40.5	-103.3	174.5	-60.8	-21.6	0	0	0	114.9	R240 D288 M318 V319	R240-D316 IonicContact CZ-OD1 3.14Å; R240-D316 IonicContact CZ-OD2 2.62Å; R240-D316 IonicContact NH1-OD1 3.23Å; R240-D316 IonicContact NH1-OD2 3.62Å; R240-D316 PolarHBondContact NH1-OD2 3.1Å; R240-D316 IonicContact NH2-OD1 3.69Å; R240-D316 PolarHBondContact NH2-OD1 2.88Å; R240-D316 VanDerWaalsContact NH2-OD1 3.14Å; R240-D316 IonicContact NH2-OD2 2.77Å; R240-D316 PolarHBondContact NH2-OD2 3.03Å; D288-D316 PolarHBondContact N-OD1 3.15Å; D288-D316 PolarHBondContact O-N 3.02Å; D316-M318 PolarHBondContact O-N 3.46Å; D316-M318 VanDerWaalsContact O-N 3.13Å; D316-V319 VanDerWaalsContact O-CB 3.29Å; D316-V319 WeakPolarHBondContact O-CB 3.49Å; D316-V319 VanDerWaalsContact O-CG2 3.32Å; D316-V319 WeakPolarHBondContact O-CG2 3.26Å; D316-V319 PolarHBondContact O-N 3.07Å; D316-V319 VanDerWaalsContact O-N 3.11Å
317	S	85.4	Confident	87.6	Confident	58 Å²	58	38.1 Å²	38.1	41%	0.406	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-64.5	-18.5	-172.5	57.3	0	0	0	0	113.6	K201 L315	K201-S317 PolarHBondContact NZ-OG 3.41Å; L315-S317 PolarHBondContact O-N 3.19Å
318	M	85.7	Confident	87.8	Confident	12 Å²	12	35.9 Å²	35.9	6%	0.059	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-90.2	-6.1	179.4	-67.5	-177.8	-70.6	0	0	114.1	L314 L315 D316 L321 A358 I361	L314-M318 HydrophobicContact CB-CB 4.25Å; L314-M318 WeakPolarHBondContact CD1-O 3.41Å; L315-M318 PolarHBondContact O-N 3.02Å; L315-M318 VanDerWaalsContact O-N 3.07Å; D316-M318 PolarHBondContact O-N 3.46Å; D316-M318 VanDerWaalsContact O-N 3.13Å; M318-L321 HydrophobicContact CB-CD1 4.25Å; M318-L321 HydrophobicContact CG-CD1 4.33Å; M318-L321 WeakPolarHBondContact O-CB 3.37Å; M318-L321 WeakPolarHBondContact O-CG 3.3Å; M318-L321 PolarHBondContact O-N 3Å; M318-A358 HydrophobicContact CE-CB 4.47Å; M318-A358 WeakPolarHBondContact CE-O 3.44Å; M318-A358 HydrophobicContact SD-CB 4.43Å; M318-I361 HydrophobicContact CB-CD1 4.38Å; M318-I361 HydrophobicContact SD-CG1 4.45Å
319	V	89.5	Confident	87.8	Confident	20 Å²	20	33.2 Å²	33.2	12%	0.121	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	142.1	-175.3	-178.8	0	0	0	0	110.6	L235 D288 Q290 L314 D316 L321	L235-V319 HydrophobicContact CD2-CB 4.34Å; L235-V319 HydrophobicContact CD2-CG1 2.97Å; L235-V319 HydrophobicContact CG-CG1 4.47Å; D288-V319 HydrophobicContact CB-CG2 4.39Å; Q290-V319 HydrophobicContact CB-CB 4.41Å; Q290-V319 HydrophobicContact CB-CG1 3.63Å; Q290-V319 HydrophobicContact CB-CG2 4.14Å; Q290-V319 HydrophobicContact CG-CG1 4.39Å; L314-V319 HydrophobicContact CB-CG2 4.3Å; D316-V319 VanDerWaalsContact O-CB 3.29Å; D316-V319 WeakPolarHBondContact O-CB 3.49Å; D316-V319 VanDerWaalsContact O-CG2 3.32Å; D316-V319 WeakPolarHBondContact O-CG2 3.26Å; D316-V319 PolarHBondContact O-N 3.07Å; D316-V319 VanDerWaalsContact O-N 3.11Å; V319-L321 PolarHBondContact O-N 3.1Å
320	D	87.1	Confident	87.9	Confident	99 Å²	99	30.1 Å²	30.1	53%	0.529	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	10.5	-174.1	-71.7	-20.8	0	0	0	115.1	Q290 V322	Q290-D320 PolarHBondContact NE2-OD1 3.23Å; D320-V322 VanDerWaalsContact C-N 3.27Å; D320-V322 PolarHBondContact O-N 3.17Å
321	L	86.3	Confident	87.9	Confident	85 Å²	85	29.1 Å²	29.1	45%	0.445	16%	0.163	S	C	.	.			trans	-67.1	-31.5	171.5	-70.2	-174.5	0	0	0	111.6	M318 V319 K363	M318-L321 HydrophobicContact CB-CD1 4.25Å; M318-L321 HydrophobicContact CG-CD1 4.33Å; M318-L321 WeakPolarHBondContact O-CB 3.37Å; M318-L321 WeakPolarHBondContact O-CG 3.3Å; M318-L321 PolarHBondContact O-N 3Å; V319-L321 PolarHBondContact O-N 3.1Å; L321-K363 WeakPolarHBondContact O-CE 3.27Å; L321-K363 PolarHBondContact O-NZ 3.22Å
322	V	86.3	Confident	87.9	Confident	3 Å²	3	28.3 Å²	28.3	2%	0.018	16%	0.158	C	C	.	.			trans	-109.8	131.8	-168.2	-178.5	0	0	0	0	111.2	V229 L314 D320 D326 I328 I361	V229-V322 HydrophobicContact CB-CG1 4.01Å; V229-V322 HydrophobicContact CG1-CG1 4.03Å; V229-V322 HydrophobicContact CG2-CG1 3.2Å; L314-V322 HydrophobicContact CD1-CG2 4.46Å; D320-V322 VanDerWaalsContact C-N 3.27Å; D320-V322 PolarHBondContact O-N 3.17Å; V322-D326 HydrophobicContact CG1-CB 4.49Å; V322-I328 HydrophobicContact CG1-CD1 4.21Å; V322-I328 HydrophobicContact CG1-CG2 4.15Å; V322-I328 HydrophobicContact CG2-CD1 4.28Å; V322-I328 HydrophobicContact CG2-CG2 4.38Å; V322-I361 HydrophobicContact CG2-CD1 3.68Å; V322-I361 HydrophobicContact CG2-CG2 3.88Å
323	M	83	Confident	87.8	Confident	112 Å²	112	28.6 Å²	28.6	55%	0.552	16%	0.159	S	C	*	.			trans	-101.9	149.9	173.8	-62.3	-60.2	-71.2	0	0	110.7	G325 D326	M323-G325 PolarHBondContact O-N 3.07Å; M323-D326 PolarHBondContact N-OD2 3.3Å; M323-D326 WeakPolarHBondContact O-CB 3.31Å; M323-D326 PolarHBondContact O-N 2.6Å; M323-D326 VanDerWaalsContact O-N 3.16Å
324	P	83.2	Confident	87.8	Confident	34 Å²	34	28.9 Å²	28.9	22%	0.221	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	138.7	170.7	23.7	-31.5	0	0	0	110.7	I497	P324-I497 VanDerWaalsContact C-CD1 3.48Å; P324-I497 HydrophobicContact CB-CD1 3.66Å; P324-I497 HydrophobicContact CB-CG1 4.05Å; P324-I497 HydrophobicContact CG-CD1 3.87Å; P324-I497 HydrophobicContact CG-CG1 4.37Å; P324-I497 WeakPolarHBondContact O-CD1 2.99Å
325	G	77.4	Confident	87.8	Confident	18 Å²	18	32.7 Å²	32.7	19%	0.186	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	90.2	-13.7	-174.4	0	0	0	0	0	115.1	V229 M323	V229-G325 PolarHBondContact O-N 3.35Å; M323-G325 PolarHBondContact O-N 3.07Å
326	D	82.7	Confident	87.9	Confident	4 Å²	4	32.6 Å²	32.6	2%	0.021	18%	0.177	C	C	.	.			trans	-70.6	140.9	176.2	-72	-13.4	0	0	0	110.6	M228 V229 V322 M323 I328 K363 K368	M228-D326 WeakPolarHBondContact CA-O 3.48Å; V229-D326 WeakPolarHBondContact CG2-O 3.46Å; V229-D326 PolarHBondContact N-O 2.85Å; V322-D326 HydrophobicContact CG1-CB 4.49Å; M323-D326 PolarHBondContact N-OD2 3.3Å; M323-D326 WeakPolarHBondContact O-CB 3.31Å; M323-D326 PolarHBondContact O-N 2.6Å; M323-D326 VanDerWaalsContact O-N 3.16Å; D326-I328 HydrophobicContact CB-CG2 4.31Å; D326-K363 IonicContact OD2-NZ 2.76Å; D326-K363 PolarHBondContact OD2-NZ 2.86Å; D326-K368 IonicContact OD1-NZ 3.94Å; D326-K368 PolarHBondContact OD1-NZ 3.39Å
327	R	83.7	Confident	88.1	Confident	25 Å²	25	34.8 Å²	34.8	9%	0.094	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	122.3	169.8	-60.5	-174.7	176.2	-163.9	-5.8	109	F297 L364 P465	F297-R327 HydrophobicContact CE1-CB 3.76Å; F297-R327 HydrophobicContact CE1-CG 3.69Å; F297-R327 HydrophobicContact CZ-CB 3.91Å; F297-R327 HydrophobicContact CZ-CG 4.29Å; R327-L364 HydrophobicContact CB-CB 4.22Å; R327-L364 HydrophobicContact CB-CD1 4.15Å; R327-L364 PolarHBondContact O-N 2.79Å; R327-P465 PolarHBondContact NH1-O 2.99Å; R327-P465 PolarHBondContact NH2-O 3.17Å
328	I	89.3	Confident	88.5	Confident	3 Å²	3	35.8 Å²	35.8	2%	0.015	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	150.1	-176	66.3	173.2	0	0	0	111	G227 V229 L294 V322 D326 V330 I361 L362 K363	G227-I328 PolarHBondContact N-O 2.82Å; G227-I328 PolarHBondContact O-N 3.35Å; G227-I328 VanDerWaalsContact O-O 3.11Å; V229-I328 HydrophobicContact CG2-CD1 3.74Å; V229-I328 HydrophobicContact CG2-CG1 4.01Å; V229-I328 HydrophobicContact CG2-CG2 4.36Å; L294-I328 HydrophobicContact CD1-CD1 4.07Å; L294-I328 HydrophobicContact CD1-CG1 4.28Å; L294-I328 HydrophobicContact CD2-CD1 3.53Å; L294-I328 HydrophobicContact CD2-CG1 3.89Å; L294-I328 HydrophobicContact CG-CD1 4.43Å; V322-I328 HydrophobicContact CG1-CD1 4.21Å; V322-I328 HydrophobicContact CG1-CG2 4.15Å; V322-I328 HydrophobicContact CG2-CD1 4.28Å; V322-I328 HydrophobicContact CG2-CG2 4.38Å; D326-I328 HydrophobicContact CB-CG2 4.31Å; I328-V330 HydrophobicContact CD1-CG2 3.35Å; I328-V330 HydrophobicContact CG1-CG2 3.83Å; I328-I361 HydrophobicContact CB-CG2 3.88Å; I328-I361 HydrophobicContact CD1-CG2 3.91Å; I328-I361 HydrophobicContact CG1-CG2 4.47Å; I328-I361 HydrophobicContact CG2-CG2 3.99Å; I328-L362 CarbonylContact C-O 3.58Å; I328-L362 WeakPolarHBondContact CA-O 3.07Å; I328-K363 HydrophobicContact CG2-CG 4.21Å
329	T	90.9	Very high	88.6	Confident	19 Å²	19	38.6 Å²	38.6	12%	0.117	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	123.2	159.6	78.8	0	0	0	0	107	I225 N226 L362 L364	I225-T329 CarbonylContact O-C 3.52Å; I225-T329 WeakPolarHBondContact O-CA 3.38Å; N226-T329 VanDerWaalsContact OD1-CB 3.27Å; N226-T329 WeakPolarHBondContact OD1-CB 3.39Å; N226-T329 WeakPolarHBondContact OD1-CG2 3.29Å; T329-L362 PolarHBondContact N-O 2.91Å; T329-L362 PolarHBondContact O-N 3.45Å; T329-L362 WeakPolarHBondContact OG1-CB 3.5Å; T329-L364 HydrophobicContact CG2-CD1 3.83Å; T329-L364 HydrophobicContact CG2-CD2 3.66Å; T329-L364 HydrophobicContact CG2-CG 3.73Å
330	V	92.4	Very high	88.6	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.012	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	123.1	178.8	177	0	0	0	0	107.6	S224 I225 L294 V312 I328 I356 A358	S224-V330 CarbonylContact C-O 3.6Å; S224-V330 WeakPolarHBondContact CA-O 3.49Å; I225-V330 PolarHBondContact N-O 3.29Å; I225-V330 PolarHBondContact O-N 3.37Å; L294-V330 HydrophobicContact CD1-CB 4.36Å; L294-V330 HydrophobicContact CD1-CG2 3.64Å; V312-V330 HydrophobicContact CG1-CG1 3.92Å; I328-V330 HydrophobicContact CD1-CG2 3.35Å; I328-V330 HydrophobicContact CG1-CG2 3.83Å; V330-I356 HydrophobicContact CG1-CG2 4.35Å; V330-A358 HydrophobicContact CG1-CB 3.78Å
331	T	92.5	Very high	88.5	Confident	1 Å²	1	46 Å²	46	1%	0.006	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	124.4	166.8	-55.9	0	0	0	0	108	L222 I223 S224 I359 H360	L222-T331 HydrophobicContact CD1-CG2 4.06Å; L222-T331 HydrophobicContact CD2-CG2 4.13Å; L222-T331 HydrophobicContact CG-CG2 4.01Å; I223-T331 WeakPolarHBondContact O-CA 3.31Å; S224-T331 PolarHBondContact OG-OG1 2.95Å; T331-I359 PolarHBondContact O-N 3.12Å; T331-H360 PolarHBondContact N-O 2.96Å; T331-H360 PolarHBondContact O-N 3.38Å
332	G	92.8	Very high	88.7	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.8	175.8	-171.6	0	0	0	0	0	113.5	I223 D357	I223-G332 WeakPolarHBondContact CG1-O 3.35Å; I223-G332 PolarHBondContact N-O 3.33Å; I223-G332 PolarHBondContact O-N 3.27Å; G332-D357 CarbonylContact C-O 3.52Å; G332-D357 WeakPolarHBondContact CA-O 3.46Å
333	I	93.6	Very high	88.7	Confident	7 Å²	7	51.7 Å²	51.7	4%	0.036	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	128.8	-179.6	-51.8	177.9	0	0	0	108.5	P170 N171 K221 L222 R335 I356 D357 I359	P170-I333 HydrophobicContact CB-CD1 3.88Å; P170-I333 HydrophobicContact CB-CG1 4.1Å; P170-I333 HydrophobicContact CG-CD1 3.84Å; P170-I333 HydrophobicContact CG-CG1 3.89Å; P170-I333 HydrophobicContact CG-CG2 4.21Å; N171-I333 WeakPolarHBondContact OD1-CD1 3.41Å; K221-I333 WeakPolarHBondContact O-CA 3.48Å; L222-I333 HydrophobicContact CD1-CG1 4.42Å; I333-R335 HydrophobicContact CG2-CG 4.19Å; I333-R335 PolarHBondContact O-N 2.76Å; I333-I356 WeakPolarHBondContact O-CA 3.3Å; I333-D357 PolarHBondContact N-O 3.27Å; I333-D357 PolarHBondContact O-N 2.94Å; I333-I359 HydrophobicContact CD1-CD1 3.98Å; I333-I359 HydrophobicContact CG1-CD1 3.79Å; I333-I359 HydrophobicContact CG1-CG1 4.4Å
334	Y	94.1	Very high	89	Confident	22 Å²	22	56 Å²	56	9%	0.086	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	115.7	175.2	-169.5	-134.7	0	0	0	110.7	L214 I219 N220 K221 I223 T354 I356	L214-Y334 HydrophobicContact CD1-CE2 4.29Å; I219-Y334 HydrophobicContact CB-CD1 4.48Å; I219-Y334 HydrophobicContact CG1-CD1 3.82Å; I219-Y334 HydrophobicContact CG1-CE1 3.9Å; N220-Y334 PolarHBondContact N-O 3.47Å; K221-Y334 PolarHBondContact O-N 2.91Å; I223-Y334 HydrophobicContact CD1-CD2 4.27Å; I223-Y334 HydrophobicContact CD1-CG 4.21Å; Y334-T354 HydrophobicContact CE1-CG2 4.47Å; Y334-T354 HydrophobicContact CE2-CG2 4.25Å; Y334-T354 VanDerWaalsContact OH-CB 3.31Å; Y334-T354 WeakPolarHBondContact OH-CB 3.28Å; Y334-T354 WeakPolarHBondContact OH-CG2 3.48Å; Y334-T354 PolarHBondContact OH-OG1 3.12Å; Y334-I356 HydrophobicContact CD2-CG1 4.01Å
335	R	92.9	Very high	89.3	Confident	82 Å²	82	59.5 Å²	59.5	31%	0.309	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	152.2	-175.6	-68.2	-169.9	174.5	-155.4	-2.2	111.9	N171 I333 T354 F355 D357	N171-R335 PolarHBondContact OD1-NH2 3.18Å; I333-R335 HydrophobicContact CG2-CG 4.19Å; I333-R335 PolarHBondContact O-N 2.76Å; R335-T354 WeakPolarHBondContact O-CA 3.35Å; R335-F355 HydrophobicContact CB-CD1 4.38Å; R335-F355 HydrophobicContact CB-CD2 4.29Å; R335-F355 HydrophobicContact CB-CE1 3.82Å; R335-F355 HydrophobicContact CB-CE2 3.75Å; R335-F355 HydrophobicContact CB-CZ 3.5Å; R335-F355 HydrophobicContact CG-CE2 4.43Å; R335-F355 HydrophobicContact CG-CZ 4.41Å; R335-F355 PolarHBondContact N-O 3.42Å; R335-F355 PolarHBondContact O-N 3.08Å; R335-F355 VanDerWaalsContact O-O 3.04Å; R335-D357 IonicContact CZ-OD2 3.23Å; R335-D357 IonicContact NE-OD2 3.73Å; R335-D357 IonicContact NH1-OD2 2.76Å; R335-D357 IonicContact NH2-OD2 2.78Å
336	S	91.8	Very high	89.9	Confident	41 Å²	41	70.2 Å²	70.2	29%	0.287	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	130.2	175.8	68.2	0	0	0	0	111	R353	S336-R353 CarbonylContact C-O 3.56Å; S336-R353 WeakPolarHBondContact CA-O 3.36Å
337	E	89.7	Confident	90.4	Very high	83 Å²	83	72.1 Å²	72.1	39%	0.388	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	137.1	178.9	-97.6	169.9	-159.7	0	0	111.8	R353 F355	E337-R353 PolarHBondContact N-O 3.33Å; E337-R353 PolarHBondContact O-N 2.99Å; E337-F355 HydrophobicContact CB-CD1 4.45Å; E337-F355 HydrophobicContact CB-CE1 3.81Å; E337-F355 HydrophobicContact CG-CD1 4.47Å; E337-F355 HydrophobicContact CG-CE1 3.46Å; E337-F355 VanDerWaalsContact CG-CE1 3.46Å; E337-F355 HydrophobicContact CG-CZ 4.01Å; E337-F355 WeakPolarHBondContact OE1-CE1 3.4Å; E337-F355 WeakPolarHBondContact OE1-CZ 3.3Å
338	P	92.8	Very high	90.7	Very high	80 Å²	80	74.4 Å²	74.4	52%	0.519	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-72.5	127.7	174.4	26.5	-31.3	0	0	0	112.3	V348 L352	P338-V348 HydrophobicContact CB-CG1 3.38Å; P338-V348 HydrophobicContact CB-CG2 4.49Å; P338-L352 HydrophobicContact CB-CD2 4.04Å
339	I	88.6	Confident	90.7	Very high	70 Å²	70	78.8 Å²	78.8	36%	0.359	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-90.3	129.9	172	-60.7	163.9	0	0	0	109.9	K349 R353	I339-K349 HydrophobicContact CB-CD 4.47Å; I339-K349 HydrophobicContact CG2-CD 4.26Å; I339-K349 PolarHBondContact O-N 2.74Å; I339-R353 HydrophobicContact CD1-CB 3.63Å; I339-R353 HydrophobicContact CD1-CG 4.46Å; I339-R353 HydrophobicContact CG1-CB 3.77Å
340	R	88.5	Confident	90.8	Very high	166 Å²	166	83.9 Å²	83.9	63%	0.626	42%	0.418	S	S	*	.	B	Isolated β-bridge	trans	-72.3	137.3	170.6	-63.1	-175.6	-177.3	173.5	3	110.9
341	E	87	Confident	90.7	Very high	108 Å²	108	89.1 Å²	89.1	51%	0.505	45%	0.45	S	S	.	.	S	Bend	trans	-65.3	-52.5	177.5	-78.4	-171.7	167.6	0	0	112.2	A347 K349	E341-A347 PolarHBondContact N-O 3.38Å; E341-K349 HydrophobicContact CB-CG 4.4Å; E341-K349 HydrophobicContact CG-CB 4.43Å; E341-K349 HydrophobicContact CG-CD 4.33Å; E341-K349 HydrophobicContact CG-CG 3.34Å
342	L	89.2	Confident	90.7	Very high	94 Å²	94	93 Å²	93	49%	0.492	47%	0.47	S	S	.	.	S	Bend	trans	-122	137.6	172.3	-109.5	69.1	0	0	0	108	K344 Q345	L342-K344 PolarHBondContact O-N 3.36Å; L342-Q345 HydrophobicContact CB-CB 4.3Å; L342-Q345 HydrophobicContact CB-CG 4.46Å; L342-Q345 PolarHBondContact O-N 3.11Å; L342-Q345 VanDerWaalsContact O-N 3.1Å
343	P	86	Confident	90.6	Very high	114 Å²	114	96.2 Å²	96.2	74%	0.74	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.6	-177.7	24.1	-34.1	0	0	0	113.4
344	K	89.6	Confident	90.6	Very high	202 Å²	202	98.7 Å²	98.7	88%	0.878	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-21	180	-65.6	-174.1	177.8	-177.4	0	114.2	L342	L342-K344 PolarHBondContact O-N 3.36Å
345	Q	90.2	Very high	90.6	Very high	109 Å²	109	98 Å²	98	51%	0.509	50%	0.495	S	S	.	.	S	Bend	trans	-102.4	151.3	-176.7	-70.5	-178.7	-14.5	0	0	110.2	L342 A347	L342-Q345 HydrophobicContact CB-CB 4.3Å; L342-Q345 HydrophobicContact CB-CG 4.46Å; L342-Q345 PolarHBondContact O-N 3.11Å; L342-Q345 VanDerWaalsContact O-N 3.1Å; Q345-A347 VanDerWaalsContact C-N 3.25Å; Q345-A347 PolarHBondContact O-N 3.12Å
346	R	89.8	Confident	90.7	Very high	242 Å²	242	94.3 Å²	94.3	91%	0.913	48%	0.481	S	S	*	.			trans	-80.8	-5.8	177.3	-65.3	-176.7	-179.2	-180	-0.8	113.1
347	A	92.7	Very high	90.7	Very high	45 Å²	45	93.4 Å²	93.4	37%	0.372	47%	0.473	S	S	.	.			trans	-66.1	132.8	177.8	0	0	0	0	0	110.9	E341 Q345	E341-A347 PolarHBondContact N-O 3.38Å; Q345-A347 VanDerWaalsContact C-N 3.25Å; Q345-A347 PolarHBondContact O-N 3.12Å
348	V	90.9	Very high	90.9	Very high	72 Å²	72	89.6 Å²	89.6	44%	0.436	46%	0.456	S	S	.	.	B	Isolated β-bridge	trans	-111.5	142.6	-177.2	174	0	0	0	0	108.5	P338	P338-V348 HydrophobicContact CB-CG1 3.38Å; P338-V348 HydrophobicContact CB-CG2 4.49Å
349	K	89.8	Confident	90.9	Very high	95 Å²	95	87 Å²	87	41%	0.413	44%	0.438	S	S	.	.			trans	-68.3	142.1	173.6	-70.7	-174.1	178.4	-173.1	0	110.6	I339 E341 V351	I339-K349 HydrophobicContact CB-CD 4.47Å; I339-K349 HydrophobicContact CG2-CD 4.26Å; I339-K349 PolarHBondContact O-N 2.74Å; E341-K349 HydrophobicContact CB-CG 4.4Å; E341-K349 HydrophobicContact CG-CB 4.43Å; E341-K349 HydrophobicContact CG-CD 4.33Å; E341-K349 HydrophobicContact CG-CG 3.34Å; K349-V351 PolarHBondContact O-N 2.85Å
350	S	91	Very high	91	Very high	127 Å²	127	84 Å²	84	89%	0.888	42%	0.422	S	S	*	.	S	Bend	trans	-65	-26.2	174.4	-51	0	0	0	0	113.2
351	V	91.8	Very high	91.1	Very high	112 Å²	112	77.2 Å²	77.2	68%	0.679	40%	0.398	S	S	*	.	S	Bend	trans	-87	114.6	175.9	-177	0	0	0	0	109.3	K349	K349-V351 PolarHBondContact O-N 2.85Å
352	L	91.9	Very high	91.1	Very high	83 Å²	83	74.5 Å²	74.5	44%	0.435	39%	0.387	S	S	.	.	P	Polyproline II helix	trans	-77.6	146.6	175.8	-56.8	175.7	0	0	0	110.2	P338	P338-L352 HydrophobicContact CB-CD2 4.04Å
353	R	91.4	Very high	90.8	Very high	66 Å²	66	74 Å²	74	25%	0.249	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	131.4	169.9	179.6	178.7	165.5	161.6	0.3	108.8	S336 E337 I339 E489	S336-R353 CarbonylContact C-O 3.56Å; S336-R353 WeakPolarHBondContact CA-O 3.36Å; E337-R353 PolarHBondContact N-O 3.33Å; E337-R353 PolarHBondContact O-N 2.99Å; I339-R353 HydrophobicContact CD1-CB 3.63Å; I339-R353 HydrophobicContact CD1-CG 4.46Å; I339-R353 HydrophobicContact CG1-CB 3.77Å; R353-E489 IonicContact CZ-OE1 3.17Å; R353-E489 IonicContact NH1-OE1 3.74Å; R353-E489 PolarHBondContact NH1-OE1 3.02Å; R353-E489 IonicContact NH2-OE1 3.85Å; R353-E489 PolarHBondContact NH2-OE1 2.83Å; R353-E489 IonicContact NH2-OE2 3.1Å
354	T	93	Very high	90.1	Very high	59 Å²	59	72.8 Å²	72.8	36%	0.362	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	148.2	175.5	60.3	0	0	0	0	111.3	Y334 R335	Y334-T354 HydrophobicContact CE1-CG2 4.47Å; Y334-T354 HydrophobicContact CE2-CG2 4.25Å; Y334-T354 VanDerWaalsContact OH-CB 3.31Å; Y334-T354 WeakPolarHBondContact OH-CB 3.28Å; Y334-T354 WeakPolarHBondContact OH-CG2 3.48Å; Y334-T354 PolarHBondContact OH-OG1 3.12Å; R335-T354 WeakPolarHBondContact O-CA 3.35Å
355	F	94	Very high	88.7	Confident	8 Å²	8	64.4 Å²	64.4	4%	0.035	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155	163.6	174.6	64.2	-80.4	0	0	0	108.8	S311 Y313 R335 E337	S311-F355 VanDerWaalsContact O-CA 3.31Å; S311-F355 WeakPolarHBondContact O-CA 3.47Å; S311-F355 WeakPolarHBondContact O-CB 3.49Å; Y313-F355 AromaticContact CD2-CD2 3.43Å; Y313-F355 HydrophobicContact CD2-CD2 3.43Å; Y313-F355 VanDerWaalsContact CD2-CD2 3.43Å; Y313-F355 AromaticContact CD2-CE2 3.51Å; Y313-F355 HydrophobicContact CD2-CE2 3.51Å; Y313-F355 HydrophobicContact CD2-CG 4.26Å; Y313-F355 HydrophobicContact CD2-CZ 4.4Å; Y313-F355 HydrophobicContact CE2-CD1 4.43Å; Y313-F355 AromaticContact CE2-CD2 3.56Å; Y313-F355 HydrophobicContact CE2-CD2 3.56Å; Y313-F355 AromaticContact CE2-CE2 3.65Å; Y313-F355 HydrophobicContact CE2-CE2 3.65Å; Y313-F355 AromaticContact CE2-CG 3.96Å; Y313-F355 HydrophobicContact CE2-CG 3.96Å; Y313-F355 HydrophobicContact CE2-CZ 4.15Å; Y313-F355 AromaticContact CG-CD2 3.96Å; Y313-F355 HydrophobicContact CG-CD2 3.96Å; Y313-F355 HydrophobicContact CG-CE2 4.41Å; R335-F355 HydrophobicContact CB-CD1 4.38Å; R335-F355 HydrophobicContact CB-CD2 4.29Å; R335-F355 HydrophobicContact CB-CE1 3.82Å; R335-F355 HydrophobicContact CB-CE2 3.75Å; R335-F355 HydrophobicContact CB-CZ 3.5Å; R335-F355 HydrophobicContact CG-CE2 4.43Å; R335-F355 HydrophobicContact CG-CZ 4.41Å; R335-F355 PolarHBondContact N-O 3.42Å; R335-F355 PolarHBondContact O-N 3.08Å; R335-F355 VanDerWaalsContact O-O 3.04Å; E337-F355 HydrophobicContact CB-CD1 4.45Å; E337-F355 HydrophobicContact CB-CE1 3.81Å; E337-F355 HydrophobicContact CG-CD1 4.47Å; E337-F355 HydrophobicContact CG-CE1 3.46Å; E337-F355 VanDerWaalsContact CG-CE1 3.46Å; E337-F355 HydrophobicContact CG-CZ 4.01Å; E337-F355 WeakPolarHBondContact OE1-CE1 3.4Å; E337-F355 WeakPolarHBondContact OE1-CZ 3.3Å
356	I	94	Very high	86.9	Confident	4 Å²	4	67.4 Å²	67.4	2%	0.021	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	128.5	176.7	-60.9	171.8	0	0	0	107.9	I223 I225 V310 S311 V312 Y313 V330 I333 Y334	I223-I356 HydrophobicContact CD1-CD1 3.82Å; I223-I356 HydrophobicContact CD1-CG1 4.12Å; I225-I356 HydrophobicContact CD1-CD1 3.31Å; I225-I356 HydrophobicContact CG1-CD1 4.14Å; V310-I356 HydrophobicContact CG1-CD1 3.65Å; V310-I356 HydrophobicContact CG1-CG1 3.96Å; S311-I356 PolarHBondContact O-N 2.89Å; V312-I356 CarbonylContact C-O 3.55Å; V312-I356 VanDerWaalsContact CA-O 3.3Å; V312-I356 WeakPolarHBondContact CA-O 3.46Å; V312-I356 HydrophobicContact CG2-CB 4.25Å; Y313-I356 PolarHBondContact N-O 3.33Å; V330-I356 HydrophobicContact CG1-CG2 4.35Å; I333-I356 WeakPolarHBondContact O-CA 3.3Å; Y334-I356 HydrophobicContact CD2-CG1 4.01Å
357	D	93.7	Very high	84.9	Confident	22 Å²	22	61 Å²	61	12%	0.118	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	107.7	169.5	-161.3	8.7	0	0	0	107.7	L315 G332 I333 R335	L315-D357 WeakPolarHBondContact CD1-OD1 3.5Å; G332-D357 CarbonylContact C-O 3.52Å; G332-D357 WeakPolarHBondContact CA-O 3.46Å; I333-D357 PolarHBondContact N-O 3.27Å; I333-D357 PolarHBondContact O-N 2.94Å; R335-D357 IonicContact CZ-OD2 3.23Å; R335-D357 IonicContact NE-OD2 3.73Å; R335-D357 IonicContact NH1-OD2 2.76Å; R335-D357 IonicContact NH2-OD2 2.78Å
358	A	93.4	Very high	82.5	Confident	4 Å²	4	63.3 Å²	63.3	3%	0.033	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	135.8	-176.7	0	0	0	0	0	109.8	V312 Y313 L314 M318 V330 I361	V312-A358 HydrophobicContact CG1-CB 3.69Å; Y313-A358 WeakPolarHBondContact O-CB 3.48Å; Y313-A358 PolarHBondContact O-N 3.14Å; L314-A358 HydrophobicContact CD2-CB 3.46Å; L314-A358 VanDerWaalsContact CD2-CB 3.46Å; M318-A358 HydrophobicContact CE-CB 4.47Å; M318-A358 WeakPolarHBondContact CE-O 3.44Å; M318-A358 HydrophobicContact SD-CB 4.43Å; V330-A358 HydrophobicContact CG1-CB 3.78Å; A358-I361 HydrophobicContact CB-CG1 4.47Å
359	I	91.6	Very high	80	Confident	25 Å²	25	66.4 Å²	66.4	13%	0.128	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	-38.4	169.7	-59.6	-175.7	0	0	0	109.9	I174 K201 P202 L222 T331 I333	I174-I359 HydrophobicContact CD1-CD1 3.4Å; K201-I359 HydrophobicContact CB-CG2 4.43Å; K201-I359 VanDerWaalsContact CD-O 3.29Å; K201-I359 WeakPolarHBondContact CD-O 3.43Å; K201-I359 HydrophobicContact CG-CG2 4.38Å; P202-I359 HydrophobicContact CG-CG2 4.21Å; L222-I359 HydrophobicContact CD1-CD1 3.75Å; T331-I359 PolarHBondContact O-N 3.12Å; I333-I359 HydrophobicContact CD1-CD1 3.98Å; I333-I359 HydrophobicContact CG1-CD1 3.79Å; I333-I359 HydrophobicContact CG1-CG1 4.4Å
360	H	91	Very high	77.2	Confident	8 Å²	8	69.5 Å²	69.5	4%	0.037	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	145.8	-179.1	-174.1	78.8	0	0	0	111.1	E149 K201 F203 T331 L362	E149-H360 IonicContact OE1-CE1 3.1Å; E149-H360 PolarHBondContact OE1-CE1 2.85Å; K201-H360 HydrophobicContact CB-CB 4.29Å; F203-H360 HydrophobicContact CB-CB 4.3Å; F203-H360 WeakPolarHBondContact CB-CD2 3.2Å; T331-H360 PolarHBondContact N-O 2.96Å; T331-H360 PolarHBondContact O-N 3.38Å; H360-L362 WeakPolarHBondContact NE2-CD2 3.28Å; H360-L362 VanDerWaalsContact NE2-CG 3.3Å; H360-L362 WeakPolarHBondContact NE2-CG 3.41Å
361	I	90.5	Very high	74.5	Confident	22 Å²	22	71.7 Å²	71.7	11%	0.113	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	120.1	178.9	-52.6	173.1	0	0	0	108.5	L314 M318 V322 I328 A358	L314-I361 HydrophobicContact CD1-CD1 3.79Å; L314-I361 HydrophobicContact CD2-CD1 3.42Å; L314-I361 VanDerWaalsContact CD2-CD1 3.42Å; L314-I361 HydrophobicContact CD2-CG1 4.26Å; L314-I361 HydrophobicContact CG-CD1 4.24Å; M318-I361 HydrophobicContact CB-CD1 4.38Å; M318-I361 HydrophobicContact SD-CG1 4.45Å; V322-I361 HydrophobicContact CG2-CD1 3.68Å; V322-I361 HydrophobicContact CG2-CG2 3.88Å; I328-I361 HydrophobicContact CB-CG2 3.88Å; I328-I361 HydrophobicContact CD1-CG2 3.91Å; I328-I361 HydrophobicContact CG1-CG2 4.47Å; I328-I361 HydrophobicContact CG2-CG2 3.99Å; A358-I361 HydrophobicContact CB-CG1 4.47Å
362	L	86.9	Confident	72	Confident	52 Å²	52	75.8 Å²	75.8	27%	0.272	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	126.5	167.7	-62.9	164.3	0	0	0	108.9	F203 I328 T329 H360	F203-L362 HydrophobicContact CD2-CD1 4.1Å; I328-L362 CarbonylContact C-O 3.58Å; I328-L362 WeakPolarHBondContact CA-O 3.07Å; T329-L362 PolarHBondContact N-O 2.91Å; T329-L362 PolarHBondContact O-N 3.45Å; T329-L362 WeakPolarHBondContact OG1-CB 3.5Å; H360-L362 WeakPolarHBondContact NE2-CD2 3.28Å; H360-L362 VanDerWaalsContact NE2-CG 3.3Å; H360-L362 WeakPolarHBondContact NE2-CG 3.41Å
363	K	82.5	Confident	69.7	Low	82 Å²	82	78.5 Å²	78.5	36%	0.357	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	119.8	166.6	-64.5	-173.7	179.4	-166.5	0	108.5	L321 D326 I328 D365	L321-K363 WeakPolarHBondContact O-CE 3.27Å; L321-K363 PolarHBondContact O-NZ 3.22Å; D326-K363 IonicContact OD2-NZ 2.76Å; D326-K363 PolarHBondContact OD2-NZ 2.86Å; I328-K363 HydrophobicContact CG2-CG 4.21Å; K363-D365 PolarHBondContact O-N 2.95Å
364	L	72	Confident	67.7	Low	89 Å²	89	79.5 Å²	79.5	47%	0.466	39%	0.385	S	S	.	.	S	Bend	trans	-67.6	-32.4	174.8	-69.8	166.4	0	0	0	110.9	F297 R327 T329 R366	F297-L364 HydrophobicContact CE2-CD1 4Å; F297-L364 HydrophobicContact CZ-CD1 3.68Å; R327-L364 HydrophobicContact CB-CB 4.22Å; R327-L364 HydrophobicContact CB-CD1 4.15Å; R327-L364 PolarHBondContact O-N 2.79Å; T329-L364 HydrophobicContact CG2-CD1 3.83Å; T329-L364 HydrophobicContact CG2-CD2 3.66Å; T329-L364 HydrophobicContact CG2-CG 3.73Å; L364-R366 PolarHBondContact O-N 3.06Å
365	D	60.1	Low	66	Low	27 Å²	27	79.4 Å²	79.4	14%	0.144	38%	0.382	C	S	.	.			trans	-91.3	70.1	-179.7	-66.6	-45.2	0	0	0	111.6	K363 H367 R466	K363-D365 PolarHBondContact O-N 2.95Å; D365-H367 PolarHBondContact O-N 3.22Å; D365-R466 IonicContact OD1-CZ 3.96Å; D365-R466 IonicContact OD1-NE 3.82Å; D365-R466 PolarHBondContact OD1-NE 3.06Å; D365-R466 IonicContact OD1-NH2 3.1Å; D365-R466 IonicContact OD2-CZ 3.34Å; D365-R466 IonicContact OD2-NE 3.36Å; D365-R466 PolarHBondContact OD2-NE 3.13Å; D365-R466 IonicContact OD2-NH2 3.18Å; D365-R466 PolarHBondContact OD2-NH2 3.01Å
366	R	53.3	Low	64.1	Low	172 Å²	172	83.7 Å²	83.7	65%	0.649	41%	0.413	S	S	*	.			trans	-64.8	-10.9	170.4	-81.7	-170.6	171.1	-169.4	2.9	113.5	L364 K368 D374	L364-R366 PolarHBondContact O-N 3.06Å; R366-K368 PolarHBondContact O-N 3.45Å; R366-D374 IonicContact CZ-OD2 3.53Å; R366-D374 IonicContact NH1-OD2 2.68Å; R366-D374 PolarHBondContact NH1-OD2 3.47Å
367	H	47.6	Very low	62.8	Low	107 Å²	107	89.2 Å²	89.2	50%	0.495	43%	0.434	S	S	.	.			trans	-67.7	20.8	-176.2	-69.2	-65	0	0	0	116.8	D365	D365-H367 PolarHBondContact O-N 3.22Å
368	K	41.4	Very low	61.6	Low	93 Å²	93	88.9 Å²	88.9	40%	0.404	43%	0.432	S	S	.	.	S	Bend	trans	-101.1	94.3	172.7	-74.1	178.7	178.5	170.9	0	110.4	D326 R366 N370	D326-K368 IonicContact OD1-NZ 3.94Å; D326-K368 PolarHBondContact OD1-NZ 3.39Å; R366-K368 PolarHBondContact O-N 3.45Å; K368-N370 PolarHBondContact O-N 3.1Å
369	L	38.7	Very low	60.9	Low	137 Å²	137	91.9 Å²	91.9	72%	0.717	45%	0.453	S	S	*	.	S	Bend	trans	71.9	7.4	145.1	-76.2	148.1	0	0	0	121.4
370	N	31.8	Very low	60.5	Low	160 Å²	160	98.3 Å²	98.3	86%	0.856	48%	0.482	S	S	*	.			trans	-105.2	145.4	167.4	-77.3	-1	0	0	0	112.6	K368	K368-N370 PolarHBondContact O-N 3.1Å
371	E	33.9	Very low	60.4	Low	173 Å²	173	104.9 Å²	104.9	81%	0.808	51%	0.513	S	S	*	.			trans	-64.9	133.5	-157.8	-61.9	167.7	134.4	0	0	113.8	D373	E371-D373 VanDerWaalsContact C-N 3.3Å; E371-D373 PolarHBondContact O-N 3.45Å
372	K	38.6	Very low	60.1	Low	199 Å²	199	105.9 Å²	105.9	87%	0.865	52%	0.515	S	S	*	.	S	Bend	trans	55.7	-14.5	147.4	-66.3	177.4	178.7	172.3	0	122.2
373	D	43	Very low	60.2	Low	139 Å²	139	104.4 Å²	104.4	74%	0.743	51%	0.508	S	S	*	.			trans	-117.2	-3.4	-156.1	-67.9	-20.2	0	0	0	119.2	E371	E371-D373 VanDerWaalsContact C-N 3.3Å; E371-D373 PolarHBondContact O-N 3.45Å
374	D	50.9	Low	60.6	Low	87 Å²	87	105 Å²	105	47%	0.465	51%	0.514	S	S	.	.			trans	-116.8	70	-178.6	-82	-3.6	0	0	0	113.8	R366	R366-D374 IonicContact CZ-OD2 3.53Å; R366-D374 IonicContact NH1-OD2 2.68Å; R366-D374 PolarHBondContact NH1-OD2 3.47Å
375	I	57.2	Low	61.4	Low	57 Å²	57	104.6 Å²	104.6	29%	0.292	51%	0.51	S	S	.	.			trans	-87.9	11.4	160.1	-43.5	168.2	0	0	0	110.3	W377 L378 I383 Y630 V634	I375-W377 PolarHBondContact O-N 2.79Å; I375-L378 HydrophobicContact CG2-CB 4.41Å; I375-L378 PolarHBondContact O-N 2.93Å; I375-L378 VanDerWaalsContact O-N 3.09Å; I375-I383 HydrophobicContact CG2-CD1 4.31Å; I375-Y630 HydrophobicContact CD1-CE2 4.37Å; I375-Y630 HydrophobicContact CG2-CD2 4Å; I375-Y630 HydrophobicContact CG2-CE2 4.1Å; I375-V634 HydrophobicContact CD1-CG2 3.5Å; I375-V634 HydrophobicContact CG1-CG2 4.48Å
376	S	54.6	Low	62.8	Low	99 Å²	99	103.3 Å²	103.3	69%	0.692	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-10.8	-173.4	54	0	0	0	0	115.3	L378	S376-L378 VanDerWaalsContact C-N 3.32Å
377	W	65.1	Low	64.6	Low	120 Å²	120	101.6 Å²	101.6	46%	0.455	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-12.5	176.3	68.6	-81.9	0	0	0	113.8	I375 A629	I375-W377 PolarHBondContact O-N 2.79Å; W377-A629 HydrophobicContact CH2-CB 3.54Å; W377-A629 HydrophobicContact CZ2-CB 3.58Å
378	L	68.9	Low	66.6	Low	14 Å²	14	100 Å²	100	7%	0.073	50%	0.497	C	S	.	.	S	Bend	trans	-105.3	128.2	176.6	-118.5	71.6	0	0	0	110.8	I375 S376 R382 I383 I386 D626 Y630	I375-L378 HydrophobicContact CG2-CB 4.41Å; I375-L378 PolarHBondContact O-N 2.93Å; I375-L378 VanDerWaalsContact O-N 3.09Å; S376-L378 VanDerWaalsContact C-N 3.32Å; L378-R382 HydrophobicContact CD2-CB 4.39Å; L378-R382 HydrophobicContact CD2-CG 4.06Å; L378-R382 HydrophobicContact CG-CB 4.15Å; L378-R382 HydrophobicContact CG-CG 3.98Å; L378-I383 HydrophobicContact CB-CD1 4.31Å; L378-I383 HydrophobicContact CB-CG1 4.06Å; L378-I383 HydrophobicContact CD2-CG1 4.01Å; L378-I386 HydrophobicContact CD2-CD1 3.48Å; L378-I386 VanDerWaalsContact CD2-CD1 3.48Å; L378-D626 HydrophobicContact CD1-CB 4.27Å; L378-D626 HydrophobicContact CD2-CB 4.41Å; L378-Y630 HydrophobicContact CD2-CD2 4.26Å
379	S	79.5	Confident	68.9	Low	68 Å²	68	97 Å²	97	48%	0.476	49%	0.486	S	S	.	.			trans	-62.5	148.7	170.3	65.6	0	0	0	0	111	E381 R382 I383	S379-E381 PolarHBondContact O-N 2.96Å; S379-R382 WeakPolarHBondContact O-CB 3.37Å; S379-R382 PolarHBondContact O-N 2.9Å; S379-R382 WeakPolarHBondContact OG-CB 3.47Å; S379-R382 PolarHBondContact OG-N 2.89Å; S379-I383 PolarHBondContact O-N 3.5Å; S379-I383 VanDerWaalsContact O-N 3.08Å
380	E	83.5	Confident	71.3	Confident	159 Å²	159	91.3 Å²	91.3	74%	0.743	46%	0.458	S	S	*	.	H	α-helix	trans	-59.6	-34.4	177.6	-64.3	-169.8	160.8	0	0	112	R382 I383 N384	E380-R382 VanDerWaalsContact C-N 3.31Å; E380-R382 PolarHBondContact O-N 3.44Å; E380-I383 PolarHBondContact O-N 3.27Å; E380-N384 WeakPolarHBondContact O-CB 3.5Å; E380-N384 VanDerWaalsContact O-CG 3.26Å; E380-N384 PolarHBondContact O-N 3.38Å; E380-N384 PolarHBondContact O-ND2 3.23Å
381	E	87.7	Confident	74	Confident	146 Å²	146	87.8 Å²	87.8	68%	0.682	45%	0.452	S	S	*	.	H	α-helix	trans	-57.2	-43.8	172.2	-62.4	-175	168.9	0	0	112	S379 N384 Q385	S379-E381 PolarHBondContact O-N 2.96Å; E381-N384 PolarHBondContact O-N 3.38Å; E381-Q385 WeakPolarHBondContact O-CG 3.47Å; E381-Q385 PolarHBondContact O-N 3.21Å
382	R	85.3	Confident	76.7	Confident	43 Å²	43	85.3 Å²	85.3	16%	0.162	44%	0.435	C	S	.	.	H	α-helix	trans	-67.6	-39.8	179.4	-164.9	60.3	157.6	-167.4	-13.3	111.5	L378 S379 E380 N384 Q385 I386 S622 D626	L378-R382 HydrophobicContact CD2-CB 4.39Å; L378-R382 HydrophobicContact CD2-CG 4.06Å; L378-R382 HydrophobicContact CG-CB 4.15Å; L378-R382 HydrophobicContact CG-CG 3.98Å; S379-R382 WeakPolarHBondContact O-CB 3.37Å; S379-R382 PolarHBondContact O-N 2.9Å; S379-R382 WeakPolarHBondContact OG-CB 3.47Å; S379-R382 PolarHBondContact OG-N 2.89Å; E380-R382 VanDerWaalsContact C-N 3.31Å; E380-R382 PolarHBondContact O-N 3.44Å; R382-N384 VanDerWaalsContact C-N 3.32Å; R382-N384 PolarHBondContact O-N 3.25Å; R382-Q385 WeakPolarHBondContact O-CB 3.48Å; R382-Q385 PolarHBondContact O-N 3.4Å; R382-I386 HydrophobicContact CG-CD1 4.37Å; R382-I386 WeakPolarHBondContact O-CB 3.5Å; R382-I386 VanDerWaalsContact O-CG1 3.28Å; R382-I386 WeakPolarHBondContact O-CG1 3.5Å; R382-I386 PolarHBondContact O-N 3.04Å; R382-S622 PolarHBondContact NH2-O 2.96Å; R382-S622 PolarHBondContact NH2-OG 2.79Å; R382-D626 HydrophobicContact CG-CB 4.44Å; R382-D626 IonicContact CZ-OD2 3.99Å; R382-D626 VanDerWaalsContact CZ-OD2 3.23Å; R382-D626 IonicContact NE-OD2 2.59Å; R382-D626 PolarHBondContact NE-OD2 2.9Å; R382-D626 IonicContact NH2-OD2 2.89Å; R382-D626 PolarHBondContact NH2-OD2 3.03Å
383	I	87.7	Confident	78.9	Confident	22 Å²	22	81.7 Å²	81.7	11%	0.113	43%	0.432	C	S	.	.	H	α-helix	trans	-62.6	-41.8	173.9	-63.1	171.9	0	0	0	110.3	I375 L378 S379 E380 I386 R387 Y630	I375-I383 HydrophobicContact CG2-CD1 4.31Å; L378-I383 HydrophobicContact CB-CD1 4.31Å; L378-I383 HydrophobicContact CB-CG1 4.06Å; L378-I383 HydrophobicContact CD2-CG1 4.01Å; S379-I383 PolarHBondContact O-N 3.5Å; S379-I383 VanDerWaalsContact O-N 3.08Å; E380-I383 PolarHBondContact O-N 3.27Å; I383-I386 WeakPolarHBondContact O-CB 3.38Å; I383-I386 PolarHBondContact O-N 3.34Å; I383-R387 HydrophobicContact CG2-CG 4.41Å; I383-R387 WeakPolarHBondContact O-CB 3.4Å; I383-R387 WeakPolarHBondContact O-CG 3.48Å; I383-R387 PolarHBondContact O-N 2.9Å; I383-Y630 HydrophobicContact CD1-CE2 4.36Å; I383-Y630 HydrophobicContact CG1-CD2 4.48Å; I383-Y630 HydrophobicContact CG1-CE2 4.11Å; I383-Y630 HydrophobicContact CG2-CE2 4.06Å
384	N	91.2	Very high	81.1	Confident	93 Å²	93	78.8 Å²	78.8	50%	0.497	42%	0.416	S	S	.	.	H	α-helix	trans	-64.4	-41.1	176.5	-72	-26.2	0	0	0	111.7	E380 E381 R382 R387 S388	E380-N384 WeakPolarHBondContact O-CB 3.5Å; E380-N384 VanDerWaalsContact O-CG 3.26Å; E380-N384 PolarHBondContact O-N 3.38Å; E380-N384 PolarHBondContact O-ND2 3.23Å; E381-N384 PolarHBondContact O-N 3.38Å; R382-N384 VanDerWaalsContact C-N 3.32Å; R382-N384 PolarHBondContact O-N 3.25Å; N384-R387 PolarHBondContact O-N 3.33Å; N384-S388 VanDerWaalsContact O-CB 3.28Å; N384-S388 WeakPolarHBondContact O-CB 3.47Å; N384-S388 PolarHBondContact O-N 3.5Å; N384-S388 PolarHBondContact O-OG 3.35Å
385	Q	89.5	Confident	83	Confident	81 Å²	81	75.1 Å²	75.1	38%	0.379	40%	0.397	S	S	.	.	H	α-helix	trans	-58.7	-48.2	171.3	-70.8	173.8	4.9	0	0	111.4	E381 R382 R387 S388 L389 L623	E381-Q385 WeakPolarHBondContact O-CG 3.47Å; E381-Q385 PolarHBondContact O-N 3.21Å; R382-Q385 WeakPolarHBondContact O-CB 3.48Å; R382-Q385 PolarHBondContact O-N 3.4Å; Q385-R387 PolarHBondContact O-N 2.9Å; Q385-S388 PolarHBondContact O-N 3.49Å; Q385-S388 PolarHBondContact O-OG 3.29Å; Q385-L389 WeakPolarHBondContact O-CG 3.36Å; Q385-L389 PolarHBondContact O-N 3.4Å; Q385-L623 HydrophobicContact CB-CD1 4.17Å
386	I	89.4	Confident	84.5	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-58.7	-47	177.9	-73.8	167	0	0	0	111.5	L378 R382 I383 L389 A390 L623 D626 Y627 Y630 L686	L378-I386 HydrophobicContact CD2-CD1 3.48Å; L378-I386 VanDerWaalsContact CD2-CD1 3.48Å; R382-I386 HydrophobicContact CG-CD1 4.37Å; R382-I386 WeakPolarHBondContact O-CB 3.5Å; R382-I386 VanDerWaalsContact O-CG1 3.28Å; R382-I386 WeakPolarHBondContact O-CG1 3.5Å; R382-I386 PolarHBondContact O-N 3.04Å; I383-I386 WeakPolarHBondContact O-CB 3.38Å; I383-I386 PolarHBondContact O-N 3.34Å; I386-L389 PolarHBondContact O-N 2.88Å; I386-A390 WeakPolarHBondContact O-CB 3.48Å; I386-A390 PolarHBondContact O-N 3.28Å; I386-L623 HydrophobicContact CG1-CD1 3.97Å; I386-D626 HydrophobicContact CD1-CB 4.21Å; I386-Y627 HydrophobicContact CB-CD2 4.15Å; I386-Y627 HydrophobicContact CG1-CD2 4.09Å; I386-Y627 HydrophobicContact CG2-CD2 3.61Å; I386-Y627 HydrophobicContact CG2-CE2 3.79Å; I386-Y627 HydrophobicContact CG2-CG 4.43Å; I386-Y630 HydrophobicContact CD1-CG 4.3Å; I386-Y630 HydrophobicContact CG2-CD1 3.63Å; I386-Y630 HydrophobicContact CG2-CE1 4.06Å; I386-Y630 HydrophobicContact CG2-CG 4.26Å; I386-L686 HydrophobicContact CG2-CD1 4.02Å
387	R	90.6	Very high	86.2	Confident	137 Å²	137	73.7 Å²	73.7	52%	0.517	38%	0.377	S	S	.	.	H	α-helix	trans	-65.5	-40.6	177.8	-72.5	176.3	179.9	167.2	-1.1	111.8	I383 N384 Q385 L389 A390 A391 Y630	I383-R387 HydrophobicContact CG2-CG 4.41Å; I383-R387 WeakPolarHBondContact O-CB 3.4Å; I383-R387 WeakPolarHBondContact O-CG 3.48Å; I383-R387 PolarHBondContact O-N 2.9Å; N384-R387 PolarHBondContact O-N 3.33Å; Q385-R387 PolarHBondContact O-N 2.9Å; R387-L389 VanDerWaalsContact C-N 3.3Å; R387-L389 PolarHBondContact O-N 2.97Å; R387-A390 PolarHBondContact O-N 3.47Å; R387-A391 WeakPolarHBondContact O-CB 3.49Å; R387-A391 PolarHBondContact O-N 3.48Å; R387-Y630 PolarHBondContact NH2-OH 3.02Å
388	S	91.1	Very high	87.3	Confident	72 Å²	72	71.4 Å²	71.4	50%	0.503	37%	0.368	S	S	.	.	H	α-helix	trans	-62.9	-38.2	177	80.2	0	0	0	0	111.9	N384 Q385	N384-S388 VanDerWaalsContact O-CB 3.28Å; N384-S388 WeakPolarHBondContact O-CB 3.47Å; N384-S388 PolarHBondContact O-N 3.5Å; N384-S388 PolarHBondContact O-OG 3.35Å; Q385-S388 PolarHBondContact O-N 3.49Å; Q385-S388 PolarHBondContact O-OG 3.29Å
389	L	89.1	Confident	88.2	Confident	31 Å²	31	71 Å²	71	16%	0.162	37%	0.366	C	S	.	.	H	α-helix	trans	-64.7	-55.4	172.7	-75.3	179.3	0	0	0	109.1	Q385 I386 R387 A391 R392 V395 V619 L623 Y627	Q385-L389 WeakPolarHBondContact O-CG 3.36Å; Q385-L389 PolarHBondContact O-N 3.4Å; I386-L389 PolarHBondContact O-N 2.88Å; R387-L389 VanDerWaalsContact C-N 3.3Å; R387-L389 PolarHBondContact O-N 2.97Å; L389-A391 PolarHBondContact O-N 3.5Å; L389-A391 VanDerWaalsContact O-N 3.12Å; L389-R392 WeakPolarHBondContact O-CB 3.04Å; L389-R392 PolarHBondContact O-N 3.23Å; L389-V395 WeakPolarHBondContact O-CG2 2.97Å; L389-V619 HydrophobicContact CD1-CG1 4.32Å; L389-L623 HydrophobicContact CD1-CD2 3.45Å; L389-L623 VanDerWaalsContact CD1-CD2 3.45Å; L389-L623 HydrophobicContact CD1-CG 3.9Å; L389-Y627 HydrophobicContact CB-CE2 4.47Å
390	A	89.3	Confident	88.7	Confident	17 Å²	17	67.8 Å²	67.8	14%	0.14	34%	0.344	C	S	.	.	H	α-helix	trans	-55.4	-31.2	-177.7	0	0	0	0	0	114.2	I386 R387 R392 Y627 L686	I386-A390 WeakPolarHBondContact O-CB 3.48Å; I386-A390 PolarHBondContact O-N 3.28Å; R387-A390 PolarHBondContact O-N 3.47Å; A390-R392 PolarHBondContact O-N 3.47Å; A390-Y627 HydrophobicContact CB-CE2 4.2Å; A390-Y627 WeakPolarHBondContact CB-OH 3.45Å; A390-L686 HydrophobicContact CB-CD1 3.56Å; A390-L686 HydrophobicContact CB-CG 4.05Å
391	A	88.7	Confident	88.8	Confident	87 Å²	87	64.1 Å²	64.1	72%	0.719	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-17.1	177.9	0	0	0	0	0	113.8	R387 L389	R387-A391 WeakPolarHBondContact O-CB 3.49Å; R387-A391 PolarHBondContact O-N 3.48Å; L389-A391 PolarHBondContact O-N 3.5Å; L389-A391 VanDerWaalsContact O-N 3.12Å
392	R	89.2	Confident	88.7	Confident	121 Å²	121	57.6 Å²	57.6	46%	0.457	30%	0.297	S	S	.	.	S	Bend	trans	-76.9	139.4	-179.7	-58.9	178.7	70.7	157.6	0.3	110.1	L389 A390 D394 V395 R398	L389-R392 WeakPolarHBondContact O-CB 3.04Å; L389-R392 PolarHBondContact O-N 3.23Å; A390-R392 PolarHBondContact O-N 3.47Å; R392-D394 VanDerWaalsContact C-N 3.28Å; R392-D394 PolarHBondContact O-N 3.03Å; R392-V395 HydrophobicContact CB-CG2 3.99Å; R392-V395 WeakPolarHBondContact O-CG2 3.33Å; R392-V395 PolarHBondContact O-N 2.94Å; R392-R398 VanDerWaalsContact CZ-NH1 3.26Å; R392-R398 VanDerWaalsContact NE-NH1 3.13Å; R392-R398 VanDerWaalsContact NH2-NH2 3.15Å
393	P	86.3	Confident	88.6	Confident	122 Å²	122	55.6 Å²	55.6	79%	0.792	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-32.8	178.3	25.3	-33	0	0	0	112.4	V395	P393-V395 PolarHBondContact O-N 3.28Å
394	D	88.8	Confident	88.5	Confident	79 Å²	79	54.5 Å²	54.5	42%	0.422	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	17.3	-175.8	-39.1	-32.9	0	0	0	113.3	R392 Y396 E397 R398	R392-D394 VanDerWaalsContact C-N 3.28Å; R392-D394 PolarHBondContact O-N 3.03Å; D394-Y396 VanDerWaalsContact C-N 3.26Å; D394-Y396 PolarHBondContact O-N 2.92Å; D394-E397 PolarHBondContact O-N 2.99Å; D394-R398 WeakPolarHBondContact O-CB 3.27Å; D394-R398 PolarHBondContact O-N 2.69Å
395	V	89.3	Confident	88	Confident	9 Å²	9	51.6 Å²	51.6	6%	0.055	27%	0.271	C	S	.	.	H	α-helix	trans	-56.4	-44.2	-178.3	166.6	0	0	0	0	111.5	L389 R392 P393 E397 R398 L399 I684	L389-V395 WeakPolarHBondContact O-CG2 2.97Å; R392-V395 HydrophobicContact CB-CG2 3.99Å; R392-V395 WeakPolarHBondContact O-CG2 3.33Å; R392-V395 PolarHBondContact O-N 2.94Å; P393-V395 PolarHBondContact O-N 3.28Å; V395-E397 PolarHBondContact O-N 3.48Å; V395-R398 PolarHBondContact O-N 3.45Å; V395-L399 HydrophobicContact CG1-CD1 3.53Å; V395-L399 HydrophobicContact CG1-CG 4.02Å; V395-L399 WeakPolarHBondContact O-CB 3.26Å; V395-L399 WeakPolarHBondContact O-CG 3.47Å; V395-L399 PolarHBondContact O-N 3.43Å; V395-I684 HydrophobicContact CG1-CG2 4.18Å
396	Y	89.7	Confident	87.6	Confident	24 Å²	24	49.2 Å²	49.2	9%	0.094	26%	0.263	C	S	.	.	H	α-helix	trans	-59.7	-48.3	-177.5	176.5	-122	0	0	0	112	D394 S400 K415 L418 F419 I684 E697	D394-Y396 VanDerWaalsContact C-N 3.26Å; D394-Y396 PolarHBondContact O-N 2.92Å; Y396-S400 WeakPolarHBondContact O-CB 2.87Å; Y396-S400 PolarHBondContact O-N 3.34Å; Y396-S400 PolarHBondContact O-OG 3.01Å; Y396-K415 HydrophobicContact CE1-CD 3.73Å; Y396-K415 HydrophobicContact CE1-CG 3.93Å; Y396-K415 HydrophobicContact CE2-CB 4.14Å; Y396-K415 HydrophobicContact CE2-CG 3.96Å; Y396-K415 VanDerWaalsContact CZ-CG 3.49Å; Y396-K415 WeakPolarHBondContact OH-CB 3.41Å; Y396-K415 WeakPolarHBondContact OH-CD 3.36Å; Y396-K415 WeakPolarHBondContact OH-CG 3.36Å; Y396-L418 HydrophobicContact CD2-CD2 4.12Å; Y396-L418 HydrophobicContact CE2-CD2 4.46Å; Y396-F419 HydrophobicContact CD2-CE1 4.36Å; Y396-F419 HydrophobicContact CE2-CD1 4.44Å; Y396-F419 AromaticContact CE2-CE1 3.51Å; Y396-F419 HydrophobicContact CE2-CE1 3.51Å; Y396-F419 AromaticContact CE2-CZ 3.8Å; Y396-F419 HydrophobicContact CE2-CZ 3.8Å; Y396-F419 AromaticContact CZ-CZ 3.95Å; Y396-F419 WeakPolarHBondContact OH-CZ 3.46Å; Y396-I684 HydrophobicContact CD2-CD1 4.36Å; Y396-E697 HydrophobicContact CE1-CG 4.27Å; Y396-E697 VanDerWaalsContact CE1-OE1 3.31Å; Y396-E697 WeakPolarHBondContact CE1-OE1 3.42Å; Y396-E697 PolarHBondContact OH-OE1 3.27Å
397	E	89.4	Confident	87.5	Confident	103 Å²	103	49.9 Å²	49.9	48%	0.481	27%	0.266	S	S	.	.	H	α-helix	trans	-69.3	-43.4	179.1	-65	-175.1	168.4	0	0	111.5	D394 V395 L399 S400 H401	D394-E397 PolarHBondContact O-N 2.99Å; V395-E397 PolarHBondContact O-N 3.48Å; E397-L399 PolarHBondContact O-N 2.89Å; E397-S400 WeakPolarHBondContact CA-OG 3.32Å; E397-S400 PolarHBondContact O-N 3.12Å; E397-S400 PolarHBondContact O-OG 3.42Å; E397-H401 PolarHBondContact O-CD2 3.24Å; E397-H401 PolarHBondContact O-N 3.1Å
398	R	88.3	Confident	87.1	Confident	71 Å²	71	44.8 Å²	44.8	27%	0.268	25%	0.248	S	C	.	.	H	α-helix	trans	-62	-44.3	178.8	-175.4	173.9	-73.7	106	8.4	111.8	R392 D394 V395 S400 H401 A402 V619	R392-R398 VanDerWaalsContact CZ-NH1 3.26Å; R392-R398 VanDerWaalsContact NE-NH1 3.13Å; R392-R398 VanDerWaalsContact NH2-NH2 3.15Å; D394-R398 WeakPolarHBondContact O-CB 3.27Å; D394-R398 PolarHBondContact O-N 2.69Å; V395-R398 PolarHBondContact O-N 3.45Å; R398-S400 VanDerWaalsContact C-N 3.34Å; R398-H401 PolarHBondContact O-N 2.85Å; R398-A402 WeakPolarHBondContact O-CB 3.31Å; R398-A402 PolarHBondContact O-N 3.46Å; R398-V619 HydrophobicContact CG-CG2 3.96Å
399	L	89.4	Confident	86.4	Confident	6 Å²	6	44.1 Å²	44.1	3%	0.031	24%	0.237	C	C	.	.	H	α-helix	trans	-67.2	-35.9	176.2	-66.7	178.4	0	0	0	111.5	V395 E397 A402 L403 L418 L624 Y627 I684	V395-L399 HydrophobicContact CG1-CD1 3.53Å; V395-L399 HydrophobicContact CG1-CG 4.02Å; V395-L399 WeakPolarHBondContact O-CB 3.26Å; V395-L399 WeakPolarHBondContact O-CG 3.47Å; V395-L399 PolarHBondContact O-N 3.43Å; E397-L399 PolarHBondContact O-N 2.89Å; L399-A402 PolarHBondContact O-N 3.46Å; L399-L403 PolarHBondContact O-N 3.32Å; L399-L403 VanDerWaalsContact O-N 3.12Å; L399-L418 HydrophobicContact CB-CD1 4.14Å; L399-L418 HydrophobicContact CB-CD2 3.82Å; L399-L624 HydrophobicContact CD2-CD1 3.73Å; L399-Y627 HydrophobicContact CD1-CD1 4.38Å; L399-Y627 HydrophobicContact CD1-CE1 4.04Å; L399-I684 HydrophobicContact CD1-CG2 4.14Å
400	S	90	Very high	86.2	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-67.2	-38.6	175.2	63.7	0	0	0	0	112.8	Y396 E397 R398 L403 K414	Y396-S400 WeakPolarHBondContact O-CB 2.87Å; Y396-S400 PolarHBondContact O-N 3.34Å; Y396-S400 PolarHBondContact O-OG 3.01Å; E397-S400 WeakPolarHBondContact CA-OG 3.32Å; E397-S400 PolarHBondContact O-N 3.12Å; E397-S400 PolarHBondContact O-OG 3.42Å; R398-S400 VanDerWaalsContact C-N 3.34Å; S400-L403 WeakPolarHBondContact O-CB 3.48Å; S400-L403 PolarHBondContact O-N 3.39Å; S400-K414 WeakPolarHBondContact O-CD 3.31Å
401	H	84.9	Confident	86.2	Confident	83 Å²	83	47.2 Å²	47.2	38%	0.384	25%	0.249	S	C	.	.	H	α-helix	trans	-73.4	-33.2	176.9	-69.4	-56.1	0	0	0	112.4	E397 R398 L403 D411	E397-H401 PolarHBondContact O-CD2 3.24Å; E397-H401 PolarHBondContact O-N 3.1Å; R398-H401 PolarHBondContact O-N 2.85Å; H401-L403 PolarHBondContact O-N 3.05Å; H401-D411 IonicContact CE1-OD1 2.82Å; H401-D411 PolarHBondContact CE1-OD1 3.34Å; H401-D411 IonicContact CE1-OD2 3.16Å; H401-D411 IonicContact ND1-OD1 2.77Å; H401-D411 PolarHBondContact ND1-OD1 3.43Å
402	A	85.2	Confident	86.3	Confident	8 Å²	8	45.5 Å²	45.5	7%	0.066	23%	0.228	C	C	.	.	H	α-helix	trans	-67	-21.6	171.5	0	0	0	0	0	112.8	R398 L399 A404 V619	R398-A402 WeakPolarHBondContact O-CB 3.31Å; R398-A402 PolarHBondContact O-N 3.46Å; L399-A402 PolarHBondContact O-N 3.46Å; A402-A404 PolarHBondContact O-N 3.09Å; A402-V619 HydrophobicContact CB-CB 4.22Å
403	L	84.5	Confident	86.5	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.005	21%	0.208	C	C	.	.	S	Bend	trans	-77.7	112.5	175.4	-166.1	139.3	0	0	0	110.3	L399 S400 H401 K414 V417 L418 L421 L456 Y459	L399-L403 PolarHBondContact O-N 3.32Å; L399-L403 VanDerWaalsContact O-N 3.12Å; S400-L403 WeakPolarHBondContact O-CB 3.48Å; S400-L403 PolarHBondContact O-N 3.39Å; H401-L403 PolarHBondContact O-N 3.05Å; L403-K414 HydrophobicContact CD2-CB 4.19Å; L403-K414 HydrophobicContact CD2-CG 4.21Å; L403-K414 WeakPolarHBondContact O-CD 3.39Å; L403-K414 WeakPolarHBondContact O-CE 3.43Å; L403-K414 PolarHBondContact O-NZ 2.78Å; L403-V417 HydrophobicContact CD1-CB 4.45Å; L403-V417 HydrophobicContact CD1-CG1 3.91Å; L403-V417 HydrophobicContact CD2-CB 4.19Å; L403-V417 HydrophobicContact CD2-CG1 3.99Å; L403-L418 HydrophobicContact CD1-CD1 4.42Å; L403-L421 HydrophobicContact CD1-CD1 3.54Å; L403-L456 HydrophobicContact CD2-CD1 4.2Å; L403-Y459 HydrophobicContact CG-CE1 4.42Å
404	A	83.8	Confident	86.8	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	17%	0.173	C	C	.	.			trans	54	73.3	-179.8	0	0	0	0	0	113	A402 S406 I407 K414 L456 Y459	A402-A404 PolarHBondContact O-N 3.09Å; A404-S406 PolarHBondContact O-N 3.48Å; A404-I407 HydrophobicContact CB-CB 4.41Å; A404-I407 HydrophobicContact CB-CD1 3.89Å; A404-I407 HydrophobicContact CB-CG1 4.19Å; A404-I407 PolarHBondContact O-N 3.16Å; A404-I407 VanDerWaalsContact O-N 3.12Å; A404-K414 PolarHBondContact O-NZ 2.76Å; A404-L456 HydrophobicContact CB-CD1 4.16Å; A404-Y459 HydrophobicContact CB-CD1 3.72Å; A404-Y459 HydrophobicContact CB-CD2 4.34Å; A404-Y459 HydrophobicContact CB-CE1 3.98Å; A404-Y459 HydrophobicContact CB-CG 3.91Å
405	P	81.5	Confident	87	Confident	32 Å²	32	32.4 Å²	32.4	21%	0.208	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-23	179.2	26.1	-34.7	0	0	0	113.1	I407 H602 L618	P405-I407 VanDerWaalsContact C-N 3.25Å; P405-I407 PolarHBondContact O-N 3.12Å; P405-H602 PolarHBondContact O-NE2 3.38Å; P405-L618 HydrophobicContact CB-CD1 3.93Å
406	S	81.9	Confident	87.2	Confident	31 Å²	31	32 Å²	32	22%	0.217	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-18.9	176.4	57.9	0	0	0	0	114.3	A404	A404-S406 PolarHBondContact O-N 3.48Å
407	I	86.1	Confident	87.4	Confident	14 Å²	14	30.9 Å²	30.9	7%	0.072	15%	0.152	C	C	.	.	S	Bend	trans	-93.5	116.8	178.8	-61.8	174.8	0	0	0	108	A404 P405 K414 A452 L456	A404-I407 HydrophobicContact CB-CB 4.41Å; A404-I407 HydrophobicContact CB-CD1 3.89Å; A404-I407 HydrophobicContact CB-CG1 4.19Å; A404-I407 PolarHBondContact O-N 3.16Å; A404-I407 VanDerWaalsContact O-N 3.12Å; P405-I407 VanDerWaalsContact C-N 3.25Å; P405-I407 PolarHBondContact O-N 3.12Å; I407-K414 WeakPolarHBondContact O-CE 3.3Å; I407-K414 PolarHBondContact O-NZ 3.46Å; I407-A452 HydrophobicContact CG1-CB 4.34Å; I407-L456 HydrophobicContact CD1-CB 3.67Å; I407-L456 HydrophobicContact CD1-CD1 3.6Å; I407-L456 HydrophobicContact CD1-CG 4.22Å
408	F	82.3	Confident	87.5	Confident	30 Å²	30	26 Å²	26	13%	0.132	13%	0.129	C	C	.	.			trans	-81.4	134.9	177.5	-176.3	-108.4	0	0	0	110.6	Y595 R598 L599 H602	F408-Y595 HydrophobicContact CD1-CE2 4.28Å; F408-Y595 HydrophobicContact CE1-CE2 4.36Å; F408-R598 HydrophobicContact CE1-CB 3.73Å; F408-R598 HydrophobicContact CZ-CB 3.63Å; F408-L599 HydrophobicContact CB-CD1 3.6Å; F408-L599 HydrophobicContact CD1-CB 4.08Å; F408-L599 HydrophobicContact CD1-CD1 4.17Å; F408-L599 HydrophobicContact CG-CD1 4.25Å; F408-H602 HydrophobicContact CB-CB 4.42Å; F408-H602 HydrophobicContact CD2-CB 3.73Å; F408-H602 AromaticContact CD2-CD2 3.98Å; F408-H602 AromaticContact CD2-CG 3.65Å; F408-H602 HydrophobicContact CE2-CB 4.31Å; F408-H602 HydrophobicContact CG-CB 4.2Å
409	E	77.4	Confident	87.8	Confident	58 Å²	58	22.6 Å²	22.6	27%	0.271	12%	0.116	S	C	.	.	S	Bend	trans	55.8	-168	-178.4	-66.7	-177.1	-177.6	0	0	112.6	Y595 R598	E409-Y595 HydrophobicContact CB-CE2 4.16Å; E409-Y595 HydrophobicContact CG-CE2 4.44Å; E409-Y595 WeakPolarHBondContact OE2-CD2 3.27Å; E409-Y595 WeakPolarHBondContact OE2-CE2 3.28Å; E409-R598 IonicContact OE1-CZ 2.71Å; E409-R598 IonicContact OE1-NH1 3.31Å; E409-R598 PolarHBondContact OE1-NH1 3.26Å; E409-R598 IonicContact OE1-NH2 3.93Å; E409-R598 PolarHBondContact OE1-NH2 3.08Å
410	H	84.5	Confident	88	Confident	55 Å²	55	22.4 Å²	22.4	26%	0.255	12%	0.115	S	C	.	.			trans	68.1	41.9	-169	-49	-62.8	0	0	0	116	D412 I413 K414	H410-D412 PolarHBondContact O-N 3.38Å; H410-I413 HydrophobicContact CB-CB 4.17Å; H410-I413 HydrophobicContact CB-CD1 4.03Å; H410-I413 HydrophobicContact CB-CG1 4.2Å; H410-I413 PolarHBondContact O-N 3.42Å; H410-K414 PolarHBondContact O-N 3.43Å; H410-K414 VanDerWaalsContact O-N 3.08Å
411	D	88.4	Confident	88.1	Confident	58 Å²	58	22.4 Å²	22.4	31%	0.31	12%	0.115	S	C	.	.	H	α-helix	trans	-56.6	-35.3	178.8	-62.1	-31.7	0	0	0	112.6	H401 I413 K414 K415	H401-D411 IonicContact CE1-OD1 2.82Å; H401-D411 PolarHBondContact CE1-OD1 3.34Å; H401-D411 IonicContact CE1-OD2 3.16Å; H401-D411 IonicContact ND1-OD1 2.77Å; H401-D411 PolarHBondContact ND1-OD1 3.43Å; D411-I413 VanDerWaalsContact C-N 3.34Å; D411-I413 PolarHBondContact O-N 3.28Å; D411-K414 PolarHBondContact O-N 3.08Å; D411-K415 WeakPolarHBondContact O-CB 3.35Å; D411-K415 WeakPolarHBondContact O-CG 3.27Å; D411-K415 PolarHBondContact O-N 2.86Å
412	D	91.2	Very high	88.4	Confident	51 Å²	51	18.5 Å²	18.5	27%	0.273	10%	0.097	S	C	.	.	H	α-helix	trans	-63.8	-38.7	177.7	-54.5	-26.8	0	0	0	112	H410 A416 L701	H410-D412 PolarHBondContact O-N 3.38Å; D412-A416 WeakPolarHBondContact O-CB 2.79Å; D412-A416 PolarHBondContact O-N 3.15Å; D412-L701 HydrophobicContact CB-CD1 4Å; D412-L701 WeakPolarHBondContact O-CD1 3.47Å
413	I	92.6	Very high	88.5	Confident	8 Å²	8	18.5 Å²	18.5	4%	0.041	10%	0.098	C	C	.	.	H	α-helix	trans	-70	-41.8	176.6	-58.4	-178.7	0	0	0	109.8	H410 D411 K415 A416 V417 L445 L456 F585 M587	H410-I413 HydrophobicContact CB-CB 4.17Å; H410-I413 HydrophobicContact CB-CD1 4.03Å; H410-I413 HydrophobicContact CB-CG1 4.2Å; H410-I413 PolarHBondContact O-N 3.42Å; D411-I413 VanDerWaalsContact C-N 3.34Å; D411-I413 PolarHBondContact O-N 3.28Å; I413-K415 PolarHBondContact O-N 3.19Å; I413-A416 WeakPolarHBondContact O-CB 3.29Å; I413-A416 PolarHBondContact O-N 3.37Å; I413-V417 WeakPolarHBondContact O-CG2 3.43Å; I413-V417 PolarHBondContact O-N 3.28Å; I413-L445 HydrophobicContact CG2-CD2 3.83Å; I413-L456 HydrophobicContact CG2-CD2 3.76Å; I413-F585 HydrophobicContact CD1-CB 4.28Å; I413-F585 HydrophobicContact CG1-CB 4.24Å; I413-F585 HydrophobicContact CG1-CD1 4.04Å; I413-F585 HydrophobicContact CG1-CG 4Å; I413-M587 HydrophobicContact CD1-CE 3.77Å; I413-M587 HydrophobicContact CD1-CG 3.47Å; I413-M587 VanDerWaalsContact CD1-CG 3.47Å; I413-M587 HydrophobicContact CD1-SD 3.59Å; I413-M587 VanDerWaalsContact CD1-SD 3.59Å
414	K	92.8	Very high	88.6	Confident	10 Å²	10	18.8 Å²	18.8	4%	0.043	10%	0.101	C	C	.	.	H	α-helix	trans	-62.7	-42.5	176.8	-65.5	-179.6	-179.8	-163.4	0	111.7	S400 L403 A404 I407 H410 D411 A416 V417 L418	S400-K414 WeakPolarHBondContact O-CD 3.31Å; L403-K414 HydrophobicContact CD2-CB 4.19Å; L403-K414 HydrophobicContact CD2-CG 4.21Å; L403-K414 WeakPolarHBondContact O-CD 3.39Å; L403-K414 WeakPolarHBondContact O-CE 3.43Å; L403-K414 PolarHBondContact O-NZ 2.78Å; A404-K414 PolarHBondContact O-NZ 2.76Å; I407-K414 WeakPolarHBondContact O-CE 3.3Å; I407-K414 PolarHBondContact O-NZ 3.46Å; H410-K414 PolarHBondContact O-N 3.43Å; H410-K414 VanDerWaalsContact O-N 3.08Å; D411-K414 PolarHBondContact O-N 3.08Å; K414-A416 VanDerWaalsContact C-N 3.34Å; K414-A416 PolarHBondContact O-N 3.29Å; K414-V417 PolarHBondContact O-N 3.18Å; K414-L418 PolarHBondContact O-N 2.92Å
415	K	93.2	Very high	88.7	Confident	29 Å²	29	19.5 Å²	19.5	13%	0.126	11%	0.105	C	C	.	.	H	α-helix	trans	-58.8	-42.9	172.3	-75.8	168.2	178.5	-179.2	0	112	Y396 D411 I413 L418 F419	Y396-K415 HydrophobicContact CE1-CD 3.73Å; Y396-K415 HydrophobicContact CE1-CG 3.93Å; Y396-K415 HydrophobicContact CE2-CB 4.14Å; Y396-K415 HydrophobicContact CE2-CG 3.96Å; Y396-K415 VanDerWaalsContact CZ-CG 3.49Å; Y396-K415 WeakPolarHBondContact OH-CB 3.41Å; Y396-K415 WeakPolarHBondContact OH-CD 3.36Å; Y396-K415 WeakPolarHBondContact OH-CG 3.36Å; D411-K415 WeakPolarHBondContact O-CB 3.35Å; D411-K415 WeakPolarHBondContact O-CG 3.27Å; D411-K415 PolarHBondContact O-N 2.86Å; I413-K415 PolarHBondContact O-N 3.19Å; K415-L418 VanDerWaalsContact O-CB 3.27Å; K415-L418 WeakPolarHBondContact O-CB 3.22Å; K415-L418 PolarHBondContact O-N 3.24Å; K415-F419 PolarHBondContact O-N 2.99Å
416	A	93.3	Very high	88.7	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-66.4	-43	176.5	0	0	0	0	0	112.8	D412 I413 K414 L418 F419 L420 I443 L583 F585 L701	D412-A416 WeakPolarHBondContact O-CB 2.79Å; D412-A416 PolarHBondContact O-N 3.15Å; I413-A416 WeakPolarHBondContact O-CB 3.29Å; I413-A416 PolarHBondContact O-N 3.37Å; K414-A416 VanDerWaalsContact C-N 3.34Å; K414-A416 PolarHBondContact O-N 3.29Å; A416-L418 PolarHBondContact O-N 2.7Å; A416-F419 WeakPolarHBondContact O-CB 3.5Å; A416-F419 PolarHBondContact O-N 3.29Å; A416-F419 VanDerWaalsContact O-N 3.11Å; A416-L420 PolarHBondContact O-N 3.31Å; A416-I443 HydrophobicContact CB-CD1 3.94Å; A416-I443 WeakPolarHBondContact O-CD1 3.36Å; A416-L583 HydrophobicContact CB-CD1 3.78Å; A416-F585 HydrophobicContact CB-CD2 4.34Å; A416-F585 HydrophobicContact CB-CE2 3.24Å; A416-F585 HydrophobicContact CB-CZ 3.47Å; A416-F585 VanDerWaalsContact CB-CZ 3.47Å; A416-L701 HydrophobicContact CB-CD2 4.03Å
417	V	93.6	Very high	88.5	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-61.7	-35.1	173.1	175.4	0	0	0	0	110.4	L403 I413 K414 L420 L421 L456 V460	L403-V417 HydrophobicContact CD1-CB 4.45Å; L403-V417 HydrophobicContact CD1-CG1 3.91Å; L403-V417 HydrophobicContact CD2-CB 4.19Å; L403-V417 HydrophobicContact CD2-CG1 3.99Å; I413-V417 WeakPolarHBondContact O-CG2 3.43Å; I413-V417 PolarHBondContact O-N 3.28Å; K414-V417 PolarHBondContact O-N 3.18Å; V417-L420 VanDerWaalsContact O-CB 3.26Å; V417-L420 WeakPolarHBondContact O-CB 3.34Å; V417-L420 PolarHBondContact O-N 2.72Å; V417-L421 HydrophobicContact CG1-CD1 4.44Å; V417-L421 HydrophobicContact CG1-CG 4.49Å; V417-L421 VanDerWaalsContact O-CG 3.31Å; V417-L421 WeakPolarHBondContact O-CG 3.27Å; V417-L421 PolarHBondContact O-N 3.11Å; V417-L456 HydrophobicContact CG2-CD2 4.12Å; V417-V460 HydrophobicContact CG1-CG2 3.55Å
418	L	93.5	Very high	87.7	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-59.9	-48.4	171.8	-163.9	68.1	0	0	0	110.8	Y396 L399 L403 K414 K415 A416 L420 L421 F422 I684	Y396-L418 HydrophobicContact CD2-CD2 4.12Å; Y396-L418 HydrophobicContact CE2-CD2 4.46Å; L399-L418 HydrophobicContact CB-CD1 4.14Å; L399-L418 HydrophobicContact CB-CD2 3.82Å; L403-L418 HydrophobicContact CD1-CD1 4.42Å; K414-L418 PolarHBondContact O-N 2.92Å; K415-L418 VanDerWaalsContact O-CB 3.27Å; K415-L418 WeakPolarHBondContact O-CB 3.22Å; K415-L418 PolarHBondContact O-N 3.24Å; A416-L418 PolarHBondContact O-N 2.7Å; L418-L420 VanDerWaalsContact C-N 3.27Å; L418-L420 PolarHBondContact O-N 2.82Å; L418-L421 WeakPolarHBondContact O-CB 3.24Å; L418-L421 PolarHBondContact O-N 2.98Å; L418-F422 HydrophobicContact CD1-CD2 4.38Å; L418-F422 HydrophobicContact CD1-CE2 3.67Å; L418-F422 HydrophobicContact CG-CD2 4.21Å; L418-F422 HydrophobicContact CG-CE2 3.83Å; L418-F422 VanDerWaalsContact O-CD2 3.28Å; L418-F422 WeakPolarHBondContact O-CD2 3.39Å; L418-F422 PolarHBondContact O-N 3.49Å; L418-I684 HydrophobicContact CD2-CD1 3.76Å; L418-I684 HydrophobicContact CD2-CG1 4.36Å; L418-I684 HydrophobicContact CD2-CG2 4.45Å; L418-I684 HydrophobicContact CG-CD1 3.85Å; L418-I684 HydrophobicContact CG-CG1 4.41Å
419	F	94.1	Very high	87	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-57.5	-39.1	174.8	-66.1	-15.1	0	0	0	113	Y396 K415 A416 L421 F422 G423 I441 L677 A680 R681 I684 L701	Y396-F419 HydrophobicContact CD2-CE1 4.36Å; Y396-F419 HydrophobicContact CE2-CD1 4.44Å; Y396-F419 AromaticContact CE2-CE1 3.51Å; Y396-F419 HydrophobicContact CE2-CE1 3.51Å; Y396-F419 AromaticContact CE2-CZ 3.8Å; Y396-F419 HydrophobicContact CE2-CZ 3.8Å; Y396-F419 AromaticContact CZ-CZ 3.95Å; Y396-F419 WeakPolarHBondContact OH-CZ 3.46Å; K415-F419 PolarHBondContact O-N 2.99Å; A416-F419 WeakPolarHBondContact O-CB 3.5Å; A416-F419 PolarHBondContact O-N 3.29Å; A416-F419 VanDerWaalsContact O-N 3.11Å; F419-L421 VanDerWaalsContact C-N 3.33Å; F419-L421 PolarHBondContact O-N 3.41Å; F419-F422 PolarHBondContact O-N 3.3Å; F419-G423 PolarHBondContact O-N 2.81Å; F419-I441 HydrophobicContact CB-CD1 4.09Å; F419-L677 HydrophobicContact CB-CD2 4.14Å; F419-L677 HydrophobicContact CD2-CD2 3.59Å; F419-L677 HydrophobicContact CE2-CD2 4.42Å; F419-L677 HydrophobicContact CG-CD2 4.29Å; F419-A680 HydrophobicContact CB-CB 4.11Å; F419-A680 HydrophobicContact CD1-CB 4.4Å; F419-A680 HydrophobicContact CG-CB 4.4Å; F419-R681 HydrophobicContact CE1-CB 3.8Å; F419-R681 HydrophobicContact CE1-CG 4.27Å; F419-R681 HydrophobicContact CZ-CB 3.97Å; F419-R681 HydrophobicContact CZ-CG 4.38Å; F419-I684 HydrophobicContact CD1-CD1 3.45Å; F419-I684 VanDerWaalsContact CD1-CD1 3.45Å; F419-I684 HydrophobicContact CE1-CD1 3.58Å; F419-L701 HydrophobicContact CD2-CD2 3.52Å; F419-L701 HydrophobicContact CE2-CD2 3.37Å; F419-L701 HydrophobicContact CZ-CD2 4.44Å
420	L	93.5	Very high	86.3	Confident	2 Å²	2	34 Å²	34	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-58.5	-44.6	173.4	-175.9	73.7	0	0	0	112	A416 V417 L418 F422 I441 I443 V507 S549 L551	A416-L420 PolarHBondContact O-N 3.31Å; V417-L420 VanDerWaalsContact O-CB 3.26Å; V417-L420 WeakPolarHBondContact O-CB 3.34Å; V417-L420 PolarHBondContact O-N 2.72Å; L418-L420 VanDerWaalsContact C-N 3.27Å; L418-L420 PolarHBondContact O-N 2.82Å; L420-F422 PolarHBondContact O-N 3.35Å; L420-I441 HydrophobicContact CD1-CB 4.23Å; L420-I441 WeakPolarHBondContact CD1-O 3.34Å; L420-I443 HydrophobicContact CB-CD1 3.8Å; L420-I443 HydrophobicContact CD1-CD1 4.38Å; L420-I443 HydrophobicContact CD1-CG1 4.31Å; L420-I443 HydrophobicContact CD2-CD1 4.43Å; L420-I443 HydrophobicContact CG-CD1 4.45Å; L420-V507 HydrophobicContact CD2-CG1 3.92Å; L420-V507 HydrophobicContact CD2-CG2 4.23Å; L420-V507 HydrophobicContact CG-CG2 4.24Å; L420-S549 WeakPolarHBondContact CD1-OG 3.48Å; L420-L551 HydrophobicContact CD2-CB 3.82Å; L420-L551 HydrophobicContact CD2-CD1 4.1Å; L420-L551 HydrophobicContact CD2-CD2 4.18Å; L420-L551 HydrophobicContact CD2-CG 4.23Å
421	L	91.8	Very high	85.2	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-65	-38.7	-176.7	-69.9	172.2	0	0	0	112.5	L403 V417 L418 F419 V460 L463 L464 I628 K632	L403-L421 HydrophobicContact CD1-CD1 3.54Å; V417-L421 HydrophobicContact CG1-CD1 4.44Å; V417-L421 HydrophobicContact CG1-CG 4.49Å; V417-L421 VanDerWaalsContact O-CG 3.31Å; V417-L421 WeakPolarHBondContact O-CG 3.27Å; V417-L421 PolarHBondContact O-N 3.11Å; L418-L421 WeakPolarHBondContact O-CB 3.24Å; L418-L421 PolarHBondContact O-N 2.98Å; F419-L421 VanDerWaalsContact C-N 3.33Å; F419-L421 PolarHBondContact O-N 3.41Å; L421-V460 HydrophobicContact CD2-CG1 4.39Å; L421-L463 HydrophobicContact CD1-CD2 3.67Å; L421-L463 HydrophobicContact CD2-CD2 4.43Å; L421-L464 HydrophobicContact CD2-CD1 3.62Å; L421-L464 HydrophobicContact CD2-CD2 3.62Å; L421-L464 HydrophobicContact CD2-CG 3.68Å; L421-I628 HydrophobicContact CB-CD1 4.2Å; L421-I628 HydrophobicContact CD1-CD1 3.98Å; L421-K632 WeakPolarHBondContact O-CE 3.34Å; L421-K632 PolarHBondContact O-NZ 3.27Å
422	F	90.7	Very high	84.1	Confident	2 Å²	2	39 Å²	39	1%	0.009	21%	0.212	C	C	.	.	H	α-helix	trans	-81.1	-40.4	177.1	-70.7	-90.9	0	0	0	112.9	L418 F419 L420 Y627 I628 A631 K632 K683 I684	L418-F422 HydrophobicContact CD1-CD2 4.38Å; L418-F422 HydrophobicContact CD1-CE2 3.67Å; L418-F422 HydrophobicContact CG-CD2 4.21Å; L418-F422 HydrophobicContact CG-CE2 3.83Å; L418-F422 VanDerWaalsContact O-CD2 3.28Å; L418-F422 WeakPolarHBondContact O-CD2 3.39Å; L418-F422 PolarHBondContact O-N 3.49Å; F419-F422 PolarHBondContact O-N 3.3Å; L420-F422 PolarHBondContact O-N 3.35Å; F422-Y627 AromaticContact CE1-CD1 3.74Å; F422-Y627 HydrophobicContact CE1-CD1 3.74Å; F422-Y627 AromaticContact CE1-CE1 3.68Å; F422-Y627 HydrophobicContact CE1-CE1 3.68Å; F422-Y627 AromaticContact CZ-CD1 3.55Å; F422-Y627 HydrophobicContact CZ-CD1 3.55Å; F422-Y627 AromaticContact CZ-CE1 3.57Å; F422-Y627 HydrophobicContact CZ-CE1 3.57Å; F422-I628 HydrophobicContact CE1-CG1 4.41Å; F422-I628 HydrophobicContact CE2-CG1 4.24Å; F422-I628 HydrophobicContact CZ-CG1 4Å; F422-A631 HydrophobicContact CD1-CB 3.58Å; F422-A631 HydrophobicContact CE1-CB 3.4Å; F422-A631 VanDerWaalsContact CE1-CB 3.4Å; F422-K632 VanDerWaalsContact O-CE 3.29Å; F422-K632 WeakPolarHBondContact O-CE 3.45Å; F422-K683 HydrophobicContact CB-CB 4.4Å; F422-K683 HydrophobicContact CD1-CB 4.35Å; F422-I684 HydrophobicContact CD1-CG1 4.31Å; F422-I684 HydrophobicContact CD2-CD1 3.96Å; F422-I684 HydrophobicContact CD2-CG1 3.35Å; F422-I684 HydrophobicContact CE1-CG1 4.33Å; F422-I684 HydrophobicContact CE2-CD1 4.21Å; F422-I684 HydrophobicContact CE2-CG1 3.44Å; F422-I684 VanDerWaalsContact CE2-CG1 3.44Å; F422-I684 HydrophobicContact CG-CG1 3.84Å; F422-I684 HydrophobicContact CZ-CG1 3.93Å
423	G	88.6	Confident	82.4	Confident	8 Å²	8	41.6 Å²	41.6	8%	0.082	24%	0.241	C	C	.	.			trans	64.5	169.2	-177	0	0	0	0	0	114.6	F419 K683	F419-G423 PolarHBondContact O-N 2.81Å; G423-K683 WeakPolarHBondContact O-CD 3.49Å; G423-K683 WeakPolarHBondContact O-CE 3.24Å; G423-K683 PolarHBondContact O-NZ 2.91Å
424	G	86.2	Confident	80.6	Confident	7 Å²	7	45.2 Å²	45.2	7%	0.072	27%	0.267	C	S	.	.			trans	-75.9	-180	176.8	0	0	0	0	0	113.8	A439 K683	G424-A439 VanDerWaalsContact CA-O 3.3Å; G424-A439 WeakPolarHBondContact CA-O 3.33Å; G424-A439 PolarHBondContact N-O 2.97Å; G424-K683 VanDerWaalsContact C-NZ 3.28Å; G424-K683 PolarHBondContact O-NZ 3.42Å
425	T	86.3	Confident	78.9	Confident	14 Å²	14	47.4 Å²	47.4	9%	0.086	29%	0.292	C	S	.	.			trans	-86.7	144.4	175.8	60.3	0	0	0	0	112	A439 A636 P637 E679	T425-A439 VanDerWaalsContact O-CB 3.29Å; T425-A439 WeakPolarHBondContact O-CB 3.48Å; T425-A636 HydrophobicContact CG2-CB 4.36Å; T425-P637 HydrophobicContact CG2-CG 3.62Å; T425-E679 WeakPolarHBondContact CB-OE2 3.32Å; T425-E679 PolarHBondContact N-OE2 3.45Å; T425-E679 VanDerWaalsContact OG1-CD 3.26Å; T425-E679 PolarHBondContact OG1-OE2 2.86Å
426	R	81.5	Confident	77.7	Confident	107 Å²	107	54.2 Å²	54.2	40%	0.404	32%	0.318	S	S	.	.			trans	-82.4	121	170.8	-68.7	-177.2	174.5	175.9	-1.7	108.3	A439 E440 N505 R547	R426-A439 HydrophobicContact CG-CB 3.8Å; R426-E440 IonicContact CZ-OE1 2.86Å; R426-E440 IonicContact NH2-OE1 3.93Å; R426-E440 PolarHBondContact NH2-OE1 3.15Å; R426-N505 VanDerWaalsContact CZ-OD1 3.25Å; R426-N505 PolarHBondContact NH1-OD1 2.87Å; R426-N505 PolarHBondContact NH2-OD1 2.69Å; R426-R547 VanDerWaalsContact NH2-CB 3.28Å; R426-R547 VanDerWaalsContact NH2-CD 3.34Å
427	K	77.3	Confident	76.8	Confident	62 Å²	62	56.5 Å²	56.5	27%	0.27	33%	0.334	S	S	.	.			trans	-112.5	116.3	177.8	-69.1	171.8	175.4	166.4	0	108.1	F429 E679	K427-F429 HydrophobicContact CB-CD2 4.19Å; K427-F429 HydrophobicContact CB-CE2 3.57Å; K427-F429 HydrophobicContact CB-CZ 3.84Å; K427-F429 HydrophobicContact CD-CE2 4.36Å; K427-F429 HydrophobicContact CD-CZ 4.02Å; K427-F429 WeakPolarHBondContact O-CD2 3.27Å; K427-F429 PolarHBondContact O-N 3.41Å; K427-E679 WeakPolarHBondContact CE-OE1 3.36Å; K427-E679 IonicContact NZ-OE1 3.98Å; K427-E679 PolarHBondContact NZ-OE1 3.31Å
428	D	68.5	Low	76.5	Confident	106 Å²	106	57.2 Å²	57.2	57%	0.567	34%	0.337	S	S	*	.			trans	-84.7	100.7	177.1	-66.5	-20.1	0	0	0	109	T430 Y436	D428-T430 PolarHBondContact O-N 2.71Å; D428-Y436 WeakPolarHBondContact OD1-CD1 3.35Å; D428-Y436 WeakPolarHBondContact OD1-CE1 3.36Å
429	F	67.7	Low	76.2	Confident	87 Å²	87	57.4 Å²	57.4	38%	0.382	34%	0.338	S	S	.	.			trans	-87	23.7	177.2	-67.7	-72.8	0	0	0	113.1	K427 S431 V432 S434	K427-F429 HydrophobicContact CB-CD2 4.19Å; K427-F429 HydrophobicContact CB-CE2 3.57Å; K427-F429 HydrophobicContact CB-CZ 3.84Å; K427-F429 HydrophobicContact CD-CE2 4.36Å; K427-F429 HydrophobicContact CD-CZ 4.02Å; K427-F429 WeakPolarHBondContact O-CD2 3.27Å; K427-F429 PolarHBondContact O-N 3.41Å; F429-S431 PolarHBondContact O-N 3.27Å; F429-V432 PolarHBondContact O-N 3.26Å; F429-S434 WeakPolarHBondContact CB-O 3.42Å
430	T	63.3	Low	76	Confident	108 Å²	108	58.2 Å²	58.2	66%	0.663	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-56.8	-22.1	-174.6	50.8	0	0	0	0	113.4	D428	D428-T430 PolarHBondContact O-N 2.71Å
431	S	61.5	Low	76	Confident	109 Å²	109	58.1 Å²	58.1	76%	0.762	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-75.9	-20	174.8	57.2	0	0	0	0	115.4	F429	F429-S431 PolarHBondContact O-N 3.27Å
432	V	64.5	Low	76.2	Confident	109 Å²	109	58.2 Å²	58.2	66%	0.661	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-113.2	16.7	-171.5	-169.4	0	0	0	0	112	F429 S434	F429-V432 PolarHBondContact O-N 3.26Å; V432-S434 PolarHBondContact O-N 2.91Å
433	A	55.2	Low	76.3	Confident	106 Å²	106	58.1 Å²	58.1	88%	0.876	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	-0.2	176.8	0	0	0	0	0	116.6
434	S	54.8	Low	76.5	Confident	84 Å²	84	57.9 Å²	57.9	59%	0.587	34%	0.338	S	S	*	.			trans	-97.3	132.5	173.3	-163.9	0	0	0	0	109.1	F429 V432	F429-S434 WeakPolarHBondContact CB-O 3.42Å; V432-S434 PolarHBondContact O-N 2.91Å
435	G	58.4	Low	76.9	Confident	56 Å²	56	57.5 Å²	57.5	58%	0.577	34%	0.335	S	S	*	.			trans	-58.7	-178.4	-175	0	0	0	0	0	114.5	S437	G435-S437 PolarHBondContact O-N 3.26Å
436	Y	67.2	Low	77	Confident	172 Å²	172	57 Å²	57	68%	0.675	33%	0.332	S	S	*	.	P	Polyproline II helix	trans	-53	129.6	177.9	-59.3	-81.4	0	0	0	111.2	D428	D428-Y436 WeakPolarHBondContact OD1-CD1 3.35Å; D428-Y436 WeakPolarHBondContact OD1-CE1 3.36Å
437	S	74.3	Confident	77.3	Confident	47 Å²	47	51.9 Å²	51.9	33%	0.329	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-78.3	129.3	170.8	-178.1	0	0	0	0	109.4	G435 A439	G435-S437 PolarHBondContact O-N 3.26Å; S437-A439 PolarHBondContact O-N 3.3Å
438	R	87.1	Confident	77.9	Confident	16 Å²	16	49.7 Å²	49.7	6%	0.06	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-57.5	127.3	173.8	165.8	173.5	167.6	-140	-25.1	109.6	E440 N442 M528 Q531 R580 D582 R676	R438-E440 PolarHBondContact NE-O 3.23Å; R438-E440 PolarHBondContact NH2-O 3.43Å; R438-N442 PolarHBondContact NH1-ND2 2.95Å; R438-N442 PolarHBondContact NH2-ND2 2.92Å; R438-M528 WeakPolarHBondContact CD-O 3.39Å; R438-M528 PolarHBondContact NE-O 2.82Å; R438-M528 PolarHBondContact NH1-O 3.47Å; R438-Q531 HydrophobicContact CB-CG 4.29Å; R438-Q531 HydrophobicContact CG-CG 4.11Å; R438-R580 PolarHBondContact NH1-O 2.9Å; R438-D582 IonicContact CZ-OD2 2.64Å; R438-D582 IonicContact NH2-OD1 2.66Å; R438-D582 IonicContact NH2-OD2 3.22Å; R438-D582 PolarHBondContact NH2-OD2 2.89Å; R438-R676 PolarHBondContact O-NE 2.85Å; R438-R676 PolarHBondContact O-NH2 2.88Å
439	A	87.2	Confident	78.9	Confident	4 Å²	4	48.4 Å²	48.4	3%	0.033	30%	0.301	C	S	.	.			trans	-102.8	-23	179.4	0	0	0	0	0	113.3	G424 T425 R426 S437	G424-A439 VanDerWaalsContact CA-O 3.3Å; G424-A439 WeakPolarHBondContact CA-O 3.33Å; G424-A439 PolarHBondContact N-O 2.97Å; T425-A439 VanDerWaalsContact O-CB 3.29Å; T425-A439 WeakPolarHBondContact O-CB 3.48Å; R426-A439 HydrophobicContact CG-CB 3.8Å; S437-A439 PolarHBondContact O-N 3.3Å
440	E	91	Very high	79.7	Confident	17 Å²	17	48 Å²	48	8%	0.079	32%	0.321	C	S	.	.			trans	-79.5	142.1	-175.2	-78	139.9	-135	0	0	112.7	R426 R438 Q531 R547 S548 S549	R426-E440 IonicContact CZ-OE1 2.86Å; R426-E440 IonicContact NH2-OE1 3.93Å; R426-E440 PolarHBondContact NH2-OE1 3.15Å; R438-E440 PolarHBondContact NE-O 3.23Å; R438-E440 PolarHBondContact NH2-O 3.43Å; E440-Q531 PolarHBondContact OE1-NE2 2.93Å; E440-Q531 VanDerWaalsContact OE1-NE2 3.13Å; E440-Q531 PolarHBondContact OE2-NE2 2.99Å; E440-R547 VanDerWaalsContact OE1-CB 3.25Å; E440-R547 WeakPolarHBondContact OE1-CB 3.46Å; E440-R547 VanDerWaalsContact OE2-CA 3.31Å; E440-R547 WeakPolarHBondContact OE2-CA 3.42Å; E440-R547 VanDerWaalsContact OE2-O 3.09Å; E440-S548 PolarHBondContact OE2-N 3.48Å; E440-S549 WeakPolarHBondContact CB-OG 3.39Å
441	I	93.5	Very high	80.8	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	30%	0.295	C	S	.	.			trans	-91.9	142.1	178.8	-53.9	178.9	0	0	0	107.8	F419 L420 I443 S549 D582 R676 L677 A680	F419-I441 HydrophobicContact CB-CD1 4.09Å; L420-I441 HydrophobicContact CD1-CB 4.23Å; L420-I441 WeakPolarHBondContact CD1-O 3.34Å; I441-I443 HydrophobicContact CG2-CG1 4.27Å; I441-S549 PolarHBondContact N-OG 2.88Å; I441-S549 WeakPolarHBondContact O-CB 3.3Å; I441-S549 PolarHBondContact O-OG 3.12Å; I441-D582 VanDerWaalsContact CA-OD2 3.31Å; I441-D582 WeakPolarHBondContact CA-OD2 3.34Å; I441-D582 HydrophobicContact CG2-CB 4.02Å; I441-R676 HydrophobicContact CG1-CB 4.18Å; I441-L677 HydrophobicContact CD1-CD2 3.87Å; I441-L677 HydrophobicContact CD1-CG 4.47Å; I441-L677 HydrophobicContact CG2-CD2 4.25Å; I441-A680 HydrophobicContact CD1-CB 3.91Å
442	N	94.6	Very high	82.1	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.011	27%	0.274	C	S	.	.			trans	-120.3	131.2	174.4	-69.9	-22.6	0	0	0	109.7	R438 M528 I550 F581 D582 L583	R438-N442 PolarHBondContact NH1-ND2 2.95Å; R438-N442 PolarHBondContact NH2-ND2 2.92Å; N442-M528 HydrophobicContact CB-CE 3.94Å; N442-M528 WeakPolarHBondContact ND2-CE 3.34Å; N442-I550 WeakPolarHBondContact CA-O 3.39Å; N442-I550 PolarHBondContact OD1-N 3.32Å; N442-F581 HydrophobicContact CB-CD1 3.88Å; N442-F581 HydrophobicContact CB-CE1 4.44Å; N442-D582 PolarHBondContact N-OD2 3.46Å; N442-D582 PolarHBondContact O-N 2.99Å; N442-L583 PolarHBondContact O-N 2.92Å
443	I	94.3	Very high	83.4	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	135.3	-176.5	-59.1	179.9	0	0	0	109.9	A416 L420 I441 L445 I550 L551 A552 L583 F585	A416-I443 HydrophobicContact CB-CD1 3.94Å; A416-I443 WeakPolarHBondContact O-CD1 3.36Å; L420-I443 HydrophobicContact CB-CD1 3.8Å; L420-I443 HydrophobicContact CD1-CD1 4.38Å; L420-I443 HydrophobicContact CD1-CG1 4.31Å; L420-I443 HydrophobicContact CD2-CD1 4.43Å; L420-I443 HydrophobicContact CG-CD1 4.45Å; I441-I443 HydrophobicContact CG2-CG1 4.27Å; I443-L445 HydrophobicContact CG2-CD2 3.92Å; I443-L445 HydrophobicContact CG2-CG 4.48Å; I443-I550 PolarHBondContact N-O 2.7Å; I443-L551 HydrophobicContact CB-CD1 3.74Å; I443-L551 HydrophobicContact CG2-CD1 3.86Å; I443-A552 PolarHBondContact O-N 2.68Å; I443-L583 WeakPolarHBondContact CA-O 3.41Å; I443-L583 HydrophobicContact CG1-CB 4.33Å; I443-F585 HydrophobicContact CG2-CD2 4.06Å; I443-F585 HydrophobicContact CG2-CE2 4.35Å
444	L	93.1	Very high	85.1	Confident	2 Å²	2	32.7 Å²	32.7	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.3	172.5	-180	65.7	0	0	0	110.2	F513 A552 A554 L573 F581 L583 I584 F585	L444-F513 HydrophobicContact CD1-CD1 4.38Å; L444-A552 CarbonylContact C-O 3.58Å; L444-A552 WeakPolarHBondContact CA-O 3.47Å; L444-A552 HydrophobicContact CD1-CB 3.75Å; L444-A554 HydrophobicContact CD1-CB 4.12Å; L444-L573 HydrophobicContact CD2-CD1 3.96Å; L444-F581 HydrophobicContact CB-CB 4.32Å; L444-F581 HydrophobicContact CB-CD1 3.78Å; L444-F581 HydrophobicContact CB-CD2 4.1Å; L444-F581 HydrophobicContact CB-CE1 4.05Å; L444-F581 HydrophobicContact CB-CE2 4.34Å; L444-F581 HydrophobicContact CB-CG 3.8Å; L444-F581 HydrophobicContact CB-CZ 4.32Å; L444-F581 HydrophobicContact CD1-CE2 4.47Å; L444-F581 HydrophobicContact CD1-CZ 4.28Å; L444-F581 HydrophobicContact CD2-CD2 4.1Å; L444-F581 HydrophobicContact CD2-CE2 4.15Å; L444-L583 PolarHBondContact N-O 3.43Å; L444-I584 HydrophobicContact CB-CG1 4.36Å; L444-I584 HydrophobicContact CD2-CG2 4.28Å; L444-I584 WeakPolarHBondContact O-CA 2.99Å; L444-F585 PolarHBondContact O-N 3.38Å
445	L	93.1	Very high	86.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	106.9	175.5	-53.4	178.1	0	0	0	109.2	I413 I443 K453 L456 L551 A552 A553 A554 F585	I413-L445 HydrophobicContact CG2-CD2 3.83Å; I443-L445 HydrophobicContact CG2-CD2 3.92Å; I443-L445 HydrophobicContact CG2-CG 4.48Å; L445-K453 HydrophobicContact CB-CD 4.25Å; L445-K453 HydrophobicContact CB-CG 4.49Å; L445-L456 HydrophobicContact CD1-CD2 3.75Å; L445-L551 HydrophobicContact CD1-CD1 4.3Å; L445-L551 HydrophobicContact CG-CD1 4.4Å; L445-A552 PolarHBondContact N-O 3.5Å; L445-A553 CarbonylContact O-C 3.53Å; L445-A553 WeakPolarHBondContact O-CA 3.22Å; L445-A554 PolarHBondContact O-N 2.82Å; L445-F585 HydrophobicContact CD2-CB 4.02Å; L445-F585 HydrophobicContact CD2-CD2 4.15Å; L445-F585 HydrophobicContact CD2-CG 4.5Å
446	C	89.5	Confident	88.4	Confident	3 Å²	3	30.2 Å²	30.2	2%	0.02	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	154.2	174.9	-66.7	0	0	0	0	109.8	A554 V571 F585 L586 M587	C446-A554 WeakPolarHBondContact CA-O 3.04Å; C446-V571 HydrophobicContact CB-CG2 4.43Å; C446-F585 PolarHBondContact N-O 3.4Å; C446-L586 HydrophobicContact CB-CD1 4.24Å; C446-M587 PolarHBondContact O-N 2.84Å
447	G	87.8	Confident	89.7	Confident	0 Å²	0	22 Å²	22	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	152.3	-177.9	179.4	0	0	0	0	0	115.5	K453 P556 M587	G447-K453 PolarHBondContact O-NZ 3.19Å; G447-P556 WeakPolarHBondContact O-CD 3.46Å; G447-M587 CarbonylContact C-O 3.55Å; G447-M587 WeakPolarHBondContact CA-O 3.4Å
448	D	89.3	Confident	90.5	Very high	15 Å²	15	22.8 Å²	22.8	8%	0.08	15%	0.149	C	C	.	.			trans	-70.7	154.7	180	-61.4	-43.7	0	0	0	112.3	T451 Q560 W561 M587 D589	D448-T451 HydrophobicContact CB-CG2 4.29Å; D448-T451 PolarHBondContact O-OG1 3.46Å; D448-Q560 WeakPolarHBondContact OD1-CA 3.43Å; D448-W561 WeakPolarHBondContact OD1-CB 3.12Å; D448-W561 PolarHBondContact OD1-N 3.09Å; D448-M587 PolarHBondContact N-O 3.22Å; D448-M587 VanDerWaalsContact N-O 3.15Å; D448-D589 HydrophobicContact CB-CB 4.29Å; D448-D589 PolarHBondContact OD2-N 3.04Å
449	P	89.5	Confident	90.6	Very high	79 Å²	79	24.1 Å²	24.1	51%	0.513	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	136.3	168.1	29.6	-32.8	0	0	0	109	S559	P449-S559 WeakPolarHBondContact CD-O 3.48Å
450	G	85	Confident	90.8	Very high	79 Å²	79	23.9 Å²	23.9	81%	0.814	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	108.6	-16.2	-178.2	0	0	0	0	0	114.4	A452	G450-A452 PolarHBondContact O-N 3.38Å
451	T	86.7	Confident	90.7	Very high	16 Å²	16	25 Å²	25	10%	0.098	16%	0.157	C	C	.	.	S	Bend	trans	-78.4	33.3	-179.8	72.9	0	0	0	0	114	D448 K453 M587 D589	D448-T451 HydrophobicContact CB-CG2 4.29Å; D448-T451 PolarHBondContact O-OG1 3.46Å; T451-K453 PolarHBondContact O-N 3.47Å; T451-K453 WeakPolarHBondContact OG1-CE 3.18Å; T451-K453 WeakPolarHBondContact OG1-CG 3.33Å; T451-M587 HydrophobicContact CG2-CB 4.33Å; T451-M587 WeakPolarHBondContact O-CE 3.46Å; T451-D589 HydrophobicContact CG2-CB 4.09Å
452	A	88.5	Confident	90.4	Very high	41 Å²	41	32.5 Å²	32.5	34%	0.339	19%	0.186	S	C	.	.	S	Bend	trans	54.1	15.2	177.3	0	0	0	0	0	117.9	I407 G450 S454 Q455 L456	I407-A452 HydrophobicContact CG1-CB 4.34Å; G450-A452 PolarHBondContact O-N 3.38Å; A452-S454 PolarHBondContact O-N 3.32Å; A452-Q455 HydrophobicContact CB-CB 4.38Å; A452-Q455 WeakPolarHBondContact O-CB 3.4Å; A452-Q455 PolarHBondContact O-N 2.89Å; A452-Q455 VanDerWaalsContact O-N 3.13Å; A452-L456 PolarHBondContact O-N 2.94Å
453	K	91.2	Very high	89.9	Confident	8 Å²	8	32.5 Å²	32.5	4%	0.035	19%	0.186	C	C	.	.	H	α-helix	trans	-56.8	-50.4	-178.8	-61.3	-179	-155.8	154.5	0	113.7	L445 G447 T451 Q455 L456 L457 A553 A554 N555 M587	L445-K453 HydrophobicContact CB-CD 4.25Å; L445-K453 HydrophobicContact CB-CG 4.49Å; G447-K453 PolarHBondContact O-NZ 3.19Å; T451-K453 PolarHBondContact O-N 3.47Å; T451-K453 WeakPolarHBondContact OG1-CE 3.18Å; T451-K453 WeakPolarHBondContact OG1-CG 3.33Å; K453-Q455 PolarHBondContact O-N 3.45Å; K453-L456 WeakPolarHBondContact O-CB 3.11Å; K453-L456 PolarHBondContact O-N 3.3Å; K453-L456 VanDerWaalsContact O-N 3.13Å; K453-L457 PolarHBondContact O-N 2.92Å; K453-A553 HydrophobicContact CB-CB 4.13Å; K453-A553 HydrophobicContact CD-CB 4.3Å; K453-A554 PolarHBondContact NZ-O 2.59Å; K453-N555 PolarHBondContact NZ-OD1 3.27Å; K453-M587 HydrophobicContact CD-SD 4.34Å; K453-M587 HydrophobicContact CG-SD 3.58Å; K453-M587 VanDerWaalsContact CG-SD 3.58Å
454	S	91.2	Very high	89.2	Confident	46 Å²	46	33.2 Å²	33.2	32%	0.322	19%	0.189	S	C	.	.	H	α-helix	trans	-63.1	-32.7	179.4	-55.9	0	0	0	0	111.5	A452 L457 Q458 D511	A452-S454 PolarHBondContact O-N 3.32Å; S454-L457 PolarHBondContact O-N 3.4Å; S454-Q458 VanDerWaalsContact O-CG 3.29Å; S454-Q458 WeakPolarHBondContact O-CG 3.27Å; S454-Q458 PolarHBondContact O-N 2.8Å; S454-D511 WeakPolarHBondContact CB-OD2 3.32Å; S454-D511 PolarHBondContact OG-OD1 3.31Å; S454-D511 PolarHBondContact OG-OD2 2.88Å
455	Q	90.9	Very high	88.3	Confident	82 Å²	82	37 Å²	37	38%	0.383	21%	0.214	S	C	.	.	H	α-helix	trans	-66.9	-40.8	174.9	-171.4	62.7	29	0	0	111.4	A452 K453 Q458 Y459	A452-Q455 HydrophobicContact CB-CB 4.38Å; A452-Q455 WeakPolarHBondContact O-CB 3.4Å; A452-Q455 PolarHBondContact O-N 2.89Å; A452-Q455 VanDerWaalsContact O-N 3.13Å; K453-Q455 PolarHBondContact O-N 3.45Å; Q455-Q458 PolarHBondContact O-N 3.07Å; Q455-Y459 WeakPolarHBondContact O-CB 3.29Å; Q455-Y459 PolarHBondContact O-N 3.25Å
456	L	92.7	Very high	87.6	Confident	6 Å²	6	38.5 Å²	38.5	3%	0.031	22%	0.22	C	C	.	.	H	α-helix	trans	-62.5	-45.4	174.9	-172.4	69.5	0	0	0	111.3	L403 A404 I407 I413 V417 L445 A452 K453 Q458 Y459 V460	L403-L456 HydrophobicContact CD2-CD1 4.2Å; A404-L456 HydrophobicContact CB-CD1 4.16Å; I407-L456 HydrophobicContact CD1-CB 3.67Å; I407-L456 HydrophobicContact CD1-CD1 3.6Å; I407-L456 HydrophobicContact CD1-CG 4.22Å; I413-L456 HydrophobicContact CG2-CD2 3.76Å; V417-L456 HydrophobicContact CG2-CD2 4.12Å; L445-L456 HydrophobicContact CD1-CD2 3.75Å; A452-L456 PolarHBondContact O-N 2.94Å; K453-L456 WeakPolarHBondContact O-CB 3.11Å; K453-L456 PolarHBondContact O-N 3.3Å; K453-L456 VanDerWaalsContact O-N 3.13Å; L456-Q458 PolarHBondContact O-N 2.83Å; L456-Y459 PolarHBondContact O-N 3.09Å; L456-V460 WeakPolarHBondContact O-CG2 3.41Å; L456-V460 PolarHBondContact O-N 3.17Å
457	L	93.6	Very high	87.3	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-57.6	-46.8	175	-67.4	-173.9	0	0	0	111.9	K453 S454 Y459 V460 H461 Y469 C509 D511 L551 A553	K453-L457 PolarHBondContact O-N 2.92Å; S454-L457 PolarHBondContact O-N 3.4Å; L457-Y459 VanDerWaalsContact C-N 3.32Å; L457-Y459 PolarHBondContact O-N 3.11Å; L457-V460 PolarHBondContact O-N 3.12Å; L457-H461 WeakPolarHBondContact O-CB 3.36Å; L457-H461 PolarHBondContact O-N 2.74Å; L457-Y469 HydrophobicContact CB-CD2 4.37Å; L457-Y469 HydrophobicContact CB-CE2 4.15Å; L457-Y469 HydrophobicContact CD1-CE2 4.42Å; L457-C509 HydrophobicContact CB-CB 4.18Å; L457-C509 HydrophobicContact CD2-CB 4.14Å; L457-D511 HydrophobicContact CD1-CB 3.91Å; L457-L551 HydrophobicContact CD2-CB 4.15Å; L457-L551 HydrophobicContact CD2-CD2 3.5Å; L457-L551 VanDerWaalsContact CD2-CD2 3.5Å; L457-L551 HydrophobicContact CD2-CG 3.39Å; L457-A553 HydrophobicContact CD1-CB 3.68Å; L457-A553 HydrophobicContact CG-CB 4.38Å
458	Q	90.9	Very high	87.3	Confident	62 Å²	62	39.9 Å²	39.9	29%	0.29	23%	0.227	S	C	.	.	H	α-helix	trans	-64.8	-36.5	178.9	-73.5	177.7	13.5	0	0	112.2	S454 Q455 L456 R462 Y469	S454-Q458 VanDerWaalsContact O-CG 3.29Å; S454-Q458 WeakPolarHBondContact O-CG 3.27Å; S454-Q458 PolarHBondContact O-N 2.8Å; Q455-Q458 PolarHBondContact O-N 3.07Å; L456-Q458 PolarHBondContact O-N 2.83Å; Q458-R462 WeakPolarHBondContact O-CG 3.46Å; Q458-R462 PolarHBondContact O-N 2.88Å; Q458-Y469 HydrophobicContact CG-CD2 4.44Å; Q458-Y469 HydrophobicContact CG-CE2 4.18Å
459	Y	90	Very high	87.5	Confident	44 Å²	44	43 Å²	43	17%	0.173	24%	0.238	C	C	.	.	H	α-helix	trans	-64.6	-48.4	175.4	-173.6	-93.8	0	0	0	111.4	L403 A404 Q455 L456 L457 H461 R462 L463	L403-Y459 HydrophobicContact CG-CE1 4.42Å; A404-Y459 HydrophobicContact CB-CD1 3.72Å; A404-Y459 HydrophobicContact CB-CD2 4.34Å; A404-Y459 HydrophobicContact CB-CE1 3.98Å; A404-Y459 HydrophobicContact CB-CG 3.91Å; Q455-Y459 WeakPolarHBondContact O-CB 3.29Å; Q455-Y459 PolarHBondContact O-N 3.25Å; L456-Y459 PolarHBondContact O-N 3.09Å; L457-Y459 VanDerWaalsContact C-N 3.32Å; L457-Y459 PolarHBondContact O-N 3.11Å; Y459-H461 VanDerWaalsContact C-N 3.29Å; Y459-H461 PolarHBondContact O-N 3.01Å; Y459-R462 PolarHBondContact O-N 2.97Å; Y459-R462 VanDerWaalsContact O-N 3.15Å; Y459-L463 PolarHBondContact O-N 2.96Å
460	V	91.4	Very high	87.6	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.7	-39.4	177.8	173.1	0	0	0	0	111.5	V417 L421 L456 L457 R462 L463 L464 V507 L551	V417-V460 HydrophobicContact CG1-CG2 3.55Å; L421-V460 HydrophobicContact CD2-CG1 4.39Å; L456-V460 WeakPolarHBondContact O-CG2 3.41Å; L456-V460 PolarHBondContact O-N 3.17Å; L457-V460 PolarHBondContact O-N 3.12Å; V460-R462 PolarHBondContact O-N 3.26Å; V460-L463 PolarHBondContact O-N 3.31Å; V460-L464 HydrophobicContact CG1-CD1 3.92Å; V460-L464 PolarHBondContact O-N 2.59Å; V460-V507 HydrophobicContact CG1-CG1 4.25Å; V460-L551 HydrophobicContact CB-CD2 4.2Å; V460-L551 HydrophobicContact CG1-CD2 4.14Å; V460-L551 HydrophobicContact CG2-CD2 4.02Å
461	H	89.2	Confident	87.9	Confident	39 Å²	39	37.9 Å²	37.9	18%	0.181	19%	0.191	C	C	.	.	H	α-helix	trans	-58.3	-44.2	174.5	173.1	-96.5	0	0	0	112.8	L457 Y459 G467 Q468 Y469	L457-H461 WeakPolarHBondContact O-CB 3.36Å; L457-H461 PolarHBondContact O-N 2.74Å; Y459-H461 VanDerWaalsContact C-N 3.29Å; Y459-H461 PolarHBondContact O-N 3.01Å; H461-G467 VanDerWaalsContact CD2-C 3.45Å; H461-G467 PolarHBondContact CD2-O 2.82Å; H461-G467 PolarHBondContact NE2-O 2.71Å; H461-Q468 VanDerWaalsContact CD2-C 3.46Å; H461-Y469 PolarHBondContact CD2-N 3.06Å
462	R	85.6	Confident	87.8	Confident	158 Å²	158	37.2 Å²	37.2	60%	0.596	19%	0.188	S	C	*	.	H	α-helix	trans	-74	-27.2	179.3	-67.3	176.9	-168.7	171.7	5	113.5	Q458 Y459 V460 K625	Q458-R462 WeakPolarHBondContact O-CG 3.46Å; Q458-R462 PolarHBondContact O-N 2.88Å; Y459-R462 PolarHBondContact O-N 2.97Å; Y459-R462 VanDerWaalsContact O-N 3.15Å; V460-R462 PolarHBondContact O-N 3.26Å; R462-K625 PolarHBondContact O-NZ 2.87Å
463	L	84.6	Confident	87.7	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.016	20%	0.199	C	C	.	.	H	α-helix	trans	-70.4	-41.7	178.4	-176.4	67.2	0	0	0	110.9	L421 Y459 V460 M621 L624 K625 I628	L421-L463 HydrophobicContact CD1-CD2 3.67Å; L421-L463 HydrophobicContact CD2-CD2 4.43Å; Y459-L463 PolarHBondContact O-N 2.96Å; V460-L463 PolarHBondContact O-N 3.31Å; L463-M621 HydrophobicContact CD1-CG 3.76Å; L463-M621 HydrophobicContact CD1-SD 4.37Å; L463-L624 HydrophobicContact CD1-CD2 4.02Å; L463-L624 HydrophobicContact CD1-CG 4.5Å; L463-L624 HydrophobicContact CD2-CD2 4.17Å; L463-K625 HydrophobicContact CD1-CG 3.84Å; L463-K625 WeakPolarHBondContact O-CD 3.41Å; L463-K625 WeakPolarHBondContact O-CE 3.46Å; L463-K625 PolarHBondContact O-NZ 3.35Å; L463-I628 HydrophobicContact CD2-CD1 4.34Å
464	L	80.3	Confident	87.3	Confident	14 Å²	14	44.4 Å²	44.4	7%	0.073	23%	0.23	C	C	.	.			trans	-89.7	134.1	-172.7	-73	167.8	0	0	0	112.4	L421 V460 R466 G467 V507	L421-L464 HydrophobicContact CD2-CD1 3.62Å; L421-L464 HydrophobicContact CD2-CD2 3.62Å; L421-L464 HydrophobicContact CD2-CG 3.68Å; V460-L464 HydrophobicContact CG1-CD1 3.92Å; V460-L464 PolarHBondContact O-N 2.59Å; L464-R466 VanDerWaalsContact C-N 3.3Å; L464-R466 PolarHBondContact O-N 3.2Å; L464-G467 PolarHBondContact O-N 3.34Å; L464-V507 HydrophobicContact CD1-CB 3.37Å; L464-V507 HydrophobicContact CD1-CG1 4.43Å; L464-V507 HydrophobicContact CD1-CG2 3.28Å
465	P	72.6	Confident	87	Confident	82 Å²	82	43.6 Å²	43.6	53%	0.532	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-43.8	173.5	24.4	-32	0	0	0	110.3	R327 G467	R327-P465 PolarHBondContact NH1-O 2.99Å; R327-P465 PolarHBondContact NH2-O 3.17Å; P465-G467 PolarHBondContact O-N 3.01Å
466	R	79.1	Confident	86.8	Confident	31 Å²	31	43 Å²	43	12%	0.117	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96	34.8	178.9	-64.5	-174.7	171.2	-168.9	-8.6	113.7	D365 L464 D504	D365-R466 IonicContact OD1-CZ 3.96Å; D365-R466 IonicContact OD1-NE 3.82Å; D365-R466 PolarHBondContact OD1-NE 3.06Å; D365-R466 IonicContact OD1-NH2 3.1Å; D365-R466 IonicContact OD2-CZ 3.34Å; D365-R466 IonicContact OD2-NE 3.36Å; D365-R466 PolarHBondContact OD2-NE 3.13Å; D365-R466 IonicContact OD2-NH2 3.18Å; D365-R466 PolarHBondContact OD2-NH2 3.01Å; L464-R466 VanDerWaalsContact C-N 3.3Å; L464-R466 PolarHBondContact O-N 3.2Å; R466-D504 WeakPolarHBondContact CD-O 3.37Å; R466-D504 PolarHBondContact NH1-O 3.45Å
467	G	83.2	Confident	86.5	Confident	3 Å²	3	43.1 Å²	43.1	3%	0.031	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	137.2	171.2	0	0	0	0	0	111.3	H461 L464 P465 V507	H461-G467 VanDerWaalsContact CD2-C 3.45Å; H461-G467 PolarHBondContact CD2-O 2.82Å; H461-G467 PolarHBondContact NE2-O 2.71Å; L464-G467 PolarHBondContact O-N 3.34Å; P465-G467 PolarHBondContact O-N 3.01Å; G467-V507 WeakPolarHBondContact CA-O 3.33Å
468	Q	88.8	Confident	86.1	Confident	30 Å²	30	44.8 Å²	44.8	14%	0.14	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130.3	167.1	-69.4	-64.6	-32.5	0	0	109.5	H461 L502 V507 C509	H461-Q468 VanDerWaalsContact CD2-C 3.46Å; Q468-L502 HydrophobicContact CG-CB 4.45Å; Q468-V507 PolarHBondContact N-O 3.08Å; Q468-V507 VanDerWaalsContact N-O 3.12Å; Q468-C509 PolarHBondContact O-N 3.02Å
469	Y	91.8	Very high	85.9	Confident	80 Å²	80	43.5 Å²	43.5	31%	0.314	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	123.5	175.5	179.1	-97.2	0	0	0	110.3	L457 Q458 H461 C509 D511	L457-Y469 HydrophobicContact CB-CD2 4.37Å; L457-Y469 HydrophobicContact CB-CE2 4.15Å; L457-Y469 HydrophobicContact CD1-CE2 4.42Å; Q458-Y469 HydrophobicContact CG-CD2 4.44Å; Q458-Y469 HydrophobicContact CG-CE2 4.18Å; H461-Y469 PolarHBondContact CD2-N 3.06Å; Y469-C509 HydrophobicContact CD2-CB 4.16Å; Y469-D511 HydrophobicContact CE2-CB 4.01Å; Y469-D511 WeakPolarHBondContact OH-CB 3.22Å; Y469-D511 PolarHBondContact OH-OD2 3.49Å
470	V	92.1	Very high	85.7	Confident	9 Å²	9	41.4 Å²	41.4	6%	0.055	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	132.8	-174.4	161.9	0	0	0	0	109.4	T475 L480 A499 C509 I510 D511	V470-T475 HydrophobicContact CB-CG2 4.23Å; V470-T475 HydrophobicContact CG1-CG2 3.23Å; V470-T475 VanDerWaalsContact CG1-OG1 3.23Å; V470-T475 WeakPolarHBondContact CG1-OG1 3.46Å; V470-T475 HydrophobicContact CG2-CG2 4.25Å; V470-L480 HydrophobicContact CG1-CD2 4.01Å; V470-L480 HydrophobicContact CG2-CD2 4.35Å; V470-A499 HydrophobicContact CG2-CB 3.67Å; V470-C509 PolarHBondContact N-O 3.26Å; V470-I510 HydrophobicContact CG1-CG2 4.48Å; V470-I510 CarbonylContact O-C 3.46Å; V470-I510 WeakPolarHBondContact O-CA 3.15Å; V470-D511 PolarHBondContact O-N 3.01Å
471	S	91.5	Very high	85.5	Confident	41 Å²	41	41.9 Å²	41.9	29%	0.287	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	133.4	166.2	172.6	0	0	0	0	110.5	K473 G474 T475	S471-K473 VanDerWaalsContact C-N 3.33Å; S471-K473 PolarHBondContact O-N 2.92Å; S471-G474 PolarHBondContact O-N 3.23Å; S471-T475 PolarHBondContact O-N 3.24Å; S471-T475 VanDerWaalsContact O-N 3.08Å; S471-T475 PolarHBondContact O-OG1 2.62Å
472	G	84.9	Confident	85.4	Confident	3 Å²	3	40 Å²	40	3%	0.031	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-34.7	-178.1	0	0	0	0	0	114.1	D511 M516	G472-D511 WeakPolarHBondContact CA-O 3.33Å; G472-D511 PolarHBondContact N-O 3.46Å; G472-M516 WeakPolarHBondContact O-CG 3.12Å
473	K	86.4	Confident	85.5	Confident	133 Å²	133	35.4 Å²	35.4	58%	0.578	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-39.7	172.5	-76.4	-175.2	171.5	162.6	0	113	S471 T475 E512 K515	S471-K473 VanDerWaalsContact C-N 3.33Å; S471-K473 PolarHBondContact O-N 2.92Å; K473-T475 PolarHBondContact O-N 3.05Å; K473-E512 WeakPolarHBondContact CD-OE2 3.12Å; K473-K515 HydrophobicContact CD-CB 4.19Å; K473-K515 HydrophobicContact CD-CD 4.13Å; K473-K515 HydrophobicContact CD-CG 4.39Å; K473-K515 HydrophobicContact CG-CB 3.47Å; K473-K515 VanDerWaalsContact CG-CB 3.47Å; K473-K515 HydrophobicContact CG-CD 4.22Å; K473-K515 HydrophobicContact CG-CG 4.2Å
474	G	83.7	Confident	85.7	Confident	67 Å²	67	37 Å²	37	69%	0.691	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-13.5	-176	0	0	0	0	0	113.6	S471	S471-G474 PolarHBondContact O-N 3.23Å
475	T	84.4	Confident	86	Confident	28 Å²	28	38.1 Å²	38.1	17%	0.172	23%	0.234	C	C	.	.			trans	-108.1	121	-174.5	48.2	0	0	0	0	113.8	V470 S471 K473	V470-T475 HydrophobicContact CB-CG2 4.23Å; V470-T475 HydrophobicContact CG1-CG2 3.23Å; V470-T475 VanDerWaalsContact CG1-OG1 3.23Å; V470-T475 WeakPolarHBondContact CG1-OG1 3.46Å; V470-T475 HydrophobicContact CG2-CG2 4.25Å; S471-T475 PolarHBondContact O-N 3.24Å; S471-T475 VanDerWaalsContact O-N 3.08Å; S471-T475 PolarHBondContact O-OG1 2.62Å; K473-T475 PolarHBondContact O-N 3.05Å
476	S	86.3	Confident	86.7	Confident	69 Å²	69	41.8 Å²	41.8	48%	0.483	24%	0.237	S	C	.	.			trans	-80.2	158	164	65.4	0	0	0	0	110.2	A478 G479 L480	S476-A478 PolarHBondContact O-N 2.83Å; S476-A478 VanDerWaalsContact O-N 3.15Å; S476-G479 PolarHBondContact O-N 3.44Å; S476-G479 PolarHBondContact OG-N 2.89Å; S476-L480 PolarHBondContact O-N 3.48Å; S476-L480 VanDerWaalsContact O-N 3.12Å
477	A	86.8	Confident	86.7	Confident	10 Å²	10	40.3 Å²	40.3	8%	0.083	23%	0.232	C	C	.	.	H	α-helix	trans	-52.6	-35.1	171	0	0	0	0	0	112.4	G479 L480 T481 Y519 T520 V523	A477-G479 PolarHBondContact O-N 3.25Å; A477-L480 PolarHBondContact O-N 3.24Å; A477-T481 WeakPolarHBondContact O-CB 3.41Å; A477-T481 WeakPolarHBondContact O-CG2 3.08Å; A477-T481 PolarHBondContact O-N 3.43Å; A477-T481 PolarHBondContact O-OG1 2.95Å; A477-Y519 HydrophobicContact CB-CD1 3.56Å; A477-Y519 HydrophobicContact CB-CE1 3.43Å; A477-Y519 VanDerWaalsContact CB-CE1 3.43Å; A477-T520 HydrophobicContact CB-CG2 4.31Å; A477-T520 PolarHBondContact N-OG1 2.94Å; A477-V523 HydrophobicContact CB-CG2 4.45Å
478	A	84.8	Confident	86.6	Confident	35 Å²	35	44.8 Å²	44.8	29%	0.289	26%	0.26	S	S	.	.	H	α-helix	trans	-66.6	-34.1	177	0	0	0	0	0	113.3	S476 H483	S476-A478 PolarHBondContact O-N 2.83Å; S476-A478 VanDerWaalsContact O-N 3.15Å; A478-H483 HydrophobicContact CB-CB 4.21Å
479	G	86	Confident	86	Confident	34 Å²	34	46.7 Å²	46.7	35%	0.351	27%	0.269	S	S	.	.	H	α-helix	trans	-75.1	-30.7	175.9	0	0	0	0	0	113.5	S476 A477 G498 A499	S476-G479 PolarHBondContact O-N 3.44Å; S476-G479 PolarHBondContact OG-N 2.89Å; A477-G479 PolarHBondContact O-N 3.25Å; G479-G498 CarbonylContact O-C 3.11Å; G479-G498 WeakPolarHBondContact O-CA 3.27Å; G479-A499 PolarHBondContact O-N 2.97Å
480	L	86.8	Confident	85.4	Confident	1 Å²	1	44.3 Å²	44.3	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-78.4	-36.5	175.1	-80.5	161.1	0	0	0	112.9	V470 S476 A477 G498 A499 L500 M516 T520	V470-L480 HydrophobicContact CG1-CD2 4.01Å; V470-L480 HydrophobicContact CG2-CD2 4.35Å; S476-L480 PolarHBondContact O-N 3.48Å; S476-L480 VanDerWaalsContact O-N 3.12Å; A477-L480 PolarHBondContact O-N 3.24Å; L480-G498 CarbonylContact O-C 3.59Å; L480-A499 HydrophobicContact CD2-CB 4.46Å; L480-A499 PolarHBondContact O-N 2.77Å; L480-L500 HydrophobicContact CB-CD1 4.1Å; L480-L500 HydrophobicContact CB-CG 4.45Å; L480-L500 HydrophobicContact CD2-CD1 4.31Å; L480-L500 HydrophobicContact CD2-CG 4.07Å; L480-L500 WeakPolarHBondContact O-CB 3.33Å; L480-L500 WeakPolarHBondContact O-CG 3.48Å; L480-L500 PolarHBondContact O-N 2.93Å; L480-M516 HydrophobicContact CD1-CE 3.55Å; L480-T520 HydrophobicContact CD1-CG2 3.23Å
481	T	86.6	Confident	84.9	Confident	10 Å²	10	50.3 Å²	50.3	6%	0.061	29%	0.288	C	S	.	.	S	Bend	trans	-93.8	-96	-172.2	55.2	0	0	0	0	113.2	A477 G498 V523 L533	A477-T481 WeakPolarHBondContact O-CB 3.41Å; A477-T481 WeakPolarHBondContact O-CG2 3.08Å; A477-T481 PolarHBondContact O-N 3.43Å; A477-T481 PolarHBondContact O-OG1 2.95Å; T481-G498 VanDerWaalsContact O-CA 3.22Å; T481-G498 WeakPolarHBondContact O-CA 3.44Å; T481-G498 PolarHBondContact O-N 3.49Å; T481-V523 HydrophobicContact CG2-CB 4.29Å; T481-V523 HydrophobicContact CG2-CG1 3.11Å; T481-V523 HydrophobicContact CG2-CG2 4.31Å; T481-L533 HydrophobicContact CG2-CD1 3.5Å; T481-L533 VanDerWaalsContact CG2-CD1 3.5Å; T481-L533 HydrophobicContact CG2-CD2 4Å; T481-L533 HydrophobicContact CG2-CG 4.37Å
482	A	86.5	Confident	84.5	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	149.7	172.3	0	0	0	0	0	107.3	L495 Q496 V535 L544	A482-L495 HydrophobicContact CB-CD1 3.78Å; A482-L495 HydrophobicContact CB-CG 4.18Å; A482-Q496 CarbonylContact C-O 3.58Å; A482-Q496 WeakPolarHBondContact CA-O 3.28Å; A482-Q496 WeakPolarHBondContact CB-O 3.4Å; A482-V535 HydrophobicContact CB-CG2 4.23Å; A482-L544 HydrophobicContact CB-CD1 3.78Å
483	H	87.9	Confident	84.6	Confident	60 Å²	60	60 Å²	60	28%	0.278	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	150.4	174.5	68.9	-79.3	0	0	0	109.8	A478 T485 Q496	A478-H483 HydrophobicContact CB-CB 4.21Å; H483-T485 WeakPolarHBondContact CD2-CG2 3.23Å; H483-T485 WeakPolarHBondContact NE2-CG2 3.31Å; H483-Q496 WeakPolarHBondContact CE1-CG 3.33Å; H483-Q496 PolarHBondContact CE1-OE1 2.94Å; H483-Q496 PolarHBondContact N-O 3.26Å; H483-Q496 PolarHBondContact NE2-OE1 2.96Å; H483-Q496 VanDerWaalsContact NE2-OE1 3.14Å; H483-Q496 PolarHBondContact O-N 3.5Å
484	I	88.3	Confident	84.5	Confident	38 Å²	38	54.4 Å²	54.4	20%	0.195	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	121.3	-179.6	-61	-178.3	0	0	0	107.5	F493 V494 L495 K537 A538 I540	I484-F493 HydrophobicContact CG2-CB 3.66Å; I484-F493 HydrophobicContact CG2-CD1 3.78Å; I484-F493 HydrophobicContact CG2-CG 4.05Å; I484-V494 WeakPolarHBondContact CA-O 3.36Å; I484-L495 HydrophobicContact CG1-CD1 3.94Å; I484-K537 VanDerWaalsContact CD1-C 3.5Å; I484-K537 HydrophobicContact CD1-CB 3.38Å; I484-K537 WeakPolarHBondContact CD1-O 3.25Å; I484-K537 HydrophobicContact CG1-CB 4.34Å; I484-A538 HydrophobicContact CD1-CB 4.06Å; I484-A538 HydrophobicContact CG2-CB 4.29Å; I484-I540 HydrophobicContact CD1-CB 4.15Å; I484-I540 HydrophobicContact CD1-CD1 4.15Å; I484-I540 HydrophobicContact CD1-CG1 4.42Å; I484-I540 HydrophobicContact CG2-CD1 4.37Å
485	T	87.7	Confident	84.6	Confident	36 Å²	36	52.5 Å²	52.5	22%	0.221	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	148.5	174.5	62.7	0	0	0	0	109.8	H483 V494	H483-T485 WeakPolarHBondContact CD2-CG2 3.23Å; H483-T485 WeakPolarHBondContact NE2-CG2 3.31Å; T485-V494 PolarHBondContact N-O 3.42Å; T485-V494 PolarHBondContact O-N 3.14Å
486	R	86.4	Confident	84.6	Confident	160 Å²	160	53.7 Å²	53.7	60%	0.604	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88	121.7	171	-169.3	179.8	-173.7	-177.1	3	108.3	K491 F493	R486-K491 WeakPolarHBondContact CG-O 3.45Å; R486-K491 PolarHBondContact NE-O 3.36Å; R486-F493 HydrophobicContact CB-CD1 4.31Å; R486-F493 HydrophobicContact CB-CE1 4.31Å
487	D	80.1	Confident	84.6	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.263	C	S	.	.			trans	-70.2	128.8	178	178	39.9	0	0	0	110.7	R231 E489 T490 K491 H492 V494	R231-D487 IonicContact CZ-OD1 3.64Å; R231-D487 IonicContact NH1-OD1 2.66Å; R231-D487 PolarHBondContact NH1-OD1 3.11Å; R231-D487 IonicContact NH2-OD1 2.95Å; R231-D487 PolarHBondContact NH2-OD1 3.36Å; D487-E489 PolarHBondContact O-N 3.49Å; D487-T490 WeakPolarHBondContact CB-OG1 3.18Å; D487-T490 PolarHBondContact OD2-N 3.13Å; D487-T490 VanDerWaalsContact OD2-N 3.1Å; D487-T490 PolarHBondContact OD2-OG1 3.34Å; D487-K491 WeakPolarHBondContact O-CA 3.29Å; D487-K491 PolarHBondContact O-N 2.93Å; D487-H492 PolarHBondContact N-O 3.39Å; D487-V494 HydrophobicContact CB-CG2 3.9Å
488	P	81.5	Confident	84.6	Confident	96 Å²	96	51.1 Å²	51.1	62%	0.623	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-26.6	180	22.9	-35.9	0	0	0	114
489	E	75.7	Confident	84.8	Confident	70 Å²	70	50 Å²	50	33%	0.327	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-58.5	-175.2	-63.2	179.3	179.5	0	0	111.4	I291 R353 D487	I291-E489 WeakPolarHBondContact CD1-OE2 3.19Å; R353-E489 IonicContact CZ-OE1 3.17Å; R353-E489 IonicContact NH1-OE1 3.74Å; R353-E489 PolarHBondContact NH1-OE1 3.02Å; R353-E489 IonicContact NH2-OE1 3.85Å; R353-E489 PolarHBondContact NH2-OE1 2.83Å; R353-E489 IonicContact NH2-OE2 3.1Å; D487-E489 PolarHBondContact O-N 3.49Å
490	T	78.8	Confident	85	Confident	30 Å²	30	48.4 Å²	48.4	18%	0.184	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-16.7	-177.5	60.5	0	0	0	0	113	T233 I236 D487 H492	T233-T490 HydrophobicContact CG2-CG2 4.28Å; I236-T490 HydrophobicContact CD1-CG2 3.97Å; D487-T490 WeakPolarHBondContact CB-OG1 3.18Å; D487-T490 PolarHBondContact OD2-N 3.13Å; D487-T490 VanDerWaalsContact OD2-N 3.1Å; D487-T490 PolarHBondContact OD2-OG1 3.34Å; T490-H492 PolarHBondContact O-N 3.09Å; T490-H492 PolarHBondContact OG1-N 2.98Å
491	K	82.6	Confident	85	Confident	136 Å²	136	49 Å²	49	59%	0.591	24%	0.24	S	C	*	.			trans	58.4	10.1	-170.5	-62.2	178.7	-177.4	171.8	0	114.1	R486 D487	R486-K491 WeakPolarHBondContact CG-O 3.45Å; R486-K491 PolarHBondContact NE-O 3.36Å; D487-K491 WeakPolarHBondContact O-CA 3.29Å; D487-K491 PolarHBondContact O-N 2.93Å
492	H	83	Confident	84.9	Confident	133 Å²	133	50.6 Å²	50.6	62%	0.616	25%	0.248	S	C	*	.			trans	-84	156.2	175.2	-65.2	-48.3	0	0	0	111.1	D487 T490	D487-H492 PolarHBondContact N-O 3.39Å; T490-H492 PolarHBondContact O-N 3.09Å; T490-H492 PolarHBondContact OG1-N 2.98Å
493	F	86.4	Confident	84.9	Confident	114 Å²	114	50.6 Å²	50.6	50%	0.5	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	126.3	172.6	-70.1	-65.1	0	0	0	109	I484 R486 A538 I540	I484-F493 HydrophobicContact CG2-CB 3.66Å; I484-F493 HydrophobicContact CG2-CD1 3.78Å; I484-F493 HydrophobicContact CG2-CG 4.05Å; R486-F493 HydrophobicContact CB-CD1 4.31Å; R486-F493 HydrophobicContact CB-CE1 4.31Å; F493-A538 HydrophobicContact CD1-CB 4.43Å; F493-A538 HydrophobicContact CD2-CB 4.27Å; F493-A538 HydrophobicContact CE2-CB 4.45Å; F493-A538 HydrophobicContact CG-CB 4.26Å; F493-I540 HydrophobicContact CB-CD1 4.14Å
494	V	85.3	Confident	84.8	Confident	15 Å²	15	48.5 Å²	48.5	9%	0.091	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	136.8	179.1	-176.8	0	0	0	0	108.4	R231 I484 T485 D487	R231-V494 HydrophobicContact CB-CG1 3.79Å; I484-V494 WeakPolarHBondContact CA-O 3.36Å; T485-V494 PolarHBondContact N-O 3.42Å; T485-V494 PolarHBondContact O-N 3.14Å; D487-V494 HydrophobicContact CB-CG2 3.9Å
495	L	84.6	Confident	84.6	Confident	27 Å²	27	48.8 Å²	48.8	14%	0.141	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	126.6	176.4	-171.3	75.5	0	0	0	109.3	A482 I484 V535 C542 L544	A482-L495 HydrophobicContact CB-CD1 3.78Å; A482-L495 HydrophobicContact CB-CG 4.18Å; I484-L495 HydrophobicContact CG1-CD1 3.94Å; L495-V535 HydrophobicContact CD1-CG1 4.23Å; L495-C542 VanDerWaalsContact CD2-SG 3.58Å; L495-L544 HydrophobicContact CD2-CD1 4.1Å; L495-L544 HydrophobicContact CD2-CD2 3.92Å; L495-L544 HydrophobicContact CD2-CG 4.37Å
496	Q	85.3	Confident	84.6	Confident	54 Å²	54	47.3 Å²	47.3	25%	0.252	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	127	171.1	-178.2	170.4	-14.1	0	0	109.3	I230 A482 H483	I230-Q496 HydrophobicContact CG2-CG 3.72Å; A482-Q496 CarbonylContact C-O 3.58Å; A482-Q496 WeakPolarHBondContact CA-O 3.28Å; A482-Q496 WeakPolarHBondContact CB-O 3.4Å; H483-Q496 WeakPolarHBondContact CE1-CG 3.33Å; H483-Q496 PolarHBondContact CE1-OE1 2.94Å; H483-Q496 PolarHBondContact N-O 3.26Å; H483-Q496 PolarHBondContact NE2-OE1 2.96Å; H483-Q496 VanDerWaalsContact NE2-OE1 3.14Å; H483-Q496 PolarHBondContact O-N 3.5Å
497	I	86	Confident	84.9	Confident	20 Å²	20	39.8 Å²	39.8	10%	0.103	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	140.4	-175.4	-58.3	-173.5	0	0	0	110.5	P324 A501 L502	P324-I497 VanDerWaalsContact C-CD1 3.48Å; P324-I497 HydrophobicContact CB-CD1 3.66Å; P324-I497 HydrophobicContact CB-CG1 4.05Å; P324-I497 HydrophobicContact CG-CD1 3.87Å; P324-I497 HydrophobicContact CG-CG1 4.37Å; P324-I497 WeakPolarHBondContact O-CD1 2.99Å; I497-A501 HydrophobicContact CG2-CB 3.26Å; I497-L502 HydrophobicContact CB-CD2 4.4Å; I497-L502 HydrophobicContact CG2-CD2 4.22Å; I497-L502 HydrophobicContact CG2-CG 4.08Å
498	G	87.2	Confident	85.5	Confident	5 Å²	5	39.8 Å²	39.8	5%	0.052	21%	0.205	C	C	.	.			trans	-94.4	-178.8	174.2	0	0	0	0	0	113.5	G479 L480 T481 L500 A501 L502	G479-G498 CarbonylContact O-C 3.11Å; G479-G498 WeakPolarHBondContact O-CA 3.27Å; L480-G498 CarbonylContact O-C 3.59Å; T481-G498 VanDerWaalsContact O-CA 3.22Å; T481-G498 WeakPolarHBondContact O-CA 3.44Å; T481-G498 PolarHBondContact O-N 3.49Å; G498-L500 VanDerWaalsContact C-N 3.33Å; G498-L500 PolarHBondContact O-N 3.32Å; G498-A501 PolarHBondContact O-N 3.14Å; G498-L502 WeakPolarHBondContact O-CG 3.35Å; G498-L502 PolarHBondContact O-N 3.1Å; G498-L502 VanDerWaalsContact O-N 3.09Å
499	A	88.2	Confident	86.2	Confident	12 Å²	12	35.2 Å²	35.2	10%	0.099	18%	0.175	C	C	.	.	H	α-helix	trans	-56.5	-38.8	-170.2	0	0	0	0	0	114.5	V470 G479 L480 L502 S503	V470-A499 HydrophobicContact CG2-CB 3.67Å; G479-A499 PolarHBondContact O-N 2.97Å; L480-A499 HydrophobicContact CD2-CB 4.46Å; L480-A499 PolarHBondContact O-N 2.77Å; A499-L502 PolarHBondContact O-N 3.36Å; A499-S503 PolarHBondContact O-N 3.44Å; A499-S503 VanDerWaalsContact O-N 3.08Å; A499-S503 PolarHBondContact O-OG 2.95Å
500	L	89.7	Confident	87.1	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-67.1	-44.7	-176.2	-68.4	167.5	0	0	0	112.3	L480 G498 L502 S503 C508 L524 V527	L480-L500 HydrophobicContact CB-CD1 4.1Å; L480-L500 HydrophobicContact CB-CG 4.45Å; L480-L500 HydrophobicContact CD2-CD1 4.31Å; L480-L500 HydrophobicContact CD2-CG 4.07Å; L480-L500 WeakPolarHBondContact O-CB 3.33Å; L480-L500 WeakPolarHBondContact O-CG 3.48Å; L480-L500 PolarHBondContact O-N 2.93Å; G498-L500 VanDerWaalsContact C-N 3.33Å; G498-L500 PolarHBondContact O-N 3.32Å; L500-L502 VanDerWaalsContact C-N 3.35Å; L500-S503 WeakPolarHBondContact CA-OG 3.28Å; L500-S503 CarbonylContact O-C 3.52Å; L500-S503 PolarHBondContact O-N 3.35Å; L500-S503 VanDerWaalsContact O-N 3.16Å; L500-S503 PolarHBondContact O-OG 2.98Å; L500-C508 HydrophobicContact CD2-CB 4.03Å; L500-L524 HydrophobicContact CD1-CD2 3.66Å; L500-L524 HydrophobicContact CD2-CD2 4.23Å; L500-V527 HydrophobicContact CD1-CG2 4.15Å
501	A	86.7	Confident	87.8	Confident	12 Å²	12	31 Å²	31	10%	0.099	15%	0.154	C	C	.	.	H	α-helix	trans	-78.4	-20.6	179.7	0	0	0	0	0	112.5	I497 G498 S503	I497-A501 HydrophobicContact CG2-CB 3.26Å; G498-A501 PolarHBondContact O-N 3.14Å; A501-S503 VanDerWaalsContact C-N 3.29Å
502	L	85.7	Confident	88.2	Confident	44 Å²	44	26.8 Å²	26.8	23%	0.23	14%	0.136	C	C	.	.	H	α-helix	trans	-69	-28.3	164.9	-68.2	174.6	0	0	0	112.4	Q468 I497 G498 A499 L500 D504	Q468-L502 HydrophobicContact CG-CB 4.45Å; I497-L502 HydrophobicContact CB-CD2 4.4Å; I497-L502 HydrophobicContact CG2-CD2 4.22Å; I497-L502 HydrophobicContact CG2-CG 4.08Å; G498-L502 WeakPolarHBondContact O-CG 3.35Å; G498-L502 PolarHBondContact O-N 3.1Å; G498-L502 VanDerWaalsContact O-N 3.09Å; A499-L502 PolarHBondContact O-N 3.36Å; L500-L502 VanDerWaalsContact C-N 3.35Å; L502-D504 VanDerWaalsContact C-N 3.33Å; L502-D504 PolarHBondContact O-N 3.19Å
503	S	86.3	Confident	88.6	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	11%	0.106	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	21.8	178.3	64.7	0	0	0	0	114.7	A499 L500 A501 N505 G506 S548	A499-S503 PolarHBondContact O-N 3.44Å; A499-S503 VanDerWaalsContact O-N 3.08Å; A499-S503 PolarHBondContact O-OG 2.95Å; L500-S503 WeakPolarHBondContact CA-OG 3.28Å; L500-S503 CarbonylContact O-C 3.52Å; L500-S503 PolarHBondContact O-N 3.35Å; L500-S503 VanDerWaalsContact O-N 3.16Å; L500-S503 PolarHBondContact O-OG 2.98Å; A501-S503 VanDerWaalsContact C-N 3.29Å; S503-N505 PolarHBondContact O-N 3.33Å; S503-G506 WeakPolarHBondContact O-CA 3.25Å; S503-G506 PolarHBondContact O-N 2.79Å; S503-S548 WeakPolarHBondContact O-CB 3.36Å; S503-S548 VanDerWaalsContact OG-CB 3.27Å; S503-S548 WeakPolarHBondContact OG-CB 3.47Å
504	D	85.6	Confident	88.7	Confident	17 Å²	17	16.7 Å²	16.7	9%	0.091	9%	0.092	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	132.5	178.8	-169.4	42.9	0	0	0	111.5	R466 L502 G506 R547	R466-D504 WeakPolarHBondContact CD-O 3.37Å; R466-D504 PolarHBondContact NH1-O 3.45Å; L502-D504 VanDerWaalsContact C-N 3.33Å; L502-D504 PolarHBondContact O-N 3.19Å; D504-G506 PolarHBondContact O-N 2.98Å; D504-G506 VanDerWaalsContact O-N 3.09Å; D504-R547 WeakPolarHBondContact OD1-CA 3.3Å; D504-R547 VanDerWaalsContact OD1-CB 3.23Å; D504-R547 WeakPolarHBondContact OD1-CB 3.46Å; D504-R547 WeakPolarHBondContact OD1-CG 3.27Å; D504-R547 PolarHBondContact OD1-N 2.74Å
505	N	83.4	Confident	88.9	Confident	44 Å²	44	19.5 Å²	19.5	24%	0.235	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	6.1	-168.4	-52.8	-34.6	0	0	0	116.1	R426 S503 R547	R426-N505 VanDerWaalsContact CZ-OD1 3.25Å; R426-N505 PolarHBondContact NH1-OD1 2.87Å; R426-N505 PolarHBondContact NH2-OD1 2.69Å; S503-N505 PolarHBondContact O-N 3.33Å; N505-R547 WeakPolarHBondContact CA-O 3.49Å; N505-R547 PolarHBondContact N-O 3.09Å
506	G	87.8	Confident	89.1	Confident	5 Å²	5	18.4 Å²	18.4	5%	0.052	10%	0.097	C	C	.	.	S	Bend	trans	-106.4	-157	179.6	0	0	0	0	0	112.8	S503 D504 S549	S503-G506 WeakPolarHBondContact O-CA 3.25Å; S503-G506 PolarHBondContact O-N 2.79Å; D504-G506 PolarHBondContact O-N 2.98Å; D504-G506 VanDerWaalsContact O-N 3.09Å; G506-S549 PolarHBondContact O-N 2.99Å
507	V	92.2	Very high	89.3	Confident	2 Å²	2	21.4 Å²	21.4	1%	0.012	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	129.3	175.5	179.2	0	0	0	0	109.9	L420 V460 L464 G467 Q468 S549 L551	L420-V507 HydrophobicContact CD2-CG1 3.92Å; L420-V507 HydrophobicContact CD2-CG2 4.23Å; L420-V507 HydrophobicContact CG-CG2 4.24Å; V460-V507 HydrophobicContact CG1-CG1 4.25Å; L464-V507 HydrophobicContact CD1-CB 3.37Å; L464-V507 HydrophobicContact CD1-CG1 4.43Å; L464-V507 HydrophobicContact CD1-CG2 3.28Å; G467-V507 WeakPolarHBondContact CA-O 3.33Å; Q468-V507 PolarHBondContact N-O 3.08Å; Q468-V507 VanDerWaalsContact N-O 3.12Å; V507-S549 CarbonylContact C-O 3.54Å; V507-S549 VanDerWaalsContact CA-O 3.26Å; V507-S549 WeakPolarHBondContact CA-O 3.46Å; V507-L551 HydrophobicContact CG1-CB 3.91Å
508	C	93.9	Very high	89.4	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	114.3	169.7	-174.3	0	0	0	0	109	L500 S549 L551	L500-C508 HydrophobicContact CD2-CB 4.03Å; C508-S549 PolarHBondContact N-O 2.68Å; C508-L551 PolarHBondContact O-N 3.27Å
509	C	95.1	Very high	89.5	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	117.4	176.5	-63.3	0	0	0	0	109.1	L457 Q468 Y469 V470 L551	L457-C509 HydrophobicContact CB-CB 4.18Å; L457-C509 HydrophobicContact CD2-CB 4.14Å; Q468-C509 PolarHBondContact O-N 3.02Å; Y469-C509 HydrophobicContact CD2-CB 4.16Å; V470-C509 PolarHBondContact N-O 3.26Å; C509-L551 CarbonylContact C-O 3.52Å; C509-L551 VanDerWaalsContact CA-O 3.31Å; C509-L551 WeakPolarHBondContact CA-O 3.38Å
510	I	94.5	Very high	89.5	Confident	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	113.9	179.2	-52.9	175.3	0	0	0	109.4	V470 F513 M516 L524 I550 L551 A552 A553	V470-I510 HydrophobicContact CG1-CG2 4.48Å; V470-I510 CarbonylContact O-C 3.46Å; V470-I510 WeakPolarHBondContact O-CA 3.15Å; I510-F513 HydrophobicContact CB-CD2 4.41Å; I510-F513 HydrophobicContact CD1-CE2 4.42Å; I510-F513 HydrophobicContact CG2-CD2 3.89Å; I510-M516 HydrophobicContact CG2-SD 3.84Å; I510-L524 HydrophobicContact CD1-CD1 4.23Å; I510-L524 HydrophobicContact CD1-CD2 4.4Å; I510-I550 HydrophobicContact CD1-CG2 4Å; I510-L551 PolarHBondContact N-O 2.89Å; I510-A552 CarbonylContact O-C 3.59Å; I510-A552 WeakPolarHBondContact O-CA 3.17Å; I510-A553 PolarHBondContact O-N 2.89Å
511	D	94	Very high	89.3	Confident	12 Å²	12	33.5 Å²	33.5	6%	0.064	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	156.9	172.4	-155.2	-12.3	0	0	0	110.8	S454 L457 Y469 V470 G472 F513	S454-D511 WeakPolarHBondContact CB-OD2 3.32Å; S454-D511 PolarHBondContact OG-OD1 3.31Å; S454-D511 PolarHBondContact OG-OD2 2.88Å; L457-D511 HydrophobicContact CD1-CB 3.91Å; Y469-D511 HydrophobicContact CE2-CB 4.01Å; Y469-D511 WeakPolarHBondContact OH-CB 3.22Å; Y469-D511 PolarHBondContact OH-OD2 3.49Å; V470-D511 PolarHBondContact O-N 3.01Å; G472-D511 WeakPolarHBondContact CA-O 3.33Å; G472-D511 PolarHBondContact N-O 3.46Å; D511-F513 VanDerWaalsContact C-N 3.32Å; D511-F513 PolarHBondContact O-N 3.39Å
512	E	91.9	Very high	89.3	Confident	46 Å²	46	35.8 Å²	35.8	22%	0.215	18%	0.18	C	C	.	.			trans	51.4	45.8	179.6	-61.2	-162.4	137.7	0	0	114	K473 D514 K515 A553	K473-E512 WeakPolarHBondContact CD-OE2 3.12Å; E512-D514 PolarHBondContact O-N 2.6Å; E512-K515 HydrophobicContact CB-CB 4.44Å; E512-K515 HydrophobicContact CB-CD 3.75Å; E512-K515 HydrophobicContact CG-CD 4.04Å; E512-K515 PolarHBondContact O-N 3.35Å; E512-K515 IonicContact OE1-NZ 3.93Å; E512-K515 PolarHBondContact OE1-NZ 2.96Å; E512-K515 IonicContact OE2-NZ 2.72Å; E512-A553 PolarHBondContact N-O 2.71Å
513	F	91.4	Very high	89.5	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-58.9	-31.9	-176.8	-167.8	-108.4	0	0	0	113.5	L444 I510 D511 K515 M516 L524 A552 A553 A554 L573 L577 F581	L444-F513 HydrophobicContact CD1-CD1 4.38Å; I510-F513 HydrophobicContact CB-CD2 4.41Å; I510-F513 HydrophobicContact CD1-CE2 4.42Å; I510-F513 HydrophobicContact CG2-CD2 3.89Å; D511-F513 VanDerWaalsContact C-N 3.32Å; D511-F513 PolarHBondContact O-N 3.39Å; F513-K515 PolarHBondContact O-N 3.35Å; F513-M516 HydrophobicContact CD2-SD 3.55Å; F513-M516 VanDerWaalsContact CD2-SD 3.55Å; F513-M516 HydrophobicContact CE2-SD 3.84Å; F513-M516 HydrophobicContact CG-SD 4.41Å; F513-M516 PolarHBondContact O-N 2.8Å; F513-L524 HydrophobicContact CE2-CD1 3.48Å; F513-L524 VanDerWaalsContact CE2-CD1 3.48Å; F513-L524 HydrophobicContact CZ-CD1 3.97Å; F513-A552 HydrophobicContact CB-CB 4.37Å; F513-A552 HydrophobicContact CD2-CB 4.01Å; F513-A552 HydrophobicContact CE2-CB 4.44Å; F513-A552 HydrophobicContact CG-CB 4.14Å; F513-A553 VanDerWaalsContact CB-O 3.29Å; F513-A553 WeakPolarHBondContact CB-O 3.45Å; F513-A553 PolarHBondContact N-O 2.64Å; F513-A554 HydrophobicContact CB-CB 4.28Å; F513-L573 HydrophobicContact CD1-CD1 4.01Å; F513-L573 HydrophobicContact CD1-CD2 3.98Å; F513-L573 HydrophobicContact CE1-CD1 4.09Å; F513-L573 HydrophobicContact CE1-CD2 3.96Å; F513-L577 HydrophobicContact CE1-CD2 3.61Å; F513-L577 HydrophobicContact CE1-CG 4.35Å; F513-L577 HydrophobicContact CZ-CD1 4.5Å; F513-L577 HydrophobicContact CZ-CD2 3.71Å; F513-L577 HydrophobicContact CZ-CG 4.35Å; F513-F581 HydrophobicContact CE1-CE2 4.22Å; F513-F581 HydrophobicContact CE1-CZ 4.17Å; F513-F581 HydrophobicContact CZ-CE2 4.36Å; F513-F581 HydrophobicContact CZ-CZ 4.02Å
514	D	89.2	Confident	89.7	Confident	36 Å²	36	34.5 Å²	34.5	19%	0.193	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-63.8	-20.9	176	61.4	-64.5	0	0	0	113.4	E512 R521 N555	E512-D514 PolarHBondContact O-N 2.6Å; D514-R521 VanDerWaalsContact C-NH2 3.29Å; D514-R521 PolarHBondContact O-NH2 3.43Å; D514-N555 PolarHBondContact OD1-N 2.77Å
515	K	87.7	Confident	89.9	Confident	73 Å²	73	35.9 Å²	35.9	32%	0.317	18%	0.18	S	C	.	.	G	3₁₀ helix	trans	-98.5	2.3	-177.8	-70.4	142.8	163.3	-179.4	0	114.2	K473 E512 F513	K473-K515 HydrophobicContact CD-CB 4.19Å; K473-K515 HydrophobicContact CD-CD 4.13Å; K473-K515 HydrophobicContact CD-CG 4.39Å; K473-K515 HydrophobicContact CG-CB 3.47Å; K473-K515 VanDerWaalsContact CG-CB 3.47Å; K473-K515 HydrophobicContact CG-CD 4.22Å; K473-K515 HydrophobicContact CG-CG 4.2Å; E512-K515 HydrophobicContact CB-CB 4.44Å; E512-K515 HydrophobicContact CB-CD 3.75Å; E512-K515 HydrophobicContact CG-CD 4.04Å; E512-K515 PolarHBondContact O-N 3.35Å; E512-K515 IonicContact OE1-NZ 3.93Å; E512-K515 PolarHBondContact OE1-NZ 2.96Å; E512-K515 IonicContact OE2-NZ 2.72Å; F513-K515 PolarHBondContact O-N 3.35Å
516	M	89	Confident	90.1	Very high	5 Å²	5	36.1 Å²	36.1	3%	0.025	18%	0.18	C	C	.	.	S	Bend	trans	-72.2	144.5	176.7	-66.5	-178.3	69	0	0	112.5	G472 L480 I510 F513 T520 R521 L524	G472-M516 WeakPolarHBondContact O-CG 3.12Å; L480-M516 HydrophobicContact CD1-CE 3.55Å; I510-M516 HydrophobicContact CG2-SD 3.84Å; F513-M516 HydrophobicContact CD2-SD 3.55Å; F513-M516 VanDerWaalsContact CD2-SD 3.55Å; F513-M516 HydrophobicContact CE2-SD 3.84Å; F513-M516 HydrophobicContact CG-SD 4.41Å; F513-M516 PolarHBondContact O-N 2.8Å; M516-T520 HydrophobicContact CE-CG2 3.22Å; M516-R521 HydrophobicContact CB-CG 4.12Å; M516-R521 PolarHBondContact O-NE 3.16Å; M516-R521 VanDerWaalsContact O-NE 3.12Å; M516-R521 PolarHBondContact O-NH2 3.42Å; M516-R521 VanDerWaalsContact O-NH2 3.11Å; M516-L524 HydrophobicContact CE-CD1 3.95Å; M516-L524 HydrophobicContact SD-CD1 4.36Å
517	N	89.5	Confident	90.3	Very high	117 Å²	117	36 Å²	36	63%	0.626	18%	0.178	S	C	*	.			trans	-64.8	146.7	172.8	-65.7	-11.4	0	0	0	111.6	Y519 T520 R521	N517-Y519 VanDerWaalsContact C-N 3.28Å; N517-Y519 PolarHBondContact O-N 3.46Å; N517-T520 WeakPolarHBondContact O-CA 3.38Å; N517-T520 WeakPolarHBondContact O-CB 3.33Å; N517-T520 PolarHBondContact O-N 2.91Å; N517-R521 PolarHBondContact O-N 3.38Å
518	D	88.6	Confident	90.2	Very high	114 Å²	114	36 Å²	36	61%	0.61	18%	0.178	S	C	*	.	H	α-helix	trans	-59.6	-34.8	-179	-67	-32.4	0	0	0	113.6	T520 R521 S522	D518-T520 VanDerWaalsContact C-N 3.33Å; D518-T520 PolarHBondContact O-N 3.2Å; D518-R521 WeakPolarHBondContact O-CB 3.2Å; D518-R521 PolarHBondContact O-N 3.39Å; D518-R521 IonicContact OD1-CZ 3.48Å; D518-R521 IonicContact OD1-NH1 2.88Å; D518-R521 PolarHBondContact OD1-NH1 3.05Å; D518-S522 PolarHBondContact O-N 3.39Å
519	Y	88.7	Confident	89.7	Confident	149 Å²	149	39.5 Å²	39.5	58%	0.584	19%	0.194	S	C	*	.	H	α-helix	trans	-61.9	-39.6	173.1	178.7	-105.2	0	0	0	112.4	A477 N517 R521 S522 V523	A477-Y519 HydrophobicContact CB-CD1 3.56Å; A477-Y519 HydrophobicContact CB-CE1 3.43Å; A477-Y519 VanDerWaalsContact CB-CE1 3.43Å; N517-Y519 VanDerWaalsContact C-N 3.28Å; N517-Y519 PolarHBondContact O-N 3.46Å; Y519-R521 VanDerWaalsContact C-N 3.33Å; Y519-S522 PolarHBondContact O-N 3.34Å; Y519-S522 PolarHBondContact O-OG 3.08Å; Y519-V523 PolarHBondContact O-N 3.39Å
520	T	89.1	Confident	89.3	Confident	4 Å²	4	45.3 Å²	45.3	3%	0.025	22%	0.221	C	C	.	.	H	α-helix	trans	-69.3	-36.8	176.8	-51.8	0	0	0	0	110.6	A477 L480 M516 N517 D518 V523 L524	A477-T520 HydrophobicContact CB-CG2 4.31Å; A477-T520 PolarHBondContact N-OG1 2.94Å; L480-T520 HydrophobicContact CD1-CG2 3.23Å; M516-T520 HydrophobicContact CE-CG2 3.22Å; N517-T520 WeakPolarHBondContact O-CA 3.38Å; N517-T520 WeakPolarHBondContact O-CB 3.33Å; N517-T520 PolarHBondContact O-N 2.91Å; D518-T520 VanDerWaalsContact C-N 3.33Å; D518-T520 PolarHBondContact O-N 3.2Å; T520-V523 WeakPolarHBondContact O-CB 3.31Å; T520-V523 PolarHBondContact O-N 2.85Å; T520-L524 PolarHBondContact O-N 3.37Å
521	R	86.2	Confident	89	Confident	24 Å²	24	46.1 Å²	46.1	9%	0.091	23%	0.225	C	C	.	.	H	α-helix	trans	-65.8	-37.5	174.9	-64	175	-175.2	156.6	-6.5	112.5	D514 M516 N517 D518 Y519 V523 L524 Q525 L577	D514-R521 VanDerWaalsContact C-NH2 3.29Å; D514-R521 PolarHBondContact O-NH2 3.43Å; M516-R521 HydrophobicContact CB-CG 4.12Å; M516-R521 PolarHBondContact O-NE 3.16Å; M516-R521 VanDerWaalsContact O-NE 3.12Å; M516-R521 PolarHBondContact O-NH2 3.42Å; M516-R521 VanDerWaalsContact O-NH2 3.11Å; N517-R521 PolarHBondContact O-N 3.38Å; D518-R521 WeakPolarHBondContact O-CB 3.2Å; D518-R521 PolarHBondContact O-N 3.39Å; D518-R521 IonicContact OD1-CZ 3.48Å; D518-R521 IonicContact OD1-NH1 2.88Å; D518-R521 PolarHBondContact OD1-NH1 3.05Å; Y519-R521 VanDerWaalsContact C-N 3.33Å; R521-V523 VanDerWaalsContact C-N 3.26Å; R521-V523 PolarHBondContact O-N 3.08Å; R521-L524 PolarHBondContact O-N 3.42Å; R521-Q525 WeakPolarHBondContact O-CG 3.4Å; R521-Q525 PolarHBondContact O-N 3.35Å; R521-L577 HydrophobicContact CB-CD2 4.47Å
522	S	86.3	Confident	88.8	Confident	59 Å²	59	46.4 Å²	46.4	41%	0.413	23%	0.228	S	C	.	.	H	α-helix	trans	-63.7	-32.6	177.8	60.5	0	0	0	0	112.7	D518 Y519 Q525	D518-S522 PolarHBondContact O-N 3.39Å; Y519-S522 PolarHBondContact O-N 3.34Å; Y519-S522 PolarHBondContact O-OG 3.08Å; S522-Q525 VanDerWaalsContact O-CB 3.3Å; S522-Q525 WeakPolarHBondContact O-CB 3.46Å; S522-Q525 PolarHBondContact O-N 3.2Å
523	V	89.1	Confident	88.6	Confident	17 Å²	17	44.4 Å²	44.4	10%	0.103	22%	0.218	C	C	.	.	H	α-helix	trans	-64.6	-41.9	174.1	166.6	0	0	0	0	111.5	A477 T481 Y519 T520 R521 Q525 E526 V527 L533	A477-V523 HydrophobicContact CB-CG2 4.45Å; T481-V523 HydrophobicContact CG2-CB 4.29Å; T481-V523 HydrophobicContact CG2-CG1 3.11Å; T481-V523 HydrophobicContact CG2-CG2 4.31Å; Y519-V523 PolarHBondContact O-N 3.39Å; T520-V523 WeakPolarHBondContact O-CB 3.31Å; T520-V523 PolarHBondContact O-N 2.85Å; R521-V523 VanDerWaalsContact C-N 3.26Å; R521-V523 PolarHBondContact O-N 3.08Å; V523-Q525 PolarHBondContact O-N 3.28Å; V523-E526 WeakPolarHBondContact O-CB 3.4Å; V523-E526 PolarHBondContact O-N 3.21Å; V523-E526 VanDerWaalsContact O-N 3.08Å; V523-V527 PolarHBondContact O-N 3.09Å; V523-L533 HydrophobicContact CG1-CD1 4.1Å
524	L	90.3	Very high	88.5	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-26.7	179.8	-67.1	176.7	0	0	0	112.6	L500 I510 F513 M516 T520 R521 E526 V527 M528 I550	L500-L524 HydrophobicContact CD1-CD2 3.66Å; L500-L524 HydrophobicContact CD2-CD2 4.23Å; I510-L524 HydrophobicContact CD1-CD1 4.23Å; I510-L524 HydrophobicContact CD1-CD2 4.4Å; F513-L524 HydrophobicContact CE2-CD1 3.48Å; F513-L524 VanDerWaalsContact CE2-CD1 3.48Å; F513-L524 HydrophobicContact CZ-CD1 3.97Å; M516-L524 HydrophobicContact CE-CD1 3.95Å; M516-L524 HydrophobicContact SD-CD1 4.36Å; T520-L524 PolarHBondContact O-N 3.37Å; R521-L524 PolarHBondContact O-N 3.42Å; L524-E526 VanDerWaalsContact C-N 3.26Å; L524-E526 PolarHBondContact O-N 3.45Å; L524-V527 PolarHBondContact O-N 2.95Å; L524-M528 VanDerWaalsContact O-CB 3.27Å; L524-M528 WeakPolarHBondContact O-CB 3.5Å; L524-M528 WeakPolarHBondContact O-CG 3.05Å; L524-M528 PolarHBondContact O-N 3.39Å; L524-I550 HydrophobicContact CD2-CD1 4.18Å
525	Q	89.2	Confident	88.4	Confident	46 Å²	46	46.5 Å²	46.5	22%	0.215	24%	0.236	C	C	.	.	H	α-helix	trans	-62.5	-34	175.7	-64.3	-163.9	14.5	0	0	113	R521 S522 V523 E529 T576 L577 R580	R521-Q525 WeakPolarHBondContact O-CG 3.4Å; R521-Q525 PolarHBondContact O-N 3.35Å; S522-Q525 VanDerWaalsContact O-CB 3.3Å; S522-Q525 WeakPolarHBondContact O-CB 3.46Å; S522-Q525 PolarHBondContact O-N 3.2Å; V523-Q525 PolarHBondContact O-N 3.28Å; Q525-E529 VanDerWaalsContact O-CB 3.29Å; Q525-E529 WeakPolarHBondContact O-CB 3.4Å; Q525-E529 PolarHBondContact O-N 2.81Å; Q525-T576 PolarHBondContact NE2-OG1 3.38Å; Q525-L577 HydrophobicContact CG-CD1 4.18Å; Q525-R580 VanDerWaalsContact CB-CZ 3.44Å; Q525-R580 PolarHBondContact O-NE 2.98Å; Q525-R580 PolarHBondContact O-NH2 2.9Å
526	E	89.6	Confident	88.4	Confident	49 Å²	49	46.7 Å²	46.7	23%	0.229	25%	0.25	C	S	.	.	H	α-helix	trans	-71.2	-50.9	175.7	-169.6	-176.8	163.7	0	0	110.2	V523 L524 M528 E529 Q530 S534	V523-E526 WeakPolarHBondContact O-CB 3.4Å; V523-E526 PolarHBondContact O-N 3.21Å; V523-E526 VanDerWaalsContact O-N 3.08Å; L524-E526 VanDerWaalsContact C-N 3.26Å; L524-E526 PolarHBondContact O-N 3.45Å; E526-M528 PolarHBondContact O-N 2.82Å; E526-E529 PolarHBondContact O-N 3.16Å; E526-Q530 WeakPolarHBondContact O-CB 3.4Å; E526-Q530 PolarHBondContact O-N 2.85Å; E526-S534 WeakPolarHBondContact OE1-CB 3.21Å; E526-S534 PolarHBondContact OE1-N 2.73Å; E526-S534 PolarHBondContact OE1-OG 2.82Å
527	V	90.9	Very high	88.2	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.018	27%	0.268	C	S	.	.	H	α-helix	trans	-62.8	-44.1	-178.4	178.7	0	0	0	0	111.8	L500 V523 L524 E529 Q531 L533 A546	L500-V527 HydrophobicContact CD1-CG2 4.15Å; V523-V527 PolarHBondContact O-N 3.09Å; L524-V527 PolarHBondContact O-N 2.95Å; V527-E529 VanDerWaalsContact C-N 3.31Å; V527-E529 PolarHBondContact O-N 2.77Å; V527-Q531 WeakPolarHBondContact O-CA 3.47Å; V527-Q531 PolarHBondContact O-N 3.47Å; V527-L533 HydrophobicContact CG2-CB 4.34Å; V527-L533 HydrophobicContact CG2-CD1 4.35Å; V527-A546 HydrophobicContact CG1-CB 3.91Å; V527-A546 HydrophobicContact CG2-CB 4.43Å
528	M	90.5	Very high	88	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.015	26%	0.263	C	S	.	.	H	α-helix	trans	-70.4	-24.2	-179.4	-69.5	176.5	79.8	0	0	113.8	R438 N442 L524 E526 I550 L577 R580 F581	R438-M528 WeakPolarHBondContact CD-O 3.39Å; R438-M528 PolarHBondContact NE-O 2.82Å; R438-M528 PolarHBondContact NH1-O 3.47Å; N442-M528 HydrophobicContact CB-CE 3.94Å; N442-M528 WeakPolarHBondContact ND2-CE 3.34Å; L524-M528 VanDerWaalsContact O-CB 3.27Å; L524-M528 WeakPolarHBondContact O-CB 3.5Å; L524-M528 WeakPolarHBondContact O-CG 3.05Å; L524-M528 PolarHBondContact O-N 3.39Å; E526-M528 PolarHBondContact O-N 2.82Å; M528-I550 HydrophobicContact CG-CD1 3.43Å; M528-I550 VanDerWaalsContact CG-CD1 3.43Å; M528-I550 HydrophobicContact CG-CG1 4.45Å; M528-I550 HydrophobicContact SD-CD1 4.07Å; M528-L577 HydrophobicContact SD-CD1 3.84Å; M528-R580 HydrophobicContact CB-CB 4.26Å; M528-R580 HydrophobicContact CE-CB 3.76Å; M528-R580 HydrophobicContact SD-CB 4.33Å; M528-F581 HydrophobicContact CE-CD1 3.65Å; M528-F581 HydrophobicContact CE-CD2 4.01Å; M528-F581 HydrophobicContact CE-CE1 3.55Å; M528-F581 HydrophobicContact CE-CE2 3.92Å; M528-F581 HydrophobicContact CE-CG 3.89Å; M528-F581 HydrophobicContact CE-CZ 3.69Å; M528-F581 HydrophobicContact SD-CZ 4.3Å
529	E	83.8	Confident	87.7	Confident	72 Å²	72	46.5 Å²	46.5	34%	0.336	27%	0.273	S	S	.	.	H	α-helix	trans	-94.6	-50.8	-178.3	-167.2	71.6	-163.1	0	0	111.6	Q525 E526 V527 R580 R669	Q525-E529 VanDerWaalsContact O-CB 3.29Å; Q525-E529 WeakPolarHBondContact O-CB 3.4Å; Q525-E529 PolarHBondContact O-N 2.81Å; E526-E529 PolarHBondContact O-N 3.16Å; V527-E529 VanDerWaalsContact C-N 3.31Å; V527-E529 PolarHBondContact O-N 2.77Å; E529-R580 IonicContact OE2-NE 2.61Å; E529-R580 PolarHBondContact OE2-NE 2.71Å; E529-R580 VanDerWaalsContact OE2-NE 3.16Å; E529-R669 IonicContact OE1-CZ 3.06Å; E529-R669 IonicContact OE1-NE 3.35Å; E529-R669 IonicContact OE1-NH2 3.35Å; E529-R669 PolarHBondContact OE1-NH2 3.34Å; E529-R669 IonicContact OE2-CZ 3.39Å; E529-R669 VanDerWaalsContact OE2-CZ 3.29Å; E529-R669 IonicContact OE2-NE 3.17Å; E529-R669 IonicContact OE2-NH1 2.8Å; E529-R669 IonicContact OE2-NH2 3.58Å; E529-R669 PolarHBondContact OE2-NH2 3.38Å
530	Q	86.4	Confident	87.4	Confident	122 Å²	122	41.4 Å²	41.4	57%	0.57	26%	0.255	S	S	*	.	H	α-helix	trans	-100.4	-12.3	-170.1	-62.4	177.5	-11	0	0	112.5	E526 T532	E526-Q530 WeakPolarHBondContact O-CB 3.4Å; E526-Q530 PolarHBondContact O-N 2.85Å; Q530-T532 PolarHBondContact O-N 2.88Å; Q530-T532 VanDerWaalsContact O-N 3.11Å
531	Q	88.2	Confident	87.4	Confident	17 Å²	17	47.2 Å²	47.2	8%	0.079	29%	0.291	C	S	.	.	S	Bend	trans	54.4	25.6	-172.7	-58.5	-175.6	-56.9	0	0	113.6	R438 E440 V527 A546 R547	R438-Q531 HydrophobicContact CB-CG 4.29Å; R438-Q531 HydrophobicContact CG-CG 4.11Å; E440-Q531 PolarHBondContact OE1-NE2 2.93Å; E440-Q531 VanDerWaalsContact OE1-NE2 3.13Å; E440-Q531 PolarHBondContact OE2-NE2 2.99Å; V527-Q531 WeakPolarHBondContact O-CA 3.47Å; V527-Q531 PolarHBondContact O-N 3.47Å; Q531-A546 CarbonylContact O-C 3.59Å; Q531-A546 PolarHBondContact O-N 3.32Å; Q531-R547 HydrophobicContact CB-CG 4.27Å
532	T	89.2	Confident	87.4	Confident	19 Å²	19	47.7 Å²	47.7	12%	0.117	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	159	176.4	66.9	0	0	0	0	109.9	Q530 Q543 L544	Q530-T532 PolarHBondContact O-N 2.88Å; Q530-T532 VanDerWaalsContact O-N 3.11Å; T532-Q543 VanDerWaalsContact CB-NE2 3.34Å; T532-Q543 HydrophobicContact CG2-CG 4.38Å; T532-Q543 PolarHBondContact OG1-NE2 2.88Å; T532-L544 CarbonylContact C-O 3.59Å; T532-L544 WeakPolarHBondContact CA-O 3.41Å
533	L	88.8	Confident	87.5	Confident	3 Å²	3	51 Å²	51	2%	0.016	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	111.4	-179.5	172	69.3	0	0	0	108.6	T481 V523 V527 V535 L544 A546	T481-L533 HydrophobicContact CG2-CD1 3.5Å; T481-L533 VanDerWaalsContact CG2-CD1 3.5Å; T481-L533 HydrophobicContact CG2-CD2 4Å; T481-L533 HydrophobicContact CG2-CG 4.37Å; V523-L533 HydrophobicContact CG1-CD1 4.1Å; V527-L533 HydrophobicContact CG2-CB 4.34Å; V527-L533 HydrophobicContact CG2-CD1 4.35Å; L533-V535 HydrophobicContact CD2-CG2 4.28Å; L533-V535 HydrophobicContact CG-CG2 4.09Å; L533-L544 HydrophobicContact CB-CB 4.28Å; L533-L544 HydrophobicContact CD2-CD1 4.09Å; L533-L544 PolarHBondContact N-O 2.95Å; L533-L544 PolarHBondContact O-N 3.4Å; L533-A546 HydrophobicContact CB-CB 4.42Å
534	S	87.7	Confident	87.3	Confident	72 Å²	72	51.5 Å²	51.5	50%	0.503	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	125.3	175	62.2	0	0	0	0	111.1	E526	E526-S534 WeakPolarHBondContact OE1-CB 3.21Å; E526-S534 PolarHBondContact OE1-N 2.73Å; E526-S534 PolarHBondContact OE1-OG 2.82Å
535	V	87.1	Confident	87	Confident	9 Å²	9	55.2 Å²	55.2	6%	0.055	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	116.2	176.2	-176.8	0	0	0	0	108.5	A482 L495 L533 K537 V541 C542 L544	A482-V535 HydrophobicContact CB-CG2 4.23Å; L495-V535 HydrophobicContact CD1-CG1 4.23Å; L533-V535 HydrophobicContact CD2-CG2 4.28Å; L533-V535 HydrophobicContact CG-CG2 4.09Å; V535-K537 HydrophobicContact CG1-CD 4.48Å; V535-K537 HydrophobicContact CG1-CG 4.5Å; V535-V541 WeakPolarHBondContact O-CA 3.38Å; V535-C542 PolarHBondContact N-O 3.32Å; V535-C542 PolarHBondContact O-N 3.13Å; V535-L544 HydrophobicContact CG2-CD1 4.33Å
536	A	87.9	Confident	86.8	Confident	76 Å²	76	53 Å²	53	63%	0.628	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.1	90.2	174.3	0	0	0	0	0	109.6	I540 V541	A536-I540 WeakPolarHBondContact CA-O 3.39Å; A536-V541 HydrophobicContact CB-CG1 4.5Å; A536-V541 HydrophobicContact CB-CG2 4.23Å
537	K	86.2	Confident	86.7	Confident	89 Å²	89	53.1 Å²	53.1	39%	0.387	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	144.9	-178.3	-70.9	178.6	-175.7	170.7	0	110.7	I484 V535 G539 I540	I484-K537 VanDerWaalsContact CD1-C 3.5Å; I484-K537 HydrophobicContact CD1-CB 3.38Å; I484-K537 WeakPolarHBondContact CD1-O 3.25Å; I484-K537 HydrophobicContact CG1-CB 4.34Å; V535-K537 HydrophobicContact CG1-CD 4.48Å; V535-K537 HydrophobicContact CG1-CG 4.5Å; K537-G539 PolarHBondContact O-N 3.23Å; K537-I540 PolarHBondContact N-O 3.04Å; K537-I540 PolarHBondContact O-N 3.22Å
538	A	84.2	Confident	86.6	Confident	63 Å²	63	53.2 Å²	53.2	52%	0.521	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.5	31.7	174.4	0	0	0	0	0	115.8	I484 F493 I540	I484-A538 HydrophobicContact CD1-CB 4.06Å; I484-A538 HydrophobicContact CG2-CB 4.29Å; F493-A538 HydrophobicContact CD1-CB 4.43Å; F493-A538 HydrophobicContact CD2-CB 4.27Å; F493-A538 HydrophobicContact CE2-CB 4.45Å; F493-A538 HydrophobicContact CG-CB 4.26Å; A538-I540 VanDerWaalsContact C-N 3.29Å; A538-I540 PolarHBondContact O-N 3.22Å
539	G	82.1	Confident	86.7	Confident	80 Å²	80	53.3 Å²	53.3	83%	0.825	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.6	-4.9	-177.4	0	0	0	0	0	115	K537	K537-G539 PolarHBondContact O-N 3.23Å
540	I	83.3	Confident	87.3	Confident	43 Å²	43	49.9 Å²	49.9	22%	0.221	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	112.9	171.4	-54.8	178.8	0	0	0	107.5	I484 F493 A536 K537 A538 C542	I484-I540 HydrophobicContact CD1-CB 4.15Å; I484-I540 HydrophobicContact CD1-CD1 4.15Å; I484-I540 HydrophobicContact CD1-CG1 4.42Å; I484-I540 HydrophobicContact CG2-CD1 4.37Å; F493-I540 HydrophobicContact CB-CD1 4.14Å; A536-I540 WeakPolarHBondContact CA-O 3.39Å; K537-I540 PolarHBondContact N-O 3.04Å; K537-I540 PolarHBondContact O-N 3.22Å; A538-I540 VanDerWaalsContact C-N 3.29Å; A538-I540 PolarHBondContact O-N 3.22Å; I540-C542 HydrophobicContact CG2-CB 4.38Å
541	V	89.5	Confident	87.7	Confident	126 Å²	126	44.1 Å²	44.1	76%	0.764	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.9	108.7	168.9	-175.2	0	0	0	0	107.1	V535 A536	V535-V541 WeakPolarHBondContact O-CA 3.38Å; A536-V541 HydrophobicContact CB-CG1 4.5Å; A536-V541 HydrophobicContact CB-CG2 4.23Å
542	C	85.5	Confident	88	Confident	33 Å²	33	43.3 Å²	43.3	22%	0.223	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	146.9	179.6	61.9	0	0	0	0	110.7	L495 V535 I540	L495-C542 VanDerWaalsContact CD2-SG 3.58Å; V535-C542 PolarHBondContact N-O 3.32Å; V535-C542 PolarHBondContact O-N 3.13Å; I540-C542 HydrophobicContact CG2-CB 4.38Å
543	Q	87.7	Confident	88.2	Confident	129 Å²	129	42.4 Å²	42.4	60%	0.603	27%	0.265	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.8	114.4	168.4	-171.4	174.3	3.5	0	0	107.5	T532	T532-Q543 VanDerWaalsContact CB-NE2 3.34Å; T532-Q543 HydrophobicContact CG2-CG 4.38Å; T532-Q543 PolarHBondContact OG1-NE2 2.88Å
544	L	85.4	Confident	88.4	Confident	28 Å²	28	42.2 Å²	42.2	15%	0.147	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	138.9	175.7	-62.9	174.4	0	0	0	109	A482 L495 T532 L533 V535	A482-L544 HydrophobicContact CB-CD1 3.78Å; L495-L544 HydrophobicContact CD2-CD1 4.1Å; L495-L544 HydrophobicContact CD2-CD2 3.92Å; L495-L544 HydrophobicContact CD2-CG 4.37Å; T532-L544 CarbonylContact C-O 3.59Å; T532-L544 WeakPolarHBondContact CA-O 3.41Å; L533-L544 HydrophobicContact CB-CB 4.28Å; L533-L544 HydrophobicContact CD2-CD1 4.09Å; L533-L544 PolarHBondContact N-O 2.95Å; L533-L544 PolarHBondContact O-N 3.4Å; V535-L544 HydrophobicContact CG2-CD1 4.33Å
545	N	84	Confident	88.6	Confident	78 Å²	78	40.2 Å²	40.2	42%	0.417	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	127.8	170.5	-67.2	-24.7	0	0	0	108.4	R547	N545-R547 PolarHBondContact ND2-NH2 2.7Å
546	A	85.6	Confident	88.8	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	25%	0.247	C	C	.	.			trans	-133.2	62.5	179.3	0	0	0	0	0	108.3	V527 Q531 L533 S548	V527-A546 HydrophobicContact CG1-CB 3.91Å; V527-A546 HydrophobicContact CG2-CB 4.43Å; Q531-A546 CarbonylContact O-C 3.59Å; Q531-A546 PolarHBondContact O-N 3.32Å; L533-A546 HydrophobicContact CB-CB 4.42Å; A546-S548 PolarHBondContact O-N 2.72Å
547	R	87	Confident	88.8	Confident	51 Å²	51	40.5 Å²	40.5	19%	0.192	24%	0.242	C	C	.	.			trans	-83	60.9	-178.5	-42.4	173.2	-154	171.1	8	108.6	R426 E440 D504 N505 Q531 N545	R426-R547 VanDerWaalsContact NH2-CB 3.28Å; R426-R547 VanDerWaalsContact NH2-CD 3.34Å; E440-R547 VanDerWaalsContact OE1-CB 3.25Å; E440-R547 WeakPolarHBondContact OE1-CB 3.46Å; E440-R547 VanDerWaalsContact OE2-CA 3.31Å; E440-R547 WeakPolarHBondContact OE2-CA 3.42Å; E440-R547 VanDerWaalsContact OE2-O 3.09Å; D504-R547 WeakPolarHBondContact OD1-CA 3.3Å; D504-R547 VanDerWaalsContact OD1-CB 3.23Å; D504-R547 WeakPolarHBondContact OD1-CB 3.46Å; D504-R547 WeakPolarHBondContact OD1-CG 3.27Å; D504-R547 PolarHBondContact OD1-N 2.74Å; N505-R547 WeakPolarHBondContact CA-O 3.49Å; N505-R547 PolarHBondContact N-O 3.09Å; Q531-R547 HydrophobicContact CB-CG 4.27Å; N545-R547 PolarHBondContact ND2-NH2 2.7Å
548	S	89.7	Confident	88.8	Confident	5 Å²	5	40.8 Å²	40.8	4%	0.035	25%	0.245	C	C	.	.			trans	-104.3	134.1	179.9	61.5	0	0	0	0	110.9	E440 S503 A546	E440-S548 PolarHBondContact OE2-N 3.48Å; S503-S548 WeakPolarHBondContact O-CB 3.36Å; S503-S548 VanDerWaalsContact OG-CB 3.27Å; S503-S548 WeakPolarHBondContact OG-CB 3.47Å; A546-S548 PolarHBondContact O-N 2.72Å
549	S	92.6	Very high	88.9	Confident	4 Å²	4	41.6 Å²	41.6	3%	0.028	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	133.3	164.8	-99.9	0	0	0	0	110.1	L420 E440 I441 G506 V507 C508	L420-S549 WeakPolarHBondContact CD1-OG 3.48Å; E440-S549 WeakPolarHBondContact CB-OG 3.39Å; I441-S549 PolarHBondContact N-OG 2.88Å; I441-S549 WeakPolarHBondContact O-CB 3.3Å; I441-S549 PolarHBondContact O-OG 3.12Å; G506-S549 PolarHBondContact O-N 2.99Å; V507-S549 CarbonylContact C-O 3.54Å; V507-S549 VanDerWaalsContact CA-O 3.26Å; V507-S549 WeakPolarHBondContact CA-O 3.46Å; C508-S549 PolarHBondContact N-O 2.68Å
550	I	94.5	Very high	89.1	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125.3	179.2	-56	-173.1	0	0	0	109.9	N442 I443 I510 L524 M528 A552 F581	N442-I550 WeakPolarHBondContact CA-O 3.39Å; N442-I550 PolarHBondContact OD1-N 3.32Å; I443-I550 PolarHBondContact N-O 2.7Å; I510-I550 HydrophobicContact CD1-CG2 4Å; L524-I550 HydrophobicContact CD2-CD1 4.18Å; M528-I550 HydrophobicContact CG-CD1 3.43Å; M528-I550 VanDerWaalsContact CG-CD1 3.43Å; M528-I550 HydrophobicContact CG-CG1 4.45Å; M528-I550 HydrophobicContact SD-CD1 4.07Å; I550-A552 HydrophobicContact CG2-CB 4.32Å; I550-F581 HydrophobicContact CG2-CE1 4.39Å
551	L	95.4	Very high	89.1	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	106.4	167.7	-175.3	61.5	0	0	0	108.3	L420 I443 L445 L457 V460 V507 C508 C509 I510	L420-L551 HydrophobicContact CD2-CB 3.82Å; L420-L551 HydrophobicContact CD2-CD1 4.1Å; L420-L551 HydrophobicContact CD2-CD2 4.18Å; L420-L551 HydrophobicContact CD2-CG 4.23Å; I443-L551 HydrophobicContact CB-CD1 3.74Å; I443-L551 HydrophobicContact CG2-CD1 3.86Å; L445-L551 HydrophobicContact CD1-CD1 4.3Å; L445-L551 HydrophobicContact CG-CD1 4.4Å; L457-L551 HydrophobicContact CD2-CB 4.15Å; L457-L551 HydrophobicContact CD2-CD2 3.5Å; L457-L551 VanDerWaalsContact CD2-CD2 3.5Å; L457-L551 HydrophobicContact CD2-CG 3.39Å; V460-L551 HydrophobicContact CB-CD2 4.2Å; V460-L551 HydrophobicContact CG1-CD2 4.14Å; V460-L551 HydrophobicContact CG2-CD2 4.02Å; V507-L551 HydrophobicContact CG1-CB 3.91Å; C508-L551 PolarHBondContact O-N 3.27Å; C509-L551 CarbonylContact C-O 3.52Å; C509-L551 VanDerWaalsContact CA-O 3.31Å; C509-L551 WeakPolarHBondContact CA-O 3.38Å; I510-L551 PolarHBondContact N-O 2.89Å
552	A	94.7	Very high	88.7	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	141	-176.4	0	0	0	0	0	111.3	I443 L444 L445 I510 F513 I550 F581	I443-A552 PolarHBondContact O-N 2.68Å; L444-A552 CarbonylContact C-O 3.58Å; L444-A552 WeakPolarHBondContact CA-O 3.47Å; L444-A552 HydrophobicContact CD1-CB 3.75Å; L445-A552 PolarHBondContact N-O 3.5Å; I510-A552 CarbonylContact O-C 3.59Å; I510-A552 WeakPolarHBondContact O-CA 3.17Å; F513-A552 HydrophobicContact CB-CB 4.37Å; F513-A552 HydrophobicContact CD2-CB 4.01Å; F513-A552 HydrophobicContact CE2-CB 4.44Å; F513-A552 HydrophobicContact CG-CB 4.14Å; I550-A552 HydrophobicContact CG2-CB 4.32Å; A552-F581 HydrophobicContact CB-CE1 4.12Å; A552-F581 HydrophobicContact CB-CZ 4.16Å
553	A	94.4	Very high	88.2	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	131.7	167.6	0	0	0	0	0	110.2	L445 K453 L457 I510 E512 F513	L445-A553 CarbonylContact O-C 3.53Å; L445-A553 WeakPolarHBondContact O-CA 3.22Å; K453-A553 HydrophobicContact CB-CB 4.13Å; K453-A553 HydrophobicContact CD-CB 4.3Å; L457-A553 HydrophobicContact CD1-CB 3.68Å; L457-A553 HydrophobicContact CG-CB 4.38Å; I510-A553 PolarHBondContact O-N 2.89Å; E512-A553 PolarHBondContact N-O 2.71Å; F513-A553 VanDerWaalsContact CB-O 3.29Å; F513-A553 WeakPolarHBondContact CB-O 3.45Å; F513-A553 PolarHBondContact N-O 2.64Å
554	A	92.9	Very high	87.6	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	146.5	176.7	0	0	0	0	0	110.4	L444 L445 C446 K453 F513 V571	L444-A554 HydrophobicContact CD1-CB 4.12Å; L445-A554 PolarHBondContact O-N 2.82Å; C446-A554 WeakPolarHBondContact CA-O 3.04Å; K453-A554 PolarHBondContact NZ-O 2.59Å; F513-A554 HydrophobicContact CB-CB 4.28Å; A554-V571 HydrophobicContact CB-CG1 3.88Å
555	N	91.2	Very high	87.1	Confident	30 Å²	30	44 Å²	44	16%	0.16	22%	0.222	C	C	.	.			trans	-109.9	151.1	174.4	-60.9	-42.3	0	0	0	109.9	K453 D514	K453-N555 PolarHBondContact NZ-OD1 3.27Å; D514-N555 PolarHBondContact OD1-N 2.77Å
556	P	90.4	Very high	86.6	Confident	6 Å²	6	43.6 Å²	43.6	4%	0.039	22%	0.223	C	C	.	.			trans	-67.3	151.4	175.1	28.9	-36.3	0	0	0	110.6	G447 E558 S559 W561 N570	G447-P556 WeakPolarHBondContact O-CD 3.46Å; P556-E558 VanDerWaalsContact C-N 3.26Å; P556-E558 PolarHBondContact O-N 2.86Å; P556-S559 PolarHBondContact O-N 3.01Å; P556-S559 VanDerWaalsContact O-N 3.1Å; P556-W561 HydrophobicContact CB-CE3 4.07Å; P556-W561 HydrophobicContact CB-CZ3 4.48Å; P556-N570 WeakPolarHBondContact CA-O 3.41Å
557	V	88.3	Confident	86.1	Confident	84 Å²	84	44.6 Å²	44.6	51%	0.509	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-37.7	-179.3	174.9	0	0	0	0	112	S559 N570 Q572	V557-S559 VanDerWaalsContact C-N 3.26Å; V557-S559 PolarHBondContact O-N 3.17Å; V557-N570 WeakPolarHBondContact CG2-O 3.38Å; V557-N570 PolarHBondContact N-O 3.25Å; V557-Q572 HydrophobicContact CG2-CB 4.09Å
558	E	87.1	Confident	85.7	Confident	96 Å²	96	43.9 Å²	43.9	45%	0.449	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	9.4	-178.4	-67.7	-177.3	175.2	0	0	113.4	P556 Q560 N562 K565	P556-E558 VanDerWaalsContact C-N 3.26Å; P556-E558 PolarHBondContact O-N 2.86Å; E558-Q560 PolarHBondContact O-N 3.36Å; E558-N562 WeakPolarHBondContact OE2-CB 3.34Å; E558-N562 PolarHBondContact OE2-ND2 2.89Å; E558-K565 IonicContact OE1-NZ 2.79Å; E558-K565 PolarHBondContact OE1-NZ 2.66Å
559	S	85.3	Confident	85.2	Confident	80 Å²	80	49.4 Å²	49.4	56%	0.559	25%	0.254	S	S	*	.	S	Bend	trans	60.4	-26.2	-170.1	-52.6	0	0	0	0	115.1	P449 P556 V557	P449-S559 WeakPolarHBondContact CD-O 3.48Å; P556-S559 PolarHBondContact O-N 3.01Å; P556-S559 VanDerWaalsContact O-N 3.1Å; V557-S559 VanDerWaalsContact C-N 3.26Å; V557-S559 PolarHBondContact O-N 3.17Å
560	Q	85.6	Confident	84.8	Confident	120 Å²	120	49.4 Å²	49.4	56%	0.561	25%	0.254	S	S	*	.	S	Bend	trans	-111	145.7	168.5	-170.4	172.6	13.9	0	0	109.7	D448 E558 N562	D448-Q560 WeakPolarHBondContact OD1-CA 3.43Å; E558-Q560 PolarHBondContact O-N 3.36Å; Q560-N562 PolarHBondContact O-N 2.95Å; Q560-N562 VanDerWaalsContact O-N 3.09Å
561	W	83.4	Confident	84.1	Confident	17 Å²	17	49.5 Å²	49.5	6%	0.064	26%	0.255	C	S	.	.			trans	-67.8	105.7	176.1	-168.7	-96.9	0	0	0	110.9	D448 P556 Q563 I567 N570 V571 L586 V588	D448-W561 WeakPolarHBondContact OD1-CB 3.12Å; D448-W561 PolarHBondContact OD1-N 3.09Å; P556-W561 HydrophobicContact CB-CE3 4.07Å; P556-W561 HydrophobicContact CB-CZ3 4.48Å; W561-Q563 PolarHBondContact O-N 3.47Å; W561-I567 HydrophobicContact CH2-CB 4.12Å; W561-I567 HydrophobicContact CH2-CG1 3.58Å; W561-I567 HydrophobicContact CH2-CG2 4.23Å; W561-I567 HydrophobicContact CZ2-CB 4.37Å; W561-I567 HydrophobicContact CZ2-CD1 4.48Å; W561-I567 HydrophobicContact CZ2-CG1 3.46Å; W561-I567 VanDerWaalsContact CZ2-CG1 3.46Å; W561-N570 VanDerWaalsContact CE2-ND2 3.32Å; W561-N570 HydrophobicContact CE3-CB 4.25Å; W561-N570 HydrophobicContact CH2-CB 3.68Å; W561-N570 HydrophobicContact CZ2-CB 4.17Å; W561-N570 VanDerWaalsContact CZ2-ND2 3.34Å; W561-N570 WeakPolarHBondContact CZ2-ND2 3.48Å; W561-N570 HydrophobicContact CZ3-CB 3.74Å; W561-V571 HydrophobicContact CH2-CG2 4.19Å; W561-V571 HydrophobicContact CZ3-CG2 3.94Å; W561-L586 HydrophobicContact CD2-CD1 3.75Å; W561-L586 HydrophobicContact CD2-CD2 4.5Å; W561-L586 HydrophobicContact CE3-CD1 3.59Å; W561-L586 HydrophobicContact CH2-CD1 3.49Å; W561-L586 VanDerWaalsContact CH2-CD1 3.49Å; W561-L586 HydrophobicContact CZ2-CD1 3.64Å; W561-L586 HydrophobicContact CZ2-CD2 3.92Å; W561-L586 HydrophobicContact CZ2-CG 4.46Å; W561-L586 HydrophobicContact CZ3-CD1 3.45Å; W561-L586 VanDerWaalsContact CZ3-CD1 3.45Å; W561-V588 HydrophobicContact CG-CG2 4.33Å
562	N	82.2	Confident	83.6	Confident	41 Å²	41	56.2 Å²	56.2	22%	0.219	29%	0.286	C	S	.	.			trans	-80.3	110.2	175.3	-167.9	-20.3	0	0	0	110	E558 Q560 Q564 K565 N570	E558-N562 WeakPolarHBondContact OE2-CB 3.34Å; E558-N562 PolarHBondContact OE2-ND2 2.89Å; Q560-N562 PolarHBondContact O-N 2.95Å; Q560-N562 VanDerWaalsContact O-N 3.09Å; N562-Q564 PolarHBondContact O-N 3.36Å; N562-Q564 PolarHBondContact OD1-N 3.31Å; N562-Q564 VanDerWaalsContact OD1-N 3.17Å; N562-K565 HydrophobicContact CB-CD 4.29Å; N562-K565 PolarHBondContact O-N 3.14Å; N562-N570 PolarHBondContact O-ND2 3.39Å
563	Q	75.3	Confident	83	Confident	43 Å²	43	56.5 Å²	56.5	20%	0.201	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-19.7	-173.6	-55.5	-172.7	17.8	0	0	113.2	W561 K565 P713 L714	W561-Q563 PolarHBondContact O-N 3.47Å; Q563-K565 PolarHBondContact O-N 3.32Å; Q563-P713 HydrophobicContact CG-CB 4.43Å; Q563-P713 HydrophobicContact CG-CG 3.92Å; Q563-L714 VanDerWaalsContact CD-CD1 3.46Å; Q563-L714 VanDerWaalsContact CD-CG 3.47Å; Q563-L714 HydrophobicContact CG-CD1 4.42Å
564	Q	75	Confident	82.4	Confident	185 Å²	185	59.1 Å²	59.1	86%	0.864	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	-14	178.5	-61	-177.6	-12.4	0	0	112.9	N562	N562-Q564 PolarHBondContact O-N 3.36Å; N562-Q564 PolarHBondContact OD1-N 3.31Å; N562-Q564 VanDerWaalsContact OD1-N 3.17Å
565	K	75.2	Confident	81.8	Confident	83 Å²	83	64.6 Å²	64.6	36%	0.361	33%	0.33	S	S	.	.	S	Bend	trans	-103.8	148.9	-176.6	-71.8	-179.2	178.8	179.5	0	110.4	E558 N562 Q563 E569 N570	E558-K565 IonicContact OE1-NZ 2.79Å; E558-K565 PolarHBondContact OE1-NZ 2.66Å; N562-K565 HydrophobicContact CB-CD 4.29Å; N562-K565 PolarHBondContact O-N 3.14Å; Q563-K565 PolarHBondContact O-N 3.32Å; K565-E569 HydrophobicContact CB-CB 4.31Å; K565-N570 WeakPolarHBondContact CB-OD1 3.4Å; K565-N570 PolarHBondContact O-ND2 2.8Å
566	T	73.6	Confident	81.5	Confident	70 Å²	70	66.9 Å²	66.9	43%	0.429	35%	0.345	S	S	.	.			trans	-69.9	157.7	174.5	61.7	0	0	0	0	110.8	V568 E569 N570	T566-V568 PolarHBondContact O-N 2.92Å; T566-E569 PolarHBondContact N-OE2 2.62Å; T566-E569 VanDerWaalsContact N-OE2 3.11Å; T566-E569 PolarHBondContact O-N 2.82Å; T566-E569 VanDerWaalsContact OG1-CD 3.27Å; T566-E569 WeakPolarHBondContact OG1-CG 3.36Å; T566-E569 PolarHBondContact OG1-OE2 3.26Å; T566-N570 PolarHBondContact O-N 2.97Å
567	I	74.5	Confident	81.3	Confident	20 Å²	20	66.6 Å²	66.6	10%	0.103	34%	0.343	C	S	.	.	H	α-helix	trans	-54.6	-38.5	177.2	-72.7	165.7	0	0	0	112.5	W561 E569 N570 V571 V709	W561-I567 HydrophobicContact CH2-CB 4.12Å; W561-I567 HydrophobicContact CH2-CG1 3.58Å; W561-I567 HydrophobicContact CH2-CG2 4.23Å; W561-I567 HydrophobicContact CZ2-CB 4.37Å; W561-I567 HydrophobicContact CZ2-CD1 4.48Å; W561-I567 HydrophobicContact CZ2-CG1 3.46Å; W561-I567 VanDerWaalsContact CZ2-CG1 3.46Å; I567-E569 VanDerWaalsContact C-N 3.29Å; I567-E569 PolarHBondContact O-N 2.79Å; I567-N570 PolarHBondContact O-N 2.9Å; I567-V571 HydrophobicContact CG2-CG2 4.32Å; I567-V571 WeakPolarHBondContact O-CG2 3.31Å; I567-V571 PolarHBondContact O-N 2.96Å; I567-V709 HydrophobicContact CD1-CB 3.4Å; I567-V709 VanDerWaalsContact CD1-CB 3.4Å; I567-V709 HydrophobicContact CD1-CG1 3.27Å; I567-V709 HydrophobicContact CD1-CG2 3.5Å; I567-V709 WeakPolarHBondContact CD1-O 3.3Å
568	V	77.9	Confident	81	Confident	37 Å²	37	63.2 Å²	63.2	22%	0.224	32%	0.322	C	S	.	.	H	α-helix	trans	-63.1	-40.7	-178.6	-172.2	0	0	0	0	110.6	T566 Q572 M578	T566-V568 PolarHBondContact O-N 2.92Å; V568-Q572 WeakPolarHBondContact O-CA 3.03Å; V568-Q572 PolarHBondContact O-N 3.11Å; V568-M578 HydrophobicContact CB-CE 4.3Å; V568-M578 HydrophobicContact CG1-CE 3.92Å; V568-M578 HydrophobicContact CG2-CE 3.77Å; V568-M578 HydrophobicContact CG2-SD 4.46Å
569	E	80.5	Confident	80.8	Confident	120 Å²	120	60.5 Å²	60.5	56%	0.561	31%	0.313	S	S	*	.	H	α-helix	trans	-74.6	-35.8	176.8	-68	167.3	155.7	0	0	111.9	K565 T566 I567	K565-E569 HydrophobicContact CB-CB 4.31Å; T566-E569 PolarHBondContact N-OE2 2.62Å; T566-E569 VanDerWaalsContact N-OE2 3.11Å; T566-E569 PolarHBondContact O-N 2.82Å; T566-E569 VanDerWaalsContact OG1-CD 3.27Å; T566-E569 WeakPolarHBondContact OG1-CG 3.36Å; T566-E569 PolarHBondContact OG1-OE2 3.26Å; I567-E569 VanDerWaalsContact C-N 3.29Å; I567-E569 PolarHBondContact O-N 2.79Å
570	N	83.5	Confident	81	Confident	4 Å²	4	58.3 Å²	58.3	2%	0.021	29%	0.293	C	S	.	.	H	α-helix	trans	-69.3	-35.9	180	-83.7	-19.8	0	0	0	113.6	P556 V557 W561 N562 K565 T566 I567	P556-N570 WeakPolarHBondContact CA-O 3.41Å; V557-N570 WeakPolarHBondContact CG2-O 3.38Å; V557-N570 PolarHBondContact N-O 3.25Å; W561-N570 VanDerWaalsContact CE2-ND2 3.32Å; W561-N570 HydrophobicContact CE3-CB 4.25Å; W561-N570 HydrophobicContact CH2-CB 3.68Å; W561-N570 HydrophobicContact CZ2-CB 4.17Å; W561-N570 VanDerWaalsContact CZ2-ND2 3.34Å; W561-N570 WeakPolarHBondContact CZ2-ND2 3.48Å; W561-N570 HydrophobicContact CZ3-CB 3.74Å; N562-N570 PolarHBondContact O-ND2 3.39Å; K565-N570 WeakPolarHBondContact CB-OD1 3.4Å; K565-N570 PolarHBondContact O-ND2 2.8Å; T566-N570 PolarHBondContact O-N 2.97Å; I567-N570 PolarHBondContact O-N 2.9Å
571	V	79.9	Confident	81.2	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.024	27%	0.269	C	S	.	.	H	α-helix	trans	-103.7	-17.3	-175.8	-165.3	0	0	0	0	112.4	C446 A554 W561 I567 L573	C446-V571 HydrophobicContact CB-CG2 4.43Å; A554-V571 HydrophobicContact CB-CG1 3.88Å; W561-V571 HydrophobicContact CH2-CG2 4.19Å; W561-V571 HydrophobicContact CZ3-CG2 3.94Å; I567-V571 HydrophobicContact CG2-CG2 4.32Å; I567-V571 WeakPolarHBondContact O-CG2 3.31Å; I567-V571 PolarHBondContact O-N 2.96Å; V571-L573 VanDerWaalsContact C-N 3.32Å; V571-L573 HydrophobicContact CB-CG 4.5Å; V571-L573 HydrophobicContact CG1-CD1 3.71Å; V571-L573 HydrophobicContact CG1-CG 3.83Å; V571-L573 PolarHBondContact O-N 2.91Å
572	Q	83.9	Confident	81.5	Confident	140 Å²	140	52.6 Å²	52.6	65%	0.654	27%	0.267	S	S	*	.			trans	55.4	40.6	180	-159.4	-174.2	-29.7	0	0	113.7	V557 V568	V557-Q572 HydrophobicContact CG2-CB 4.09Å; V568-Q572 WeakPolarHBondContact O-CA 3.03Å; V568-Q572 PolarHBondContact O-N 3.11Å
573	L	81.9	Confident	81.9	Confident	6 Å²	6	50.8 Å²	50.8	3%	0.031	26%	0.257	C	S	.	.			trans	-101.1	140.4	174.8	-66.4	175.9	0	0	0	111.7	L444 F513 V571 L577 M578	L444-L573 HydrophobicContact CD2-CD1 3.96Å; F513-L573 HydrophobicContact CD1-CD1 4.01Å; F513-L573 HydrophobicContact CD1-CD2 3.98Å; F513-L573 HydrophobicContact CE1-CD1 4.09Å; F513-L573 HydrophobicContact CE1-CD2 3.96Å; V571-L573 VanDerWaalsContact C-N 3.32Å; V571-L573 HydrophobicContact CB-CG 4.5Å; V571-L573 HydrophobicContact CG1-CD1 3.71Å; V571-L573 HydrophobicContact CG1-CG 3.83Å; V571-L573 PolarHBondContact O-N 2.91Å; L573-L577 HydrophobicContact CD2-CD2 4.39Å; L573-M578 HydrophobicContact CB-CG 3.92Å; L573-M578 HydrophobicContact CB-SD 4.32Å
574	P	82.7	Confident	82.6	Confident	55 Å²	55	50 Å²	50	36%	0.357	25%	0.254	S	S	.	.			trans	-60.2	139.6	173.2	-22.8	33	0	0	0	112.2	T576 L577 M578	P574-T576 PolarHBondContact O-N 2.78Å; P574-T576 VanDerWaalsContact O-N 3.14Å; P574-L577 WeakPolarHBondContact O-CB 3.43Å; P574-L577 PolarHBondContact O-N 2.95Å; P574-M578 PolarHBondContact O-N 2.94Å; P574-M578 VanDerWaalsContact O-N 3.12Å
575	H	79.8	Confident	83.3	Confident	116 Å²	116	41.2 Å²	41.2	54%	0.537	21%	0.213	S	C	.	.	H	α-helix	trans	-56	-31.1	175.8	-67.9	-88	0	0	0	113.6	L577 M578 S579	H575-L577 PolarHBondContact O-N 3.16Å; H575-M578 HydrophobicContact CB-CE 4.31Å; H575-S579 WeakPolarHBondContact O-CB 2.89Å; H575-S579 PolarHBondContact O-N 3.36Å; H575-S579 PolarHBondContact O-OG 3.44Å
576	T	84.6	Confident	83.8	Confident	77 Å²	77	37.9 Å²	37.9	47%	0.472	20%	0.199	S	C	.	.	H	α-helix	trans	-66	-24.5	176.9	56	0	0	0	0	113.1	Q525 P574 S579 R580	Q525-T576 PolarHBondContact NE2-OG1 3.38Å; P574-T576 PolarHBondContact O-N 2.78Å; P574-T576 VanDerWaalsContact O-N 3.14Å; T576-S579 PolarHBondContact O-OG 3.09Å; T576-R580 WeakPolarHBondContact O-CG 3.45Å; T576-R580 PolarHBondContact O-NH1 3.3Å
577	L	86.5	Confident	84.5	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-91.5	-43.9	177.4	-173.5	62.6	0	0	0	110.9	F513 R521 Q525 M528 L573 P574 H575 S579 R580 F581	F513-L577 HydrophobicContact CE1-CD2 3.61Å; F513-L577 HydrophobicContact CE1-CG 4.35Å; F513-L577 HydrophobicContact CZ-CD1 4.5Å; F513-L577 HydrophobicContact CZ-CD2 3.71Å; F513-L577 HydrophobicContact CZ-CG 4.35Å; R521-L577 HydrophobicContact CB-CD2 4.47Å; Q525-L577 HydrophobicContact CG-CD1 4.18Å; M528-L577 HydrophobicContact SD-CD1 3.84Å; L573-L577 HydrophobicContact CD2-CD2 4.39Å; P574-L577 WeakPolarHBondContact O-CB 3.43Å; P574-L577 PolarHBondContact O-N 2.95Å; H575-L577 PolarHBondContact O-N 3.16Å; L577-S579 VanDerWaalsContact C-N 3.27Å; L577-S579 PolarHBondContact O-N 3.07Å; L577-R580 WeakPolarHBondContact O-CB 3.45Å; L577-R580 PolarHBondContact O-N 3.36Å; L577-F581 HydrophobicContact CG-CE2 4.18Å; L577-F581 WeakPolarHBondContact O-CD2 3.24Å
578	M	83	Confident	84.9	Confident	13 Å²	13	36 Å²	36	6%	0.064	19%	0.188	C	C	.	.	H	α-helix	trans	-57.5	-41.6	176	-68.6	-172.5	-62.8	0	0	111.9	V568 L573 P574 H575 R580 F581 I584	V568-M578 HydrophobicContact CB-CE 4.3Å; V568-M578 HydrophobicContact CG1-CE 3.92Å; V568-M578 HydrophobicContact CG2-CE 3.77Å; V568-M578 HydrophobicContact CG2-SD 4.46Å; L573-M578 HydrophobicContact CB-CG 3.92Å; L573-M578 HydrophobicContact CB-SD 4.32Å; P574-M578 PolarHBondContact O-N 2.94Å; P574-M578 VanDerWaalsContact O-N 3.12Å; H575-M578 HydrophobicContact CB-CE 4.31Å; M578-R580 PolarHBondContact O-N 3.35Å; M578-R580 VanDerWaalsContact O-N 3.13Å; M578-F581 PolarHBondContact O-N 2.86Å; M578-I584 HydrophobicContact CB-CD1 4.33Å
579	S	82.9	Confident	85.2	Confident	39 Å²	39	37.5 Å²	37.5	27%	0.273	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-8.6	176.8	59.4	0	0	0	0	114.9	H575 T576 L577 R669	H575-S579 WeakPolarHBondContact O-CB 2.89Å; H575-S579 PolarHBondContact O-N 3.36Å; H575-S579 PolarHBondContact O-OG 3.44Å; T576-S579 PolarHBondContact O-OG 3.09Å; L577-S579 VanDerWaalsContact C-N 3.27Å; L577-S579 PolarHBondContact O-N 3.07Å; S579-R669 WeakPolarHBondContact O-CD 3.35Å; S579-R669 PolarHBondContact O-NH1 3.34Å; S579-R669 PolarHBondContact OG-NH1 2.83Å
580	R	89	Confident	85.2	Confident	35 Å²	35	34.6 Å²	34.6	13%	0.132	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-14.4	176.4	-70.6	-176.3	173.9	115	-19	113.6	R438 Q525 M528 E529 T576 L577 M578	R438-R580 PolarHBondContact NH1-O 2.9Å; Q525-R580 VanDerWaalsContact CB-CZ 3.44Å; Q525-R580 PolarHBondContact O-NE 2.98Å; Q525-R580 PolarHBondContact O-NH2 2.9Å; M528-R580 HydrophobicContact CB-CB 4.26Å; M528-R580 HydrophobicContact CE-CB 3.76Å; M528-R580 HydrophobicContact SD-CB 4.33Å; E529-R580 IonicContact OE2-NE 2.61Å; E529-R580 PolarHBondContact OE2-NE 2.71Å; E529-R580 VanDerWaalsContact OE2-NE 3.16Å; T576-R580 WeakPolarHBondContact O-CG 3.45Å; T576-R580 PolarHBondContact O-NH1 3.3Å; L577-R580 WeakPolarHBondContact O-CB 3.45Å; L577-R580 PolarHBondContact O-N 3.36Å; M578-R580 PolarHBondContact O-N 3.35Å; M578-R580 VanDerWaalsContact O-N 3.13Å
581	F	90	Very high	85.1	Confident	11 Å²	11	42.1 Å²	42.1	5%	0.048	22%	0.221	C	C	.	.			trans	-78.9	134.5	167.5	-67.9	-76.8	0	0	0	108.6	N442 L444 F513 M528 I550 A552 L577 M578 I584	N442-F581 HydrophobicContact CB-CD1 3.88Å; N442-F581 HydrophobicContact CB-CE1 4.44Å; L444-F581 HydrophobicContact CB-CB 4.32Å; L444-F581 HydrophobicContact CB-CD1 3.78Å; L444-F581 HydrophobicContact CB-CD2 4.1Å; L444-F581 HydrophobicContact CB-CE1 4.05Å; L444-F581 HydrophobicContact CB-CE2 4.34Å; L444-F581 HydrophobicContact CB-CG 3.8Å; L444-F581 HydrophobicContact CB-CZ 4.32Å; L444-F581 HydrophobicContact CD1-CE2 4.47Å; L444-F581 HydrophobicContact CD1-CZ 4.28Å; L444-F581 HydrophobicContact CD2-CD2 4.1Å; L444-F581 HydrophobicContact CD2-CE2 4.15Å; F513-F581 HydrophobicContact CE1-CE2 4.22Å; F513-F581 HydrophobicContact CE1-CZ 4.17Å; F513-F581 HydrophobicContact CZ-CE2 4.36Å; F513-F581 HydrophobicContact CZ-CZ 4.02Å; M528-F581 HydrophobicContact CE-CD1 3.65Å; M528-F581 HydrophobicContact CE-CD2 4.01Å; M528-F581 HydrophobicContact CE-CE1 3.55Å; M528-F581 HydrophobicContact CE-CE2 3.92Å; M528-F581 HydrophobicContact CE-CG 3.89Å; M528-F581 HydrophobicContact CE-CZ 3.69Å; M528-F581 HydrophobicContact SD-CZ 4.3Å; I550-F581 HydrophobicContact CG2-CE1 4.39Å; A552-F581 HydrophobicContact CB-CE1 4.12Å; A552-F581 HydrophobicContact CB-CZ 4.16Å; L577-F581 HydrophobicContact CG-CE2 4.18Å; L577-F581 WeakPolarHBondContact O-CD2 3.24Å; M578-F581 PolarHBondContact O-N 2.86Å; F581-I584 HydrophobicContact CB-CG1 4.09Å
582	D	90.5	Very high	85.4	Confident	6 Å²	6	46 Å²	46	3%	0.032	24%	0.242	C	C	.	.	S	Bend	trans	-81.2	-35.9	179.8	-59.4	-62.9	0	0	0	110.6	R438 I441 N442 S673 R676	R438-D582 IonicContact CZ-OD2 2.64Å; R438-D582 IonicContact NH2-OD1 2.66Å; R438-D582 IonicContact NH2-OD2 3.22Å; R438-D582 PolarHBondContact NH2-OD2 2.89Å; I441-D582 VanDerWaalsContact CA-OD2 3.31Å; I441-D582 WeakPolarHBondContact CA-OD2 3.34Å; I441-D582 HydrophobicContact CG2-CB 4.02Å; N442-D582 PolarHBondContact N-OD2 3.46Å; N442-D582 PolarHBondContact O-N 2.99Å; D582-S673 VanDerWaalsContact OD1-CB 3.3Å; D582-S673 WeakPolarHBondContact OD1-CB 3.37Å; D582-S673 PolarHBondContact OD1-OG 3.16Å; D582-R676 IonicContact OD1-NH1 3.93Å; D582-R676 PolarHBondContact OD1-NH1 2.79Å
583	L	90.4	Very high	85.8	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.01	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	133.5	176.2	-63.2	174.7	0	0	0	110.6	A416 N442 I443 L444 F585 L677 L701 Y702 A705	A416-L583 HydrophobicContact CB-CD1 3.78Å; N442-L583 PolarHBondContact O-N 2.92Å; I443-L583 WeakPolarHBondContact CA-O 3.41Å; I443-L583 HydrophobicContact CG1-CB 4.33Å; L444-L583 PolarHBondContact N-O 3.43Å; L583-F585 HydrophobicContact CB-CD2 4.39Å; L583-F585 HydrophobicContact CB-CE2 3.79Å; L583-F585 HydrophobicContact CB-CZ 4.43Å; L583-F585 HydrophobicContact CD1-CE2 3.97Å; L583-F585 HydrophobicContact CD1-CZ 4.18Å; L583-F585 HydrophobicContact CG-CE2 4.43Å; L583-L677 HydrophobicContact CD1-CD1 4.44Å; L583-L677 HydrophobicContact CD1-CD2 3.77Å; L583-L677 HydrophobicContact CD2-CD1 3.98Å; L583-L677 HydrophobicContact CG-CD1 4.26Å; L583-L677 HydrophobicContact CG-CD2 4.3Å; L583-L701 HydrophobicContact CD1-CD2 4.05Å; L583-Y702 HydrophobicContact CD2-CD2 3.93Å; L583-A705 HydrophobicContact CD2-CB 4.46Å
584	I	89.5	Confident	86.2	Confident	27 Å²	27	54.1 Å²	54.1	14%	0.138	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	111.5	174.5	-56.5	173.5	0	0	0	107	L444 M578 F581	L444-I584 HydrophobicContact CB-CG1 4.36Å; L444-I584 HydrophobicContact CD2-CG2 4.28Å; L444-I584 WeakPolarHBondContact O-CA 2.99Å; M578-I584 HydrophobicContact CB-CD1 4.33Å; F581-I584 HydrophobicContact CB-CG1 4.09Å
585	F	89.9	Confident	86.4	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	138.6	176.4	-71.3	-77.1	0	0	0	110.6	I413 A416 I443 L444 L445 C446 L583 L701 A705	I413-F585 HydrophobicContact CD1-CB 4.28Å; I413-F585 HydrophobicContact CG1-CB 4.24Å; I413-F585 HydrophobicContact CG1-CD1 4.04Å; I413-F585 HydrophobicContact CG1-CG 4Å; A416-F585 HydrophobicContact CB-CD2 4.34Å; A416-F585 HydrophobicContact CB-CE2 3.24Å; A416-F585 HydrophobicContact CB-CZ 3.47Å; A416-F585 VanDerWaalsContact CB-CZ 3.47Å; I443-F585 HydrophobicContact CG2-CD2 4.06Å; I443-F585 HydrophobicContact CG2-CE2 4.35Å; L444-F585 PolarHBondContact O-N 3.38Å; L445-F585 HydrophobicContact CD2-CB 4.02Å; L445-F585 HydrophobicContact CD2-CD2 4.15Å; L445-F585 HydrophobicContact CD2-CG 4.5Å; C446-F585 PolarHBondContact N-O 3.4Å; L583-F585 HydrophobicContact CB-CD2 4.39Å; L583-F585 HydrophobicContact CB-CE2 3.79Å; L583-F585 HydrophobicContact CB-CZ 4.43Å; L583-F585 HydrophobicContact CD1-CE2 3.97Å; L583-F585 HydrophobicContact CD1-CZ 4.18Å; L583-F585 HydrophobicContact CG-CE2 4.43Å; F585-L701 HydrophobicContact CE1-CD1 4.29Å; F585-L701 HydrophobicContact CZ-CD1 3.99Å; F585-L701 HydrophobicContact CZ-CG 4.23Å; F585-A705 HydrophobicContact CD1-CB 4.15Å; F585-A705 HydrophobicContact CE1-CB 3.88Å; F585-A705 HydrophobicContact CZ-CB 4.26Å
586	L	86.4	Confident	86.9	Confident	14 Å²	14	50.9 Å²	50.9	7%	0.073	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	110.2	173.7	-179.3	70.1	0	0	0	109.2	C446 W561 V588 Q708	C446-L586 HydrophobicContact CB-CD1 4.24Å; W561-L586 HydrophobicContact CD2-CD1 3.75Å; W561-L586 HydrophobicContact CD2-CD2 4.5Å; W561-L586 HydrophobicContact CE3-CD1 3.59Å; W561-L586 HydrophobicContact CH2-CD1 3.49Å; W561-L586 VanDerWaalsContact CH2-CD1 3.49Å; W561-L586 HydrophobicContact CZ2-CD1 3.64Å; W561-L586 HydrophobicContact CZ2-CD2 3.92Å; W561-L586 HydrophobicContact CZ2-CG 4.46Å; W561-L586 HydrophobicContact CZ3-CD1 3.45Å; W561-L586 VanDerWaalsContact CZ3-CD1 3.45Å; L586-V588 HydrophobicContact CD1-CG2 4.32Å; L586-V588 HydrophobicContact CD2-CG2 3.64Å; L586-V588 HydrophobicContact CG-CG2 3.68Å; L586-V588 PolarHBondContact O-N 3.2Å; L586-Q708 HydrophobicContact CB-CB 4.12Å; L586-Q708 WeakPolarHBondContact CD2-O 3.07Å; L586-Q708 PolarHBondContact O-OE1 2.89Å
587	M	86.6	Confident	87.3	Confident	9 Å²	9	56.5 Å²	56.5	4%	0.044	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	87.4	173.7	-58.1	-177.1	77.3	0	0	108.7	I413 C446 G447 D448 T451 K453	I413-M587 HydrophobicContact CD1-CE 3.77Å; I413-M587 HydrophobicContact CD1-CG 3.47Å; I413-M587 VanDerWaalsContact CD1-CG 3.47Å; I413-M587 HydrophobicContact CD1-SD 3.59Å; I413-M587 VanDerWaalsContact CD1-SD 3.59Å; C446-M587 PolarHBondContact O-N 2.84Å; G447-M587 CarbonylContact C-O 3.55Å; G447-M587 WeakPolarHBondContact CA-O 3.4Å; D448-M587 PolarHBondContact N-O 3.22Å; D448-M587 VanDerWaalsContact N-O 3.15Å; T451-M587 HydrophobicContact CG2-CB 4.33Å; T451-M587 WeakPolarHBondContact O-CE 3.46Å; K453-M587 HydrophobicContact CD-SD 4.34Å; K453-M587 HydrophobicContact CG-SD 3.58Å; K453-M587 VanDerWaalsContact CG-SD 3.58Å
588	V	83.6	Confident	87.4	Confident	40 Å²	40	61.5 Å²	61.5	24%	0.242	29%	0.287	C	S	.	.			trans	-83.4	134.9	168	-172.8	0	0	0	0	107.5	W561 L586 P590 P713	W561-V588 HydrophobicContact CG-CG2 4.33Å; L586-V588 HydrophobicContact CD1-CG2 4.32Å; L586-V588 HydrophobicContact CD2-CG2 3.64Å; L586-V588 HydrophobicContact CG-CG2 3.68Å; L586-V588 PolarHBondContact O-N 3.2Å; V588-P590 WeakPolarHBondContact O-CD 3.25Å; V588-P713 HydrophobicContact CG1-CB 4.43Å; V588-P713 HydrophobicContact CG2-CG 4.18Å
589	D	84.7	Confident	87.7	Confident	69 Å²	69	63.2 Å²	63.2	37%	0.369	30%	0.297	S	S	.	.			trans	-75.4	108.1	172.9	-174	20.3	0	0	0	109.6	D448 T451 Q591	D448-D589 HydrophobicContact CB-CB 4.29Å; D448-D589 PolarHBondContact OD2-N 3.04Å; T451-D589 HydrophobicContact CG2-CB 4.09Å; D589-Q591 PolarHBondContact O-N 3.19Å
590	P	80	Confident	88	Confident	60 Å²	60	63.8 Å²	63.8	39%	0.39	30%	0.304	S	S	.	.			trans	-73.9	114.1	173.7	31.8	-29.4	0	0	0	108	V588 D592 Y595	V588-P590 WeakPolarHBondContact O-CD 3.25Å; P590-D592 PolarHBondContact O-N 3.47Å; P590-Y595 HydrophobicContact CG-CD1 4.12Å; P590-Y595 HydrophobicContact CG-CE1 4.44Å; P590-Y595 HydrophobicContact CG-CG 4.3Å
591	Q	81.4	Confident	88.1	Confident	162 Å²	162	66.1 Å²	66.1	76%	0.757	33%	0.325	S	S	*	.			trans	-72.5	62.5	172.2	-63.3	-178.2	-2.1	0	0	110.8	D589	D589-Q591 PolarHBondContact O-N 3.19Å
592	D	86.4	Confident	87.9	Confident	85 Å²	85	67.4 Å²	67.4	46%	0.455	33%	0.331	S	S	.	.			trans	-112.8	123	-179.4	-173.8	13.5	0	0	0	110.6	P590 Y594 Y595 D596	P590-D592 PolarHBondContact O-N 3.47Å; D592-Y594 PolarHBondContact O-N 3.17Å; D592-Y594 PolarHBondContact OD1-N 3.23Å; D592-Y595 PolarHBondContact O-N 2.81Å; D592-Y595 VanDerWaalsContact O-N 3.16Å; D592-D596 PolarHBondContact O-N 3.32Å
593	E	91.1	Very high	87.6	Confident	163 Å²	163	70.5 Å²	70.5	76%	0.762	35%	0.347	S	S	*	.	H	α-helix	trans	-59.6	-32	-178.5	-171.1	-175.3	169.9	0	0	112	R597	E593-R597 WeakPolarHBondContact O-CB 3.1Å; E593-R597 PolarHBondContact O-N 2.83Å
594	Y	90.3	Very high	87.5	Confident	153 Å²	153	75 Å²	75	60%	0.6	37%	0.374	S	S	*	.	H	α-helix	trans	-69.1	-43	178.9	-176.9	-98.8	0	0	0	112.3	D592 R598	D592-Y594 PolarHBondContact O-N 3.17Å; D592-Y594 PolarHBondContact OD1-N 3.23Å; Y594-R598 HydrophobicContact CE1-CG 4.44Å; Y594-R598 WeakPolarHBondContact O-CG 3.35Å; Y594-R598 PolarHBondContact O-N 3.3Å
595	Y	87.1	Confident	87.3	Confident	30 Å²	30	74.9 Å²	74.9	12%	0.118	38%	0.376	C	S	.	.	H	α-helix	trans	-63.8	-48.2	176.1	178	-100.1	0	0	0	110.3	F408 E409 P590 D592 R597 R598 L599	F408-Y595 HydrophobicContact CD1-CE2 4.28Å; F408-Y595 HydrophobicContact CE1-CE2 4.36Å; E409-Y595 HydrophobicContact CB-CE2 4.16Å; E409-Y595 HydrophobicContact CG-CE2 4.44Å; E409-Y595 WeakPolarHBondContact OE2-CD2 3.27Å; E409-Y595 WeakPolarHBondContact OE2-CE2 3.28Å; P590-Y595 HydrophobicContact CG-CD1 4.12Å; P590-Y595 HydrophobicContact CG-CE1 4.44Å; P590-Y595 HydrophobicContact CG-CG 4.3Å; D592-Y595 PolarHBondContact O-N 2.81Å; D592-Y595 VanDerWaalsContact O-N 3.16Å; Y595-R597 VanDerWaalsContact C-N 3.32Å; Y595-R597 PolarHBondContact O-N 3.19Å; Y595-R598 PolarHBondContact O-N 2.91Å; Y595-R598 VanDerWaalsContact O-N 3.11Å; Y595-L599 HydrophobicContact CE1-CD2 4.27Å; Y595-L599 WeakPolarHBondContact O-CB 3.11Å; Y595-L599 PolarHBondContact O-N 2.87Å
596	D	90.1	Very high	86.9	Confident	74 Å²	74	75.5 Å²	75.5	40%	0.396	38%	0.379	S	S	.	.	H	α-helix	trans	-58.7	-41.9	179.1	-72	-15.3	0	0	0	112.5	D592 R598 L599 A600	D592-D596 PolarHBondContact O-N 3.32Å; D596-R598 VanDerWaalsContact C-N 3.33Å; D596-R598 PolarHBondContact O-N 3.07Å; D596-L599 PolarHBondContact O-N 3Å; D596-A600 VanDerWaalsContact O-CB 3.22Å; D596-A600 WeakPolarHBondContact O-CB 3.3Å; D596-A600 PolarHBondContact O-N 3.33Å
597	R	93.3	Very high	86.7	Confident	194 Å²	194	83.7 Å²	83.7	73%	0.732	41%	0.411	S	S	*	.	H	α-helix	trans	-63.7	-39.6	178.3	-174.9	174.3	-178.8	169.2	1	112	E593 Y595 S601	E593-R597 WeakPolarHBondContact O-CB 3.1Å; E593-R597 PolarHBondContact O-N 2.83Å; Y595-R597 VanDerWaalsContact C-N 3.32Å; Y595-R597 PolarHBondContact O-N 3.19Å; R597-S601 WeakPolarHBondContact O-CB 3.44Å; R597-S601 PolarHBondContact O-N 3.3Å
598	R	90.2	Very high	86.5	Confident	106 Å²	106	92 Å²	92	40%	0.4	45%	0.447	S	S	.	.	H	α-helix	trans	-72.2	-44	178.7	-70.2	179.6	68.2	-146.9	-4.4	111.2	F408 E409 Y594 Y595 D596 A600 S601 H602	F408-R598 HydrophobicContact CE1-CB 3.73Å; F408-R598 HydrophobicContact CZ-CB 3.63Å; E409-R598 IonicContact OE1-CZ 2.71Å; E409-R598 IonicContact OE1-NH1 3.31Å; E409-R598 PolarHBondContact OE1-NH1 3.26Å; E409-R598 IonicContact OE1-NH2 3.93Å; E409-R598 PolarHBondContact OE1-NH2 3.08Å; Y594-R598 HydrophobicContact CE1-CG 4.44Å; Y594-R598 WeakPolarHBondContact O-CG 3.35Å; Y594-R598 PolarHBondContact O-N 3.3Å; Y595-R598 PolarHBondContact O-N 2.91Å; Y595-R598 VanDerWaalsContact O-N 3.11Å; D596-R598 VanDerWaalsContact C-N 3.33Å; D596-R598 PolarHBondContact O-N 3.07Å; R598-A600 PolarHBondContact O-N 3.34Å; R598-S601 PolarHBondContact O-N 2.94Å; R598-H602 PolarHBondContact O-N 2.98Å
599	L	88.2	Confident	85.9	Confident	49 Å²	49	95 Å²	95	26%	0.257	46%	0.457	S	S	.	.	H	α-helix	trans	-56.6	-49.2	173.3	176.4	65.9	0	0	0	111.1	F408 Y595 D596 S601 H602 L603	F408-L599 HydrophobicContact CB-CD1 3.6Å; F408-L599 HydrophobicContact CD1-CB 4.08Å; F408-L599 HydrophobicContact CD1-CD1 4.17Å; F408-L599 HydrophobicContact CG-CD1 4.25Å; Y595-L599 HydrophobicContact CE1-CD2 4.27Å; Y595-L599 WeakPolarHBondContact O-CB 3.11Å; Y595-L599 PolarHBondContact O-N 2.87Å; D596-L599 PolarHBondContact O-N 3Å; L599-S601 VanDerWaalsContact C-N 3.34Å; L599-S601 PolarHBondContact O-N 3.41Å; L599-H602 PolarHBondContact O-N 3.48Å; L599-L603 HydrophobicContact CD1-CD1 4.11Å; L599-L603 HydrophobicContact CD1-CG 4.26Å; L599-L603 HydrophobicContact CG-CD1 4.11Å; L599-L603 WeakPolarHBondContact O-CG 3.1Å; L599-L603 PolarHBondContact O-N 3.44Å
600	A	90.2	Very high	84.9	Confident	51 Å²	51	93.3 Å²	93.3	42%	0.421	46%	0.456	S	S	.	.	H	α-helix	trans	-61.7	-41.9	178.1	0	0	0	0	0	111.9	D596 R598 H602 L603 V604	D596-A600 VanDerWaalsContact O-CB 3.22Å; D596-A600 WeakPolarHBondContact O-CB 3.3Å; D596-A600 PolarHBondContact O-N 3.33Å; R598-A600 PolarHBondContact O-N 3.34Å; A600-H602 VanDerWaalsContact C-N 3.34Å; A600-H602 PolarHBondContact O-N 3.45Å; A600-L603 PolarHBondContact O-N 2.97Å; A600-V604 WeakPolarHBondContact O-CB 3.34Å; A600-V604 WeakPolarHBondContact O-CG2 3.45Å; A600-V604 PolarHBondContact O-N 2.82Å
601	S	90.4	Very high	84.1	Confident	83 Å²	83	96.4 Å²	96.4	58%	0.58	46%	0.46	S	S	*	.	H	α-helix	trans	-62	-40.9	175.8	-171.1	0	0	0	0	112.2	R597 R598 L599 S605	R597-S601 WeakPolarHBondContact O-CB 3.44Å; R597-S601 PolarHBondContact O-N 3.3Å; R598-S601 PolarHBondContact O-N 2.94Å; L599-S601 VanDerWaalsContact C-N 3.34Å; L599-S601 PolarHBondContact O-N 3.41Å; S601-S605 WeakPolarHBondContact O-CB 3.5Å; S601-S605 PolarHBondContact O-N 3.45Å
602	H	84.5	Confident	82.9	Confident	39 Å²	39	96.7 Å²	96.7	18%	0.181	46%	0.462	C	S	.	.	H	α-helix	trans	-67.5	-45.8	178.1	-172.8	67.9	0	0	0	111.8	P405 F408 R598 L599 A600 V604 S605 L606 E614	P405-H602 PolarHBondContact O-NE2 3.38Å; F408-H602 HydrophobicContact CB-CB 4.42Å; F408-H602 HydrophobicContact CD2-CB 3.73Å; F408-H602 AromaticContact CD2-CD2 3.98Å; F408-H602 AromaticContact CD2-CG 3.65Å; F408-H602 HydrophobicContact CE2-CB 4.31Å; F408-H602 HydrophobicContact CG-CB 4.2Å; R598-H602 PolarHBondContact O-N 2.98Å; L599-H602 PolarHBondContact O-N 3.48Å; A600-H602 VanDerWaalsContact C-N 3.34Å; A600-H602 PolarHBondContact O-N 3.45Å; H602-V604 VanDerWaalsContact C-N 3.35Å; H602-V604 PolarHBondContact O-N 3.3Å; H602-S605 PolarHBondContact O-N 3.32Å; H602-S605 PolarHBondContact O-OG 2.85Å; H602-L606 WeakPolarHBondContact O-CG 3.1Å; H602-L606 PolarHBondContact O-N 2.92Å; H602-L606 VanDerWaalsContact O-N 3.15Å; H602-E614 IonicContact CE1-OE2 2.67Å
603	L	85	Confident	81.5	Confident	70 Å²	70	98.7 Å²	98.7	37%	0.366	47%	0.468	S	S	.	.	H	α-helix	trans	-63.2	-43.3	177.7	-68.4	175.2	0	0	0	111.2	L599 A600 S605 L606 Y607	L599-L603 HydrophobicContact CD1-CD1 4.11Å; L599-L603 HydrophobicContact CD1-CG 4.26Å; L599-L603 HydrophobicContact CG-CD1 4.11Å; L599-L603 WeakPolarHBondContact O-CG 3.1Å; L599-L603 PolarHBondContact O-N 3.44Å; A600-L603 PolarHBondContact O-N 2.97Å; L603-S605 VanDerWaalsContact C-N 3.34Å; L603-S605 PolarHBondContact O-N 3.44Å; L603-L606 PolarHBondContact O-N 3.3Å; L603-Y607 WeakPolarHBondContact O-CD2 3.15Å; L603-Y607 PolarHBondContact O-N 3.22Å
604	V	88.9	Confident	79.7	Confident	96 Å²	96	93.4 Å²	93.4	58%	0.582	44%	0.443	S	S	*	.	H	α-helix	trans	-65.8	-36.1	177.6	174.1	0	0	0	0	111.6	A600 H602 Y607 F608	A600-V604 WeakPolarHBondContact O-CB 3.34Å; A600-V604 WeakPolarHBondContact O-CG2 3.45Å; A600-V604 PolarHBondContact O-N 2.82Å; H602-V604 VanDerWaalsContact C-N 3.35Å; H602-V604 PolarHBondContact O-N 3.3Å; V604-Y607 PolarHBondContact O-N 2.89Å; V604-F608 VanDerWaalsContact O-CB 3.24Å; V604-F608 WeakPolarHBondContact O-CB 3.44Å; V604-F608 PolarHBondContact O-N 2.81Å
605	S	85.7	Confident	78	Confident	26 Å²	26	91.1 Å²	91.1	18%	0.182	44%	0.438	C	S	.	.	H	α-helix	trans	-62.9	-43.1	177	68.4	0	0	0	0	111.8	S601 H602 L603 Y607 F608 K609 E614	S601-S605 WeakPolarHBondContact O-CB 3.5Å; S601-S605 PolarHBondContact O-N 3.45Å; H602-S605 PolarHBondContact O-N 3.32Å; H602-S605 PolarHBondContact O-OG 2.85Å; L603-S605 VanDerWaalsContact C-N 3.34Å; L603-S605 PolarHBondContact O-N 3.44Å; S605-Y607 PolarHBondContact O-N 2.97Å; S605-F608 PolarHBondContact O-N 2.91Å; S605-K609 WeakPolarHBondContact O-CB 3.41Å; S605-K609 PolarHBondContact O-N 2.71Å; S605-E614 PolarHBondContact OG-OE1 3.18Å
606	L	80	Confident	76.3	Confident	12 Å²	12	94 Å²	94	6%	0.063	47%	0.468	C	S	.	.	H	α-helix	trans	-60.1	-43.3	176.8	-68.3	170.8	0	0	0	112.4	H602 L603 E614	H602-L606 WeakPolarHBondContact O-CG 3.1Å; H602-L606 PolarHBondContact O-N 2.92Å; H602-L606 VanDerWaalsContact O-N 3.15Å; L603-L606 PolarHBondContact O-N 3.3Å; L606-E614 VanDerWaalsContact CD2-OE2 3.24Å; L606-E614 WeakPolarHBondContact CD2-OE2 2.92Å
607	Y	82.2	Confident	74.7	Confident	187 Å²	187	99 Å²	99	73%	0.733	49%	0.489	S	S	*	.	H	α-helix	trans	-74.3	-30.5	177.8	-76.1	-73.3	0	0	0	113.3	L603 V604 S605	L603-Y607 WeakPolarHBondContact O-CD2 3.15Å; L603-Y607 PolarHBondContact O-N 3.22Å; V604-Y607 PolarHBondContact O-N 2.89Å; S605-Y607 PolarHBondContact O-N 2.97Å
608	F	83.5	Confident	73.2	Confident	182 Å²	182	92.4 Å²	92.4	80%	0.798	47%	0.468	S	S	*	.	H	α-helix	trans	-81.7	-46.5	-175.9	-176.1	-96.9	0	0	0	113.2	V604 S605 G610	V604-F608 VanDerWaalsContact O-CB 3.24Å; V604-F608 WeakPolarHBondContact O-CB 3.44Å; V604-F608 PolarHBondContact O-N 2.81Å; S605-F608 PolarHBondContact O-N 2.91Å; F608-G610 VanDerWaalsContact C-N 3.26Å; F608-G610 PolarHBondContact O-N 3Å
609	K	71.7	Confident	72	Confident	105 Å²	105	88.5 Å²	88.5	46%	0.457	46%	0.456	S	S	.	.	H	α-helix	trans	-76.3	-16.3	-178.4	-69.8	-179	171.5	-175.9	0	113	S605 E613	S605-K609 WeakPolarHBondContact O-CB 3.41Å; S605-K609 PolarHBondContact O-N 2.71Å; K609-E613 HydrophobicContact CB-CB 4.49Å; K609-E613 HydrophobicContact CD-CB 4.48Å; K609-E613 WeakPolarHBondContact CD-OE2 3.45Å
610	G	63.6	Low	71.4	Confident	33 Å²	33	90.7 Å²	90.7	34%	0.34	47%	0.468	S	S	.	.			trans	70.6	159.7	-159.3	0	0	0	0	0	110.2	F608 E612	F608-G610 VanDerWaalsContact C-N 3.26Å; F608-G610 PolarHBondContact O-N 3Å; G610-E612 PolarHBondContact O-N 2.64Å; G610-E612 VanDerWaalsContact O-N 3.12Å
611	Y	61.7	Low	70.8	Confident	125 Å²	125	92.4 Å²	92.4	49%	0.49	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.5	-176.1	-76.8	-85.5	0	0	0	113.5	E613 E615	Y611-E613 PolarHBondContact O-N 2.66Å; Y611-E615 WeakPolarHBondContact O-CG 3.44Å
612	E	57.8	Low	70.4	Confident	167 Å²	167	90.5 Å²	90.5	78%	0.78	46%	0.455	S	S	*	.	H	α-helix	trans	-73.3	-29.2	-164.2	-61.5	178	175.6	0	0	114.9	G610	G610-E612 PolarHBondContact O-N 2.64Å; G610-E612 VanDerWaalsContact O-N 3.12Å
613	E	55.8	Low	70.5	Confident	127 Å²	127	89.7 Å²	89.7	59%	0.593	45%	0.452	S	S	*	.	H	α-helix	trans	-80.7	-34.4	-175.2	-72.1	-171.9	170	0	0	114	K609 Y611	K609-E613 HydrophobicContact CB-CB 4.49Å; K609-E613 HydrophobicContact CD-CB 4.48Å; K609-E613 WeakPolarHBondContact CD-OE2 3.45Å; Y611-E613 PolarHBondContact O-N 2.66Å
614	E	54.2	Low	70.6	Confident	52 Å²	52	86.4 Å²	86.4	24%	0.243	44%	0.435	C	S	.	.	H	α-helix	trans	-79.9	-26	177.7	-69.7	-176.8	-173.8	0	0	111.5	H602 S605 L606 A616 E617 L618	H602-E614 IonicContact CE1-OE2 2.67Å; S605-E614 PolarHBondContact OG-OE1 3.18Å; L606-E614 VanDerWaalsContact CD2-OE2 3.24Å; L606-E614 WeakPolarHBondContact CD2-OE2 2.92Å; E614-A616 VanDerWaalsContact C-N 3.27Å; E614-A616 PolarHBondContact O-N 3.18Å; E614-E617 PolarHBondContact O-N 2.86Å; E614-L618 WeakPolarHBondContact O-CD1 3.1Å; E614-L618 WeakPolarHBondContact O-CG 3.45Å
615	E	54.5	Low	70.4	Confident	106 Å²	106	85.3 Å²	85.3	50%	0.495	42%	0.422	S	S	.	.	H	α-helix	trans	-66.4	-24.5	175.4	-76.9	-179.8	179.9	0	0	113.4	Y611 E617 L618	Y611-E615 WeakPolarHBondContact O-CG 3.44Å; E615-E617 PolarHBondContact O-N 2.93Å; E615-L618 PolarHBondContact O-N 2.8Å
616	A	51.8	Low	70.3	Confident	89 Å²	89	85.7 Å²	85.7	74%	0.736	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-23.9	-179.8	0	0	0	0	0	113.8	E614	E614-A616 VanDerWaalsContact C-N 3.27Å; E614-A616 PolarHBondContact O-N 3.18Å
617	E	55.1	Low	70.7	Confident	181 Å²	181	85.1 Å²	85.1	85%	0.846	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93	-11.9	173.5	-66.5	-171.4	172	0	0	113	E614 E615	E614-E617 PolarHBondContact O-N 2.86Å; E615-E617 PolarHBondContact O-N 2.93Å
618	L	62.7	Low	71	Confident	55 Å²	55	76.7 Å²	76.7	29%	0.288	39%	0.386	S	S	.	.	S	Bend	trans	-97.8	154.1	-173.5	-65.9	165.6	0	0	0	111.4	P405 E614 E615 D620	P405-L618 HydrophobicContact CB-CD1 3.93Å; E614-L618 WeakPolarHBondContact O-CD1 3.1Å; E614-L618 WeakPolarHBondContact O-CG 3.45Å; E615-L618 PolarHBondContact O-N 2.8Å; L618-D620 PolarHBondContact O-N 2.85Å
619	V	63.8	Low	71.1	Confident	24 Å²	24	69.3 Å²	69.3	15%	0.145	36%	0.359	C	S	.	.	P	Polyproline II helix	trans	-67.7	128.7	176.1	178.4	0	0	0	0	108.5	L389 R398 A402 M621 L623	L389-V619 HydrophobicContact CD1-CG1 4.32Å; R398-V619 HydrophobicContact CG-CG2 3.96Å; A402-V619 HydrophobicContact CB-CB 4.22Å; V619-M621 PolarHBondContact O-N 2.77Å; V619-L623 HydrophobicContact CG1-CB 4.25Å; V619-L623 HydrophobicContact CG1-CD2 4.18Å; V619-L623 HydrophobicContact CG1-CG 4.28Å
620	D	76.9	Confident	71.8	Confident	95 Å²	95	65 Å²	65	51%	0.508	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-52.2	131.9	174.5	-178.8	1	0	0	0	110.6	L618 S622 L623 L624	L618-D620 PolarHBondContact O-N 2.85Å; D620-S622 PolarHBondContact O-N 3.36Å; D620-S622 PolarHBondContact OD1-N 2.86Å; D620-S622 PolarHBondContact OD1-OG 3.3Å; D620-S622 PolarHBondContact OD2-OG 3.07Å; D620-L623 HydrophobicContact CB-CB 4.28Å; D620-L623 WeakPolarHBondContact O-CB 3.29Å; D620-L623 PolarHBondContact O-N 2.96Å; D620-L624 PolarHBondContact O-N 2.98Å
621	M	77.4	Confident	73	Confident	86 Å²	86	63.4 Å²	63.4	42%	0.424	32%	0.324	S	S	.	.	H	α-helix	trans	-56.4	-33.8	178.4	-169	-168.4	60.9	0	0	111.2	L463 V619 L623 L624 K625	L463-M621 HydrophobicContact CD1-CG 3.76Å; L463-M621 HydrophobicContact CD1-SD 4.37Å; V619-M621 PolarHBondContact O-N 2.77Å; M621-L623 VanDerWaalsContact C-N 3.35Å; M621-L624 PolarHBondContact O-N 2.81Å; M621-K625 WeakPolarHBondContact O-CG 3.45Å; M621-K625 PolarHBondContact O-N 2.96Å; M621-K625 VanDerWaalsContact O-N 3.07Å
622	S	82.3	Confident	74.1	Confident	44 Å²	44	61.3 Å²	61.3	31%	0.308	32%	0.317	S	S	.	.	H	α-helix	trans	-61.8	-45.1	176	78.6	0	0	0	0	111.1	R382 D620 L624 K625 D626	R382-S622 PolarHBondContact NH2-O 2.96Å; R382-S622 PolarHBondContact NH2-OG 2.79Å; D620-S622 PolarHBondContact O-N 3.36Å; D620-S622 PolarHBondContact OD1-N 2.86Å; D620-S622 PolarHBondContact OD1-OG 3.3Å; D620-S622 PolarHBondContact OD2-OG 3.07Å; S622-L624 VanDerWaalsContact C-N 3.34Å; S622-L624 PolarHBondContact O-N 2.94Å; S622-K625 PolarHBondContact O-N 2.82Å; S622-D626 VanDerWaalsContact O-CG 3.31Å; S622-D626 PolarHBondContact O-N 2.83Å; S622-D626 VanDerWaalsContact O-N 3.1Å
623	L	86.1	Confident	75.3	Confident	21 Å²	21	56.1 Å²	56.1	11%	0.11	30%	0.303	C	S	.	.	H	α-helix	trans	-68	-36.6	-179.4	-177.1	58.7	0	0	0	111.1	Q385 I386 L389 V619 D620 M621 D626 Y627	Q385-L623 HydrophobicContact CB-CD1 4.17Å; I386-L623 HydrophobicContact CG1-CD1 3.97Å; L389-L623 HydrophobicContact CD1-CD2 3.45Å; L389-L623 VanDerWaalsContact CD1-CD2 3.45Å; L389-L623 HydrophobicContact CD1-CG 3.9Å; V619-L623 HydrophobicContact CG1-CB 4.25Å; V619-L623 HydrophobicContact CG1-CD2 4.18Å; V619-L623 HydrophobicContact CG1-CG 4.28Å; D620-L623 HydrophobicContact CB-CB 4.28Å; D620-L623 WeakPolarHBondContact O-CB 3.29Å; D620-L623 PolarHBondContact O-N 2.96Å; M621-L623 VanDerWaalsContact C-N 3.35Å; L623-D626 PolarHBondContact O-N 2.95Å; L623-Y627 WeakPolarHBondContact O-CB 3.35Å; L623-Y627 PolarHBondContact O-N 2.87Å
624	L	86.6	Confident	76.6	Confident	2 Å²	2	53.5 Å²	53.5	1%	0.01	30%	0.296	C	S	.	.	H	α-helix	trans	-62.3	-42.8	173.7	-180	64.6	0	0	0	112.1	L399 L463 D620 M621 S622 Y627 I628	L399-L624 HydrophobicContact CD2-CD1 3.73Å; L463-L624 HydrophobicContact CD1-CD2 4.02Å; L463-L624 HydrophobicContact CD1-CG 4.5Å; L463-L624 HydrophobicContact CD2-CD2 4.17Å; D620-L624 PolarHBondContact O-N 2.98Å; M621-L624 PolarHBondContact O-N 2.81Å; S622-L624 VanDerWaalsContact C-N 3.34Å; S622-L624 PolarHBondContact O-N 2.94Å; L624-Y627 WeakPolarHBondContact O-CB 3.49Å; L624-Y627 PolarHBondContact O-N 3.29Å; L624-I628 HydrophobicContact CD1-CD1 4.23Å; L624-I628 HydrophobicContact CG-CD1 4.1Å; L624-I628 WeakPolarHBondContact O-CD1 3.44Å; L624-I628 VanDerWaalsContact O-CG1 3.3Å; L624-I628 WeakPolarHBondContact O-CG1 3.28Å; L624-I628 PolarHBondContact O-N 2.87Å
625	K	84.1	Confident	78	Confident	73 Å²	73	51.5 Å²	51.5	32%	0.317	29%	0.288	S	S	.	.	H	α-helix	trans	-61.9	-47.4	177.4	-71.6	-178.9	-174.6	-159.3	0	111.2	R462 L463 M621 S622 Y627 I628 A629	R462-K625 PolarHBondContact O-NZ 2.87Å; L463-K625 HydrophobicContact CD1-CG 3.84Å; L463-K625 WeakPolarHBondContact O-CD 3.41Å; L463-K625 WeakPolarHBondContact O-CE 3.46Å; L463-K625 PolarHBondContact O-NZ 3.35Å; M621-K625 WeakPolarHBondContact O-CG 3.45Å; M621-K625 PolarHBondContact O-N 2.96Å; M621-K625 VanDerWaalsContact O-N 3.07Å; S622-K625 PolarHBondContact O-N 2.82Å; K625-Y627 VanDerWaalsContact C-N 3.32Å; K625-Y627 PolarHBondContact O-N 2.98Å; K625-I628 PolarHBondContact O-N 3.34Å; K625-A629 PolarHBondContact O-N 2.65Å; K625-A629 VanDerWaalsContact O-N 3.09Å
626	D	84.8	Confident	79.6	Confident	33 Å²	33	49.8 Å²	49.8	18%	0.176	29%	0.292	C	S	.	.	H	α-helix	trans	-63.9	-39.9	178.5	-62.4	-21.8	0	0	0	111.4	L378 R382 I386 S622 L623 I628 A629 Y630	L378-D626 HydrophobicContact CD1-CB 4.27Å; L378-D626 HydrophobicContact CD2-CB 4.41Å; R382-D626 HydrophobicContact CG-CB 4.44Å; R382-D626 IonicContact CZ-OD2 3.99Å; R382-D626 VanDerWaalsContact CZ-OD2 3.23Å; R382-D626 IonicContact NE-OD2 2.59Å; R382-D626 PolarHBondContact NE-OD2 2.9Å; R382-D626 IonicContact NH2-OD2 2.89Å; R382-D626 PolarHBondContact NH2-OD2 3.03Å; I386-D626 HydrophobicContact CD1-CB 4.21Å; S622-D626 VanDerWaalsContact O-CG 3.31Å; S622-D626 PolarHBondContact O-N 2.83Å; S622-D626 VanDerWaalsContact O-N 3.1Å; L623-D626 PolarHBondContact O-N 2.95Å; D626-I628 PolarHBondContact O-N 3.28Å; D626-A629 PolarHBondContact O-N 2.9Å; D626-Y630 VanDerWaalsContact O-CB 3.24Å; D626-Y630 WeakPolarHBondContact O-CB 3.14Å; D626-Y630 PolarHBondContact O-N 3.06Å
627	Y	89.2	Confident	81.5	Confident	1 Å²	1	45.7 Å²	45.7	0%	0.004	26%	0.257	C	S	.	.	H	α-helix	trans	-59.1	-47.2	176.2	-169.2	-78.8	0	0	0	112	I386 L389 A390 L399 F422 L623 L624 K625 Y630 A631 I684	I386-Y627 HydrophobicContact CB-CD2 4.15Å; I386-Y627 HydrophobicContact CG1-CD2 4.09Å; I386-Y627 HydrophobicContact CG2-CD2 3.61Å; I386-Y627 HydrophobicContact CG2-CE2 3.79Å; I386-Y627 HydrophobicContact CG2-CG 4.43Å; L389-Y627 HydrophobicContact CB-CE2 4.47Å; A390-Y627 HydrophobicContact CB-CE2 4.2Å; A390-Y627 WeakPolarHBondContact CB-OH 3.45Å; L399-Y627 HydrophobicContact CD1-CD1 4.38Å; L399-Y627 HydrophobicContact CD1-CE1 4.04Å; F422-Y627 AromaticContact CE1-CD1 3.74Å; F422-Y627 HydrophobicContact CE1-CD1 3.74Å; F422-Y627 AromaticContact CE1-CE1 3.68Å; F422-Y627 HydrophobicContact CE1-CE1 3.68Å; F422-Y627 AromaticContact CZ-CD1 3.55Å; F422-Y627 HydrophobicContact CZ-CD1 3.55Å; F422-Y627 AromaticContact CZ-CE1 3.57Å; F422-Y627 HydrophobicContact CZ-CE1 3.57Å; L623-Y627 WeakPolarHBondContact O-CB 3.35Å; L623-Y627 PolarHBondContact O-N 2.87Å; L624-Y627 WeakPolarHBondContact O-CB 3.49Å; L624-Y627 PolarHBondContact O-N 3.29Å; K625-Y627 VanDerWaalsContact C-N 3.32Å; K625-Y627 PolarHBondContact O-N 2.98Å; Y627-Y630 PolarHBondContact O-N 2.89Å; Y627-A631 VanDerWaalsContact O-CB 3.27Å; Y627-A631 WeakPolarHBondContact O-CB 3.19Å; Y627-A631 PolarHBondContact O-N 2.9Å; Y627-I684 PolarHBondContact OH-O 3.2Å
628	I	88.2	Confident	83.2	Confident	9 Å²	9	41.7 Å²	41.7	5%	0.046	25%	0.245	C	C	.	.	H	α-helix	trans	-63.7	-44	179.1	-66.9	162.1	0	0	0	110.5	L421 F422 L463 L624 K625 D626 K632	L421-I628 HydrophobicContact CB-CD1 4.2Å; L421-I628 HydrophobicContact CD1-CD1 3.98Å; F422-I628 HydrophobicContact CE1-CG1 4.41Å; F422-I628 HydrophobicContact CE2-CG1 4.24Å; F422-I628 HydrophobicContact CZ-CG1 4Å; L463-I628 HydrophobicContact CD2-CD1 4.34Å; L624-I628 HydrophobicContact CD1-CD1 4.23Å; L624-I628 HydrophobicContact CG-CD1 4.1Å; L624-I628 WeakPolarHBondContact O-CD1 3.44Å; L624-I628 VanDerWaalsContact O-CG1 3.3Å; L624-I628 WeakPolarHBondContact O-CG1 3.28Å; L624-I628 PolarHBondContact O-N 2.87Å; K625-I628 PolarHBondContact O-N 3.34Å; D626-I628 PolarHBondContact O-N 3.28Å; I628-K632 HydrophobicContact CG2-CD 4.49Å; I628-K632 WeakPolarHBondContact O-CG 3.32Å; I628-K632 PolarHBondContact O-N 2.97Å; I628-K632 VanDerWaalsContact O-N 3.11Å
629	A	84.1	Confident	84.6	Confident	28 Å²	28	41.3 Å²	41.3	23%	0.231	24%	0.243	C	C	.	.	H	α-helix	trans	-65.8	-44.9	179.5	0	0	0	0	0	111.8	W377 K625 D626 K632 A633	W377-A629 HydrophobicContact CH2-CB 3.54Å; W377-A629 HydrophobicContact CZ2-CB 3.58Å; K625-A629 PolarHBondContact O-N 2.65Å; K625-A629 VanDerWaalsContact O-N 3.09Å; D626-A629 PolarHBondContact O-N 2.9Å; A629-K632 PolarHBondContact O-N 3.3Å; A629-A633 PolarHBondContact O-N 3.29Å; A629-A633 VanDerWaalsContact O-N 3.13Å
630	Y	87.6	Confident	86	Confident	13 Å²	13	41.9 Å²	41.9	5%	0.051	25%	0.248	C	C	.	.	H	α-helix	trans	-60.2	-48.8	176.1	-178.2	-98.9	0	0	0	111.8	I375 L378 I383 I386 R387 D626 Y627 K632 A633 V634 L686	I375-Y630 HydrophobicContact CD1-CE2 4.37Å; I375-Y630 HydrophobicContact CG2-CD2 4Å; I375-Y630 HydrophobicContact CG2-CE2 4.1Å; L378-Y630 HydrophobicContact CD2-CD2 4.26Å; I383-Y630 HydrophobicContact CD1-CE2 4.36Å; I383-Y630 HydrophobicContact CG1-CD2 4.48Å; I383-Y630 HydrophobicContact CG1-CE2 4.11Å; I383-Y630 HydrophobicContact CG2-CE2 4.06Å; I386-Y630 HydrophobicContact CD1-CG 4.3Å; I386-Y630 HydrophobicContact CG2-CD1 3.63Å; I386-Y630 HydrophobicContact CG2-CE1 4.06Å; I386-Y630 HydrophobicContact CG2-CG 4.26Å; R387-Y630 PolarHBondContact NH2-OH 3.02Å; D626-Y630 VanDerWaalsContact O-CB 3.24Å; D626-Y630 WeakPolarHBondContact O-CB 3.14Å; D626-Y630 PolarHBondContact O-N 3.06Å; Y627-Y630 PolarHBondContact O-N 2.89Å; Y630-K632 VanDerWaalsContact C-N 3.31Å; Y630-K632 PolarHBondContact O-N 3.37Å; Y630-A633 PolarHBondContact O-N 3.41Å; Y630-A633 VanDerWaalsContact O-N 3.17Å; Y630-V634 HydrophobicContact CD2-CG2 4Å; Y630-V634 HydrophobicContact CE1-CB 4.48Å; Y630-V634 HydrophobicContact CE1-CG2 4.21Å; Y630-V634 HydrophobicContact CE2-CG2 3.66Å; Y630-V634 HydrophobicContact CG-CG2 4.41Å; Y630-V634 PolarHBondContact O-N 3.36Å; Y630-L686 HydrophobicContact CD1-CD1 4.29Å; Y630-L686 HydrophobicContact CD1-CD2 4.19Å; Y630-L686 HydrophobicContact CE1-CD1 4.06Å; Y630-L686 HydrophobicContact CE1-CD2 4.41Å
631	A	89	Confident	86.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.1	-38	-179.7	0	0	0	0	0	112.6	F422 Y627 C635 L686	F422-A631 HydrophobicContact CD1-CB 3.58Å; F422-A631 HydrophobicContact CE1-CB 3.4Å; F422-A631 VanDerWaalsContact CE1-CB 3.4Å; Y627-A631 VanDerWaalsContact O-CB 3.27Å; Y627-A631 WeakPolarHBondContact O-CB 3.19Å; Y627-A631 PolarHBondContact O-N 2.9Å; A631-C635 WeakPolarHBondContact O-CB 3.41Å; A631-C635 PolarHBondContact O-N 3.42Å; A631-C635 VanDerWaalsContact O-N 3.09Å; A631-L686 HydrophobicContact CB-CD2 3.58Å
632	K	85.1	Confident	87.7	Confident	81 Å²	81	42.3 Å²	42.3	35%	0.352	25%	0.253	S	S	.	.	H	α-helix	trans	-66.6	-35.3	175.4	-80.3	-176.1	174.5	173.5	0	113.4	L421 F422 I628 A629 Y630	L421-K632 WeakPolarHBondContact O-CE 3.34Å; L421-K632 PolarHBondContact O-NZ 3.27Å; F422-K632 VanDerWaalsContact O-CE 3.29Å; F422-K632 WeakPolarHBondContact O-CE 3.45Å; I628-K632 HydrophobicContact CG2-CD 4.49Å; I628-K632 WeakPolarHBondContact O-CG 3.32Å; I628-K632 PolarHBondContact O-N 2.97Å; I628-K632 VanDerWaalsContact O-N 3.11Å; A629-K632 PolarHBondContact O-N 3.3Å; Y630-K632 VanDerWaalsContact C-N 3.31Å; Y630-K632 PolarHBondContact O-N 3.37Å
633	A	82	Confident	88.3	Confident	59 Å²	59	40.2 Å²	40.2	49%	0.488	24%	0.238	S	C	.	.	H	α-helix	trans	-77.7	-44.5	-178.2	0	0	0	0	0	112.5	A629 Y630	A629-A633 PolarHBondContact O-N 3.29Å; A629-A633 VanDerWaalsContact O-N 3.13Å; Y630-A633 PolarHBondContact O-N 3.41Å; Y630-A633 VanDerWaalsContact O-N 3.17Å
634	V	83.9	Confident	88.7	Confident	72 Å²	72	40.6 Å²	40.6	44%	0.436	24%	0.244	S	C	.	.	H	α-helix	trans	-90.6	-37.6	-170.5	-179.2	0	0	0	0	112.7	I375 Y630	I375-V634 HydrophobicContact CD1-CG2 3.5Å; I375-V634 HydrophobicContact CG1-CG2 4.48Å; Y630-V634 HydrophobicContact CD2-CG2 4Å; Y630-V634 HydrophobicContact CE1-CB 4.48Å; Y630-V634 HydrophobicContact CE1-CG2 4.21Å; Y630-V634 HydrophobicContact CE2-CG2 3.66Å; Y630-V634 HydrophobicContact CG-CG2 4.41Å; Y630-V634 PolarHBondContact O-N 3.36Å
635	C	83.4	Confident	89.1	Confident	10 Å²	10	45.5 Å²	45.5	7%	0.068	27%	0.271	C	S	.	.			trans	-99.4	112.2	-164.9	-163.6	0	0	0	0	112.3	A631 K683 C687	A631-C635 WeakPolarHBondContact O-CB 3.41Å; A631-C635 PolarHBondContact O-N 3.42Å; A631-C635 VanDerWaalsContact O-N 3.09Å; C635-K683 HydrophobicContact CB-CG 4.27Å; C635-K683 WeakPolarHBondContact O-CE 3.48Å; C635-C687 PolarHBondContact SG-O 2.99Å
636	A	86.9	Confident	89.6	Confident	70 Å²	70	43 Å²	43	58%	0.579	26%	0.261	S	S	*	.			trans	-119.3	84.8	170.1	0	0	0	0	0	110.3	T425	T425-A636 HydrophobicContact CG2-CB 4.36Å
637	P	91.7	Very high	90	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.013	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-63.3	135.8	-177.6	21.7	-34.7	0	0	0	114.3	T425 E679 A682 K683 S688 V690	T425-P637 HydrophobicContact CG2-CG 3.62Å; P637-E679 HydrophobicContact CG-CB 4.08Å; P637-E679 HydrophobicContact CG-CG 4.4Å; P637-E679 WeakPolarHBondContact CG-O 3.49Å; P637-A682 HydrophobicContact CB-CB 3.77Å; P637-A682 HydrophobicContact CG-CB 4.09Å; P637-K683 HydrophobicContact CG-CG 3.8Å; P637-S688 CarbonylContact C-O 3.41Å; P637-S688 VanDerWaalsContact CA-O 3.25Å; P637-S688 WeakPolarHBondContact CA-O 3.48Å; P637-V690 HydrophobicContact CB-CG2 3.9Å
638	V	91.3	Very high	90.3	Very high	97 Å²	97	46.3 Å²	46.3	59%	0.588	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102	141.9	172.9	-178	0	0	0	0	109.8	S640 S688 T689 V690	V638-S640 PolarHBondContact O-N 3.45Å; V638-S688 PolarHBondContact N-O 2.9Å; V638-T689 CarbonylContact O-C 3.43Å; V638-T689 VanDerWaalsContact O-CA 3.32Å; V638-T689 WeakPolarHBondContact O-CA 3.4Å; V638-V690 PolarHBondContact O-N 3.43Å
639	L	91.5	Very high	90.5	Very high	47 Å²	47	51.6 Å²	51.6	25%	0.246	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	130.8	177.8	-73.4	93.3	0	0	0	111.3	L647 I675 V690	L639-L647 HydrophobicContact CD2-CD1 3.56Å; L639-I675 HydrophobicContact CD1-CG2 4.24Å; L639-I675 HydrophobicContact CD2-CG1 4.46Å; L639-I675 HydrophobicContact CD2-CG2 4.39Å; L639-V690 HydrophobicContact CG-CG2 4.46Å
640	S	94.4	Very high	90.8	Very high	36 Å²	36	52 Å²	52	25%	0.252	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-77	156.3	167.4	68.3	0	0	0	0	111.4	V638 A642 A643 A644 V690	V638-S640 PolarHBondContact O-N 3.45Å; S640-A642 PolarHBondContact O-N 2.86Å; S640-A643 PolarHBondContact O-N 2.97Å; S640-A643 VanDerWaalsContact OG-CB 3.24Å; S640-A643 WeakPolarHBondContact OG-CB 3.47Å; S640-A643 PolarHBondContact OG-N 3.07Å; S640-A643 VanDerWaalsContact OG-N 3.14Å; S640-A644 WeakPolarHBondContact O-CB 3.42Å; S640-A644 PolarHBondContact O-N 3.23Å; S640-V690 VanDerWaalsContact CB-O 3.27Å; S640-V690 WeakPolarHBondContact CB-O 3.28Å; S640-V690 PolarHBondContact OG-O 3.37Å
641	Q	94.2	Very high	90.9	Very high	152 Å²	152	52.9 Å²	52.9	71%	0.71	30%	0.302	S	S	*	.	H	α-helix	trans	-60.8	-36.1	176.6	-137.6	68.8	18.2	0	0	112.3	A644 N645	Q641-A644 PolarHBondContact O-N 3.13Å; Q641-N645 PolarHBondContact O-N 3.28Å; Q641-N645 VanDerWaalsContact O-N 3.1Å; Q641-N645 PolarHBondContact O-ND2 2.78Å
642	A	94.8	Very high	90.9	Very high	39 Å²	39	55.8 Å²	55.8	32%	0.322	32%	0.319	S	S	.	.	H	α-helix	trans	-62.7	-52.7	177.2	0	0	0	0	0	110.7	S640 A644 N645 N646 E692	S640-A642 PolarHBondContact O-N 2.86Å; A642-A644 VanDerWaalsContact C-N 3.33Å; A642-A644 PolarHBondContact O-N 3.47Å; A642-N645 PolarHBondContact O-N 3.1Å; A642-N646 PolarHBondContact O-N 2.92Å; A642-N646 VanDerWaalsContact O-N 3.08Å; A642-E692 HydrophobicContact CB-CG 3.7Å; A642-E692 VanDerWaalsContact CB-OE1 3.27Å; A642-E692 WeakPolarHBondContact CB-OE1 3Å
643	A	94.8	Very high	90.8	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59.6	-40.2	174.8	0	0	0	0	0	112.6	S640 N645 N646 L647 V690 V695	S640-A643 PolarHBondContact O-N 2.97Å; S640-A643 VanDerWaalsContact OG-CB 3.24Å; S640-A643 WeakPolarHBondContact OG-CB 3.47Å; S640-A643 PolarHBondContact OG-N 3.07Å; S640-A643 VanDerWaalsContact OG-N 3.14Å; A643-N645 PolarHBondContact O-N 3.06Å; A643-N646 PolarHBondContact O-N 3.49Å; A643-L647 WeakPolarHBondContact O-CB 3.24Å; A643-L647 WeakPolarHBondContact O-CG 3.42Å; A643-L647 PolarHBondContact O-N 3.06Å; A643-V690 HydrophobicContact CB-CB 4.49Å; A643-V690 HydrophobicContact CB-CG1 4.15Å; A643-V695 HydrophobicContact CB-CG2 3.86Å
644	A	94.3	Very high	90.8	Very high	29 Å²	29	53.3 Å²	53.3	24%	0.24	30%	0.299	C	S	.	.	H	α-helix	trans	-61.7	-44	177.9	0	0	0	0	0	112.5	S640 Q641 A642 L647 I648	S640-A644 WeakPolarHBondContact O-CB 3.42Å; S640-A644 PolarHBondContact O-N 3.23Å; Q641-A644 PolarHBondContact O-N 3.13Å; A642-A644 VanDerWaalsContact C-N 3.33Å; A642-A644 PolarHBondContact O-N 3.47Å; A644-L647 PolarHBondContact O-N 3.42Å; A644-I648 WeakPolarHBondContact O-CG1 3.19Å; A644-I648 PolarHBondContact O-N 3.48Å; A644-I648 VanDerWaalsContact O-N 3.14Å
645	N	95.5	Very high	90.5	Very high	105 Å²	105	55.9 Å²	55.9	56%	0.561	30%	0.301	S	S	*	.	H	α-helix	trans	-64.5	-40.7	176	-70.5	-26.5	0	0	0	111.7	Q641 A642 A643 I648 H649	Q641-N645 PolarHBondContact O-N 3.28Å; Q641-N645 VanDerWaalsContact O-N 3.1Å; Q641-N645 PolarHBondContact O-ND2 2.78Å; A642-N645 PolarHBondContact O-N 3.1Å; A643-N645 PolarHBondContact O-N 3.06Å; N645-I648 PolarHBondContact O-N 2.85Å; N645-H649 PolarHBondContact O-N 2.78Å
646	N	94.2	Very high	90.4	Very high	21 Å²	21	62.8 Å²	62.8	11%	0.112	33%	0.33	C	S	.	.	H	α-helix	trans	-64.5	-43.9	177.5	-161.7	-10.7	0	0	0	111.2	A642 A643 I648 H649 K650 V695	A642-N646 PolarHBondContact O-N 2.92Å; A642-N646 VanDerWaalsContact O-N 3.08Å; A643-N646 PolarHBondContact O-N 3.49Å; N646-I648 VanDerWaalsContact C-N 3.32Å; N646-I648 PolarHBondContact O-N 3.3Å; N646-H649 WeakPolarHBondContact O-CB 3.36Å; N646-H649 PolarHBondContact O-N 2.9Å; N646-H649 VanDerWaalsContact O-N 3.12Å; N646-K650 WeakPolarHBondContact O-CG 3.27Å; N646-K650 PolarHBondContact O-N 3.1Å; N646-K650 WeakPolarHBondContact OD1-CG 3.48Å; N646-V695 HydrophobicContact CB-CG1 4.3Å
647	L	94.7	Very high	89.4	Confident	5 Å²	5	62.1 Å²	62.1	3%	0.026	33%	0.329	C	S	.	.	H	α-helix	trans	-56.6	-43.9	174.9	-77.7	166.1	0	0	0	112.4	L639 A643 A644 K650 Y651 L671 L674 I675 V695	L639-L647 HydrophobicContact CD2-CD1 3.56Å; A643-L647 WeakPolarHBondContact O-CB 3.24Å; A643-L647 WeakPolarHBondContact O-CG 3.42Å; A643-L647 PolarHBondContact O-N 3.06Å; A644-L647 PolarHBondContact O-N 3.42Å; L647-K650 PolarHBondContact O-N 3.28Å; L647-Y651 VanDerWaalsContact O-CB 3.3Å; L647-Y651 WeakPolarHBondContact O-CB 3.42Å; L647-Y651 PolarHBondContact O-N 2.9Å; L647-L671 HydrophobicContact CB-CD1 4.26Å; L647-L674 HydrophobicContact CD2-CB 3.92Å; L647-I675 HydrophobicContact CD1-CG1 3.91Å; L647-V695 HydrophobicContact CD1-CG2 4.29Å; L647-V695 HydrophobicContact CD2-CB 4.45Å; L647-V695 HydrophobicContact CD2-CG1 3.58Å; L647-V695 HydrophobicContact CD2-CG2 4.12Å; L647-V695 HydrophobicContact CG-CB 4.46Å; L647-V695 HydrophobicContact CG-CG1 3.73Å; L647-V695 HydrophobicContact CG-CG2 3.83Å
648	I	94.1	Very high	87.8	Confident	97 Å²	97	64 Å²	64	50%	0.497	34%	0.339	S	S	.	.	H	α-helix	trans	-62.5	-46.8	176.3	-65.6	164.3	0	0	0	110.3	A644 N645 N646 K650 Y651 V652	A644-I648 WeakPolarHBondContact O-CG1 3.19Å; A644-I648 PolarHBondContact O-N 3.48Å; A644-I648 VanDerWaalsContact O-N 3.14Å; N645-I648 PolarHBondContact O-N 2.85Å; N646-I648 VanDerWaalsContact C-N 3.32Å; N646-I648 PolarHBondContact O-N 3.3Å; I648-K650 PolarHBondContact O-N 3.03Å; I648-Y651 PolarHBondContact O-N 2.83Å; I648-V652 HydrophobicContact CG2-CG2 4.49Å; I648-V652 VanDerWaalsContact O-CG2 3.31Å; I648-V652 WeakPolarHBondContact O-CG2 3.47Å; I648-V652 PolarHBondContact O-N 2.83Å
649	H	93.1	Very high	86.1	Confident	120 Å²	120	64.7 Å²	64.7	56%	0.556	35%	0.348	S	S	*	.	H	α-helix	trans	-59.2	-47.4	178.6	-177.2	-86.2	0	0	0	111.5	N645 N646 Y651 V652 E653	N645-H649 PolarHBondContact O-N 2.78Å; N646-H649 WeakPolarHBondContact O-CB 3.36Å; N646-H649 PolarHBondContact O-N 2.9Å; N646-H649 VanDerWaalsContact O-N 3.12Å; H649-Y651 PolarHBondContact O-N 2.9Å; H649-V652 PolarHBondContact O-N 3.45Å; H649-E653 IonicContact CE1-OE2 3.84Å; H649-E653 WeakPolarHBondContact O-CB 3.15Å; H649-E653 PolarHBondContact O-N 3.5Å
650	K	90	Very high	84.3	Confident	37 Å²	37	64 Å²	64	16%	0.161	35%	0.347	C	S	.	.	H	α-helix	trans	-64.7	-37.9	178.3	-67.3	-56.5	179.1	-174.7	0	113.4	N646 L647 I648 E653 M654 Y699	N646-K650 WeakPolarHBondContact O-CG 3.27Å; N646-K650 PolarHBondContact O-N 3.1Å; N646-K650 WeakPolarHBondContact OD1-CG 3.48Å; L647-K650 PolarHBondContact O-N 3.28Å; I648-K650 PolarHBondContact O-N 3.03Å; K650-E653 WeakPolarHBondContact CD-OE2 3.43Å; K650-E653 IonicContact NZ-OE2 2.75Å; K650-E653 PolarHBondContact NZ-OE2 3Å; K650-E653 VanDerWaalsContact NZ-OE2 3.1Å; K650-E653 PolarHBondContact O-N 2.92Å; K650-M654 WeakPolarHBondContact O-CB 3.32Å; K650-M654 PolarHBondContact O-N 3.06Å; K650-Y699 HydrophobicContact CB-CD2 3.77Å; K650-Y699 HydrophobicContact CB-CE2 3.98Å; K650-Y699 HydrophobicContact CB-CG 4.23Å; K650-Y699 HydrophobicContact CD-CD1 3.74Å; K650-Y699 HydrophobicContact CD-CD2 4.14Å; K650-Y699 HydrophobicContact CD-CE1 3.83Å; K650-Y699 HydrophobicContact CD-CE2 4.23Å; K650-Y699 HydrophobicContact CD-CG 3.89Å; K650-Y699 HydrophobicContact CG-CD1 4.43Å; K650-Y699 HydrophobicContact CG-CD2 4.16Å; K650-Y699 HydrophobicContact CG-CG 4.09Å
651	Y	89.3	Confident	82	Confident	32 Å²	32	73.3 Å²	73.3	13%	0.125	38%	0.377	C	S	.	.	H	α-helix	trans	-65.4	-41.6	174	173.8	-106.2	0	0	0	112.5	L647 I648 H649 M654 R655 P668 L671	L647-Y651 VanDerWaalsContact O-CB 3.3Å; L647-Y651 WeakPolarHBondContact O-CB 3.42Å; L647-Y651 PolarHBondContact O-N 2.9Å; I648-Y651 PolarHBondContact O-N 2.83Å; H649-Y651 PolarHBondContact O-N 2.9Å; Y651-M654 HydrophobicContact CD2-CE 3.54Å; Y651-M654 HydrophobicContact CE2-CE 4.07Å; Y651-M654 PolarHBondContact O-N 3.32Å; Y651-R655 PolarHBondContact O-N 3.44Å; Y651-R655 PolarHBondContact OH-NE 2.85Å; Y651-R655 PolarHBondContact OH-NH2 3.35Å; Y651-P668 WeakPolarHBondContact OH-CA 3.43Å; Y651-L671 HydrophobicContact CD2-CB 3.87Å; Y651-L671 HydrophobicContact CE2-CB 4.17Å; Y651-L671 HydrophobicContact CG-CB 4.33Å; Y651-L671 HydrophobicContact CG-CD1 4.38Å
652	V	88.7	Confident	79.9	Confident	60 Å²	60	69.7 Å²	69.7	36%	0.364	38%	0.38	S	S	.	.	H	α-helix	trans	-66.9	-39.6	175.4	172.9	0	0	0	0	111.1	I648 H649 R655 K656	I648-V652 HydrophobicContact CG2-CG2 4.49Å; I648-V652 VanDerWaalsContact O-CG2 3.31Å; I648-V652 WeakPolarHBondContact O-CG2 3.47Å; I648-V652 PolarHBondContact O-N 2.83Å; H649-V652 PolarHBondContact O-N 3.45Å; V652-R655 PolarHBondContact O-N 3.35Å; V652-K656 HydrophobicContact CG1-CD 4.21Å; V652-K656 WeakPolarHBondContact O-CG 3.29Å; V652-K656 PolarHBondContact O-N 3.13Å
653	E	85	Confident	78.1	Confident	77 Å²	77	70.7 Å²	70.7	36%	0.36	38%	0.378	S	S	.	.	H	α-helix	trans	-58.6	-47.6	174.2	-172.2	-180	172.2	0	0	111.1	H649 K650 R655 K656 G657	H649-E653 IonicContact CE1-OE2 3.84Å; H649-E653 WeakPolarHBondContact O-CB 3.15Å; H649-E653 PolarHBondContact O-N 3.5Å; K650-E653 WeakPolarHBondContact CD-OE2 3.43Å; K650-E653 IonicContact NZ-OE2 2.75Å; K650-E653 PolarHBondContact NZ-OE2 3Å; K650-E653 VanDerWaalsContact NZ-OE2 3.1Å; K650-E653 PolarHBondContact O-N 2.92Å; E653-R655 PolarHBondContact O-N 3.37Å; E653-K656 PolarHBondContact O-N 2.95Å; E653-G657 PolarHBondContact O-N 3.36Å; E653-G657 VanDerWaalsContact O-N 3.15Å
654	M	80	Confident	76.4	Confident	12 Å²	12	73 Å²	73	6%	0.059	39%	0.39	C	S	.	.	H	α-helix	trans	-59.1	-47.4	176.3	-177.2	177.3	58.6	0	0	112.3	K650 Y651 K656 G657 D658 A666 Q670 Y702	K650-M654 WeakPolarHBondContact O-CB 3.32Å; K650-M654 PolarHBondContact O-N 3.06Å; Y651-M654 HydrophobicContact CD2-CE 3.54Å; Y651-M654 HydrophobicContact CE2-CE 4.07Å; Y651-M654 PolarHBondContact O-N 3.32Å; M654-K656 VanDerWaalsContact C-N 3.32Å; M654-K656 PolarHBondContact O-N 3.06Å; M654-G657 PolarHBondContact O-N 2.75Å; M654-D658 PolarHBondContact O-N 3Å; M654-A666 HydrophobicContact CE-CB 4.01Å; M654-A666 HydrophobicContact CG-CB 3.89Å; M654-A666 HydrophobicContact SD-CB 4.29Å; M654-Q670 HydrophobicContact CE-CB 3.74Å; M654-Q670 HydrophobicContact SD-CB 4.38Å; M654-Q670 PolarHBondContact SD-OE1 3.02Å; M654-Y702 HydrophobicContact SD-CD1 4.27Å; M654-Y702 HydrophobicContact SD-CE1 3.31Å; M654-Y702 WeakPolarHBondContact SD-CE1 3.5Å
655	R	79.5	Confident	74.9	Confident	125 Å²	125	74.6 Å²	74.6	47%	0.472	40%	0.4	S	S	.	.	H	α-helix	trans	-63.3	-33.3	176.6	-89	-163.2	174.2	-161.6	4.6	114.1	Y651 V652 E653 G657 A666	Y651-R655 PolarHBondContact O-N 3.44Å; Y651-R655 PolarHBondContact OH-NE 2.85Å; Y651-R655 PolarHBondContact OH-NH2 3.35Å; V652-R655 PolarHBondContact O-N 3.35Å; E653-R655 PolarHBondContact O-N 3.37Å; R655-G657 VanDerWaalsContact C-N 3.34Å; R655-A666 HydrophobicContact CG-CB 3.84Å; R655-A666 PolarHBondContact NE-O 3.23Å
656	K	79.6	Confident	73.7	Confident	156 Å²	156	70.1 Å²	70.1	68%	0.678	38%	0.377	S	S	*	.	H	α-helix	trans	-69.2	-34.2	176.9	-75.3	173.6	179.9	175.1	0	111.6	V652 E653 M654	V652-K656 HydrophobicContact CG1-CD 4.21Å; V652-K656 WeakPolarHBondContact O-CG 3.29Å; V652-K656 PolarHBondContact O-N 3.13Å; E653-K656 PolarHBondContact O-N 2.95Å; M654-K656 VanDerWaalsContact C-N 3.32Å; M654-K656 PolarHBondContact O-N 3.06Å
657	G	65.8	Low	72.9	Confident	55 Å²	55	74.5 Å²	74.5	57%	0.567	39%	0.393	S	S	*	.	H	α-helix	trans	-65.6	-33.3	178.5	0	0	0	0	0	114.2	E653 M654 R655 S659	E653-G657 PolarHBondContact O-N 3.36Å; E653-G657 VanDerWaalsContact O-N 3.15Å; M654-G657 PolarHBondContact O-N 2.75Å; R655-G657 VanDerWaalsContact C-N 3.34Å; G657-S659 VanDerWaalsContact C-N 3.31Å; G657-S659 PolarHBondContact O-N 3.2Å
658	D	59	Low	72.4	Confident	42 Å²	42	78 Å²	78	23%	0.225	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	14.3	-171.2	-81.7	-14.4	0	0	0	115.9	M654 S660 A666	M654-D658 PolarHBondContact O-N 3Å; D658-S660 PolarHBondContact O-N 3.34Å; D658-A666 VanDerWaalsContact OD2-CB 3.28Å; D658-A666 WeakPolarHBondContact OD2-CB 3.36Å; D658-A666 PolarHBondContact OD2-N 2.84Å
659	S	55	Low	72	Confident	111 Å²	111	76.4 Å²	76.4	78%	0.776	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-4.9	-179.8	-61.8	0	0	0	0	113.7	G657	G657-S659 VanDerWaalsContact C-N 3.31Å; G657-S659 PolarHBondContact O-N 3.2Å
660	S	53.5	Low	71.7	Confident	32 Å²	32	71.7 Å²	71.7	22%	0.224	38%	0.381	C	S	.	.	S	Bend	trans	-84.4	133.4	175	39	0	0	0	0	112.2	D658 G662 H663	D658-S660 PolarHBondContact O-N 3.34Å; S660-G662 PolarHBondContact O-N 3.33Å; S660-H663 PolarHBondContact OG-CD2 3.28Å; S660-H663 VanDerWaalsContact OG-CD2 3.31Å
661	R	47.3	Very low	71.7	Confident	232 Å²	232	72.1 Å²	72.1	88%	0.875	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	128.7	178.6	-83.4	-179.9	156.9	160.6	-5.4	111.5
662	G	49.2	Very low	71.7	Confident	76 Å²	76	74.8 Å²	74.8	78%	0.784	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.7	-10.7	166.3	0	0	0	0	0	115.9	S660	S660-G662 PolarHBondContact O-N 3.33Å
663	H	57.3	Low	71.8	Confident	61 Å²	61	72.1 Å²	72.1	28%	0.282	38%	0.383	S	S	.	.	S	Bend	trans	-90.9	158.4	178.3	-57.2	-71.7	0	0	0	112.5	S660 S665	S660-H663 PolarHBondContact OG-CD2 3.28Å; S660-H663 VanDerWaalsContact OG-CD2 3.31Å; H663-S665 PolarHBondContact O-N 3.43Å
664	I	59.1	Low	72.1	Confident	49 Å²	49	68.6 Å²	68.6	25%	0.251	37%	0.367	S	S	.	.			trans	-64.4	103.5	176.2	-58.8	172.4	0	0	0	108	A666 V709	I664-A666 PolarHBondContact O-N 3.3Å; I664-V709 HydrophobicContact CD1-CG1 3.88Å
665	S	62.9	Low	72.8	Confident	62 Å²	62	70.2 Å²	70.2	43%	0.434	38%	0.375	S	S	.	.			trans	-59.6	135	-179.1	-55.8	0	0	0	0	111.9	H663 Y667	H663-S665 PolarHBondContact O-N 3.43Å; S665-Y667 WeakPolarHBondContact O-CD2 3.44Å; S665-Y667 VanDerWaalsContact O-CE2 3.27Å; S665-Y667 WeakPolarHBondContact O-CE2 3.36Å; S665-Y667 PolarHBondContact O-N 3.39Å
666	A	69.5	Low	73.4	Confident	10 Å²	10	64.9 Å²	64.9	8%	0.083	36%	0.355	C	S	.	.			trans	-64.1	104.9	178.3	0	0	0	0	0	114.8	M654 R655 D658 I664	M654-A666 HydrophobicContact CE-CB 4.01Å; M654-A666 HydrophobicContact CG-CB 3.89Å; M654-A666 HydrophobicContact SD-CB 4.29Å; R655-A666 HydrophobicContact CG-CB 3.84Å; R655-A666 PolarHBondContact NE-O 3.23Å; D658-A666 VanDerWaalsContact OD2-CB 3.28Å; D658-A666 WeakPolarHBondContact OD2-CB 3.36Å; D658-A666 PolarHBondContact OD2-N 2.84Å; I664-A666 PolarHBondContact O-N 3.3Å
667	Y	78.7	Confident	74.1	Confident	114 Å²	114	57.5 Å²	57.5	45%	0.447	32%	0.323	S	S	.	.			trans	-86.1	153.6	176	-59.4	-67.9	0	0	0	112	S665 R669 Q670	S665-Y667 WeakPolarHBondContact O-CD2 3.44Å; S665-Y667 VanDerWaalsContact O-CE2 3.27Å; S665-Y667 WeakPolarHBondContact O-CE2 3.36Å; S665-Y667 PolarHBondContact O-N 3.39Å; Y667-R669 PolarHBondContact O-N 2.91Å; Y667-Q670 WeakPolarHBondContact O-CB 3.42Å; Y667-Q670 PolarHBondContact O-N 3.13Å
668	P	84	Confident	75.5	Confident	78 Å²	78	54.9 Å²	54.9	51%	0.506	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.4	-30.5	175.1	-26.7	35	0	0	0	114.4	Y651 Q670 L671	Y651-P668 WeakPolarHBondContact OH-CA 3.43Å; P668-Q670 PolarHBondContact O-N 3.43Å; P668-Q670 VanDerWaalsContact O-N 3.17Å; P668-L671 VanDerWaalsContact O-CB 3.31Å; P668-L671 WeakPolarHBondContact O-CB 3.45Å; P668-L671 PolarHBondContact O-N 3.3Å
669	R	85.2	Confident	77.1	Confident	63 Å²	63	53.1 Å²	53.1	24%	0.238	29%	0.286	C	S	.	.	H	α-helix	trans	-56.2	-30.8	176.8	-173.9	178.4	-76.5	155.2	-2	113.4	E529 S579 Y667 L671 E672 S673	E529-R669 IonicContact OE1-CZ 3.06Å; E529-R669 IonicContact OE1-NE 3.35Å; E529-R669 IonicContact OE1-NH2 3.35Å; E529-R669 PolarHBondContact OE1-NH2 3.34Å; E529-R669 IonicContact OE2-CZ 3.39Å; E529-R669 VanDerWaalsContact OE2-CZ 3.29Å; E529-R669 IonicContact OE2-NE 3.17Å; E529-R669 IonicContact OE2-NH1 2.8Å; E529-R669 IonicContact OE2-NH2 3.58Å; E529-R669 PolarHBondContact OE2-NH2 3.38Å; S579-R669 WeakPolarHBondContact O-CD 3.35Å; S579-R669 PolarHBondContact O-NH1 3.34Å; S579-R669 PolarHBondContact OG-NH1 2.83Å; Y667-R669 PolarHBondContact O-N 2.91Å; R669-L671 PolarHBondContact O-N 2.95Å; R669-E672 WeakPolarHBondContact O-CB 3.26Å; R669-E672 PolarHBondContact O-N 3.31Å; R669-S673 PolarHBondContact O-N 2.87Å; R669-S673 PolarHBondContact O-OG 3.06Å
670	Q	86.6	Confident	79	Confident	21 Å²	21	47.9 Å²	47.9	10%	0.098	25%	0.249	C	C	.	.	H	α-helix	trans	-66.2	-28.5	177.9	-64.3	169.9	-18.1	0	0	112.4	M654 Y667 P668 E672 S673 L674 Y702	M654-Q670 HydrophobicContact CE-CB 3.74Å; M654-Q670 HydrophobicContact SD-CB 4.38Å; M654-Q670 PolarHBondContact SD-OE1 3.02Å; Y667-Q670 WeakPolarHBondContact O-CB 3.42Å; Y667-Q670 PolarHBondContact O-N 3.13Å; P668-Q670 PolarHBondContact O-N 3.43Å; P668-Q670 VanDerWaalsContact O-N 3.17Å; Q670-E672 VanDerWaalsContact C-N 3.33Å; Q670-S673 WeakPolarHBondContact O-CB 3.45Å; Q670-S673 PolarHBondContact O-N 2.95Å; Q670-L674 WeakPolarHBondContact O-CG 3.16Å; Q670-L674 PolarHBondContact O-N 2.94Å; Q670-Y702 VanDerWaalsContact CG-OH 3.26Å; Q670-Y702 WeakPolarHBondContact CG-OH 3.32Å; Q670-Y702 PolarHBondContact NE2-OH 3.3Å; Q670-Y702 PolarHBondContact OE1-OH 2.77Å
671	L	90.6	Very high	80.9	Confident	47 Å²	47	48.1 Å²	48.1	25%	0.246	25%	0.246	C	C	.	.	H	α-helix	trans	-65	-40.5	171.9	178.7	62.8	0	0	0	110.5	L647 Y651 P668 R669 S673 L674 I675	L647-L671 HydrophobicContact CB-CD1 4.26Å; Y651-L671 HydrophobicContact CD2-CB 3.87Å; Y651-L671 HydrophobicContact CE2-CB 4.17Å; Y651-L671 HydrophobicContact CG-CB 4.33Å; Y651-L671 HydrophobicContact CG-CD1 4.38Å; P668-L671 VanDerWaalsContact O-CB 3.31Å; P668-L671 WeakPolarHBondContact O-CB 3.45Å; P668-L671 PolarHBondContact O-N 3.3Å; R669-L671 PolarHBondContact O-N 2.95Å; L671-S673 VanDerWaalsContact C-N 3.34Å; L671-L674 PolarHBondContact O-N 3.21Å; L671-I675 HydrophobicContact CG-CD1 4.19Å; L671-I675 VanDerWaalsContact O-CG1 3.27Å; L671-I675 WeakPolarHBondContact O-CG1 3.47Å; L671-I675 PolarHBondContact O-N 3.44Å
672	E	88.8	Confident	83.1	Confident	87 Å²	87	37.1 Å²	37.1	41%	0.407	20%	0.204	S	C	.	.	H	α-helix	trans	-63.1	-41.9	173.9	-57.1	178.6	-172.7	0	0	111.4	R669 Q670 I675 R676	R669-E672 WeakPolarHBondContact O-CB 3.26Å; R669-E672 PolarHBondContact O-N 3.31Å; Q670-E672 VanDerWaalsContact C-N 3.33Å; E672-I675 PolarHBondContact O-N 2.99Å; E672-R676 WeakPolarHBondContact O-CG 3.47Å; E672-R676 PolarHBondContact O-N 3.36Å; E672-R676 IonicContact OE2-CZ 3.46Å; E672-R676 IonicContact OE2-NH2 2.67Å; E672-R676 PolarHBondContact OE2-NH2 2.91Å
673	S	90.6	Very high	85.2	Confident	5 Å²	5	34.1 Å²	34.1	4%	0.035	17%	0.169	C	C	.	.	H	α-helix	trans	-59	-46.4	174.5	-54.3	0	0	0	0	111.6	D582 R669 Q670 L671 I675 R676 L677	D582-S673 VanDerWaalsContact OD1-CB 3.3Å; D582-S673 WeakPolarHBondContact OD1-CB 3.37Å; D582-S673 PolarHBondContact OD1-OG 3.16Å; R669-S673 PolarHBondContact O-N 2.87Å; R669-S673 PolarHBondContact O-OG 3.06Å; Q670-S673 WeakPolarHBondContact O-CB 3.45Å; Q670-S673 PolarHBondContact O-N 2.95Å; L671-S673 VanDerWaalsContact C-N 3.34Å; S673-I675 VanDerWaalsContact C-N 3.33Å; S673-I675 PolarHBondContact O-N 3.14Å; S673-R676 PolarHBondContact O-N 2.9Å; S673-L677 VanDerWaalsContact O-CG 3.26Å; S673-L677 WeakPolarHBondContact O-CG 3.26Å; S673-L677 PolarHBondContact O-N 3.01Å
674	L	92.7	Very high	86.8	Confident	2 Å²	2	31.2 Å²	31.2	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-62.1	-38.7	176.2	-73.7	172.2	0	0	0	112.3	L647 Q670 L671 L677 S678 Y699 Y702	L647-L674 HydrophobicContact CD2-CB 3.92Å; Q670-L674 WeakPolarHBondContact O-CG 3.16Å; Q670-L674 PolarHBondContact O-N 2.94Å; L671-L674 PolarHBondContact O-N 3.21Å; L674-L677 PolarHBondContact O-N 2.85Å; L674-S678 WeakPolarHBondContact O-CB 3.49Å; L674-S678 PolarHBondContact O-N 3.05Å; L674-S678 PolarHBondContact O-OG 2.95Å; L674-Y699 HydrophobicContact CD2-CD2 4.47Å; L674-Y702 HydrophobicContact CD2-CD1 4.45Å; L674-Y702 HydrophobicContact CD2-CG 4.06Å
675	I	93	Very high	88.4	Confident	46 Å²	46	32.3 Å²	32.3	24%	0.236	16%	0.157	C	C	.	.	H	α-helix	trans	-62	-48.8	174.3	-69.1	162.7	0	0	0	110.3	L639 L647 L671 E672 S673 L677 S678 E679	L639-I675 HydrophobicContact CD1-CG2 4.24Å; L639-I675 HydrophobicContact CD2-CG1 4.46Å; L639-I675 HydrophobicContact CD2-CG2 4.39Å; L647-I675 HydrophobicContact CD1-CG1 3.91Å; L671-I675 HydrophobicContact CG-CD1 4.19Å; L671-I675 VanDerWaalsContact O-CG1 3.27Å; L671-I675 WeakPolarHBondContact O-CG1 3.47Å; L671-I675 PolarHBondContact O-N 3.44Å; E672-I675 PolarHBondContact O-N 2.99Å; S673-I675 VanDerWaalsContact C-N 3.33Å; S673-I675 PolarHBondContact O-N 3.14Å; I675-L677 VanDerWaalsContact C-N 3.35Å; I675-L677 PolarHBondContact O-N 3.11Å; I675-S678 PolarHBondContact O-N 3.08Å; I675-E679 VanDerWaalsContact CG2-OE1 3.28Å; I675-E679 WeakPolarHBondContact CG2-OE1 3.46Å; I675-E679 WeakPolarHBondContact O-CG 3.13Å; I675-E679 PolarHBondContact O-N 2.9Å
676	R	93.3	Very high	89.7	Confident	14 Å²	14	31.4 Å²	31.4	5%	0.053	15%	0.147	C	C	.	.	H	α-helix	trans	-59.6	-43	178.2	-68	169.4	-170.8	136.7	12.9	112.2	R438 I441 D582 E672 S673 E679 A680	R438-R676 PolarHBondContact O-NE 2.85Å; R438-R676 PolarHBondContact O-NH2 2.88Å; I441-R676 HydrophobicContact CG1-CB 4.18Å; D582-R676 IonicContact OD1-NH1 3.93Å; D582-R676 PolarHBondContact OD1-NH1 2.79Å; E672-R676 WeakPolarHBondContact O-CG 3.47Å; E672-R676 PolarHBondContact O-N 3.36Å; E672-R676 IonicContact OE2-CZ 3.46Å; E672-R676 IonicContact OE2-NH2 2.67Å; E672-R676 PolarHBondContact OE2-NH2 2.91Å; S673-R676 PolarHBondContact O-N 2.9Å; R676-E679 PolarHBondContact O-N 2.95Å; R676-A680 WeakPolarHBondContact O-CB 3.44Å; R676-A680 PolarHBondContact O-N 3.41Å
677	L	94.3	Very high	90.7	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66	-42	178.1	-69.1	165.8	0	0	0	111.8	F419 I441 L583 S673 L674 I675 A680 R681 A698	F419-L677 HydrophobicContact CB-CD2 4.14Å; F419-L677 HydrophobicContact CD2-CD2 3.59Å; F419-L677 HydrophobicContact CE2-CD2 4.42Å; F419-L677 HydrophobicContact CG-CD2 4.29Å; I441-L677 HydrophobicContact CD1-CD2 3.87Å; I441-L677 HydrophobicContact CD1-CG 4.47Å; I441-L677 HydrophobicContact CG2-CD2 4.25Å; L583-L677 HydrophobicContact CD1-CD1 4.44Å; L583-L677 HydrophobicContact CD1-CD2 3.77Å; L583-L677 HydrophobicContact CD2-CD1 3.98Å; L583-L677 HydrophobicContact CG-CD1 4.26Å; L583-L677 HydrophobicContact CG-CD2 4.3Å; S673-L677 VanDerWaalsContact O-CG 3.26Å; S673-L677 WeakPolarHBondContact O-CG 3.26Å; S673-L677 PolarHBondContact O-N 3.01Å; L674-L677 PolarHBondContact O-N 2.85Å; I675-L677 VanDerWaalsContact C-N 3.35Å; I675-L677 PolarHBondContact O-N 3.11Å; L677-A680 PolarHBondContact O-N 3.13Å; L677-R681 PolarHBondContact O-N 3.07Å; L677-A698 HydrophobicContact CB-CB 3.83Å
678	S	94.8	Very high	91.3	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.007	16%	0.161	C	C	.	.	H	α-helix	trans	-64.5	-41.4	177.7	-53.9	0	0	0	0	111.5	L674 I675 R681 A682	L674-S678 WeakPolarHBondContact O-CB 3.49Å; L674-S678 PolarHBondContact O-N 3.05Å; L674-S678 PolarHBondContact O-OG 2.95Å; I675-S678 PolarHBondContact O-N 3.08Å; S678-R681 PolarHBondContact O-N 3.35Å; S678-A682 PolarHBondContact O-N 2.83Å; S678-A682 VanDerWaalsContact O-N 3.08Å
679	E	93.8	Very high	91.7	Very high	5 Å²	5	30.9 Å²	30.9	2%	0.023	16%	0.158	C	C	.	.	H	α-helix	trans	-64.4	-42	173.2	-72.1	173.7	-164.7	0	0	112.1	T425 K427 P637 I675 R676 R681 A682 K683 V690	T425-E679 WeakPolarHBondContact CB-OE2 3.32Å; T425-E679 PolarHBondContact N-OE2 3.45Å; T425-E679 VanDerWaalsContact OG1-CD 3.26Å; T425-E679 PolarHBondContact OG1-OE2 2.86Å; K427-E679 WeakPolarHBondContact CE-OE1 3.36Å; K427-E679 IonicContact NZ-OE1 3.98Å; K427-E679 PolarHBondContact NZ-OE1 3.31Å; P637-E679 HydrophobicContact CG-CB 4.08Å; P637-E679 HydrophobicContact CG-CG 4.4Å; P637-E679 WeakPolarHBondContact CG-O 3.49Å; I675-E679 VanDerWaalsContact CG2-OE1 3.28Å; I675-E679 WeakPolarHBondContact CG2-OE1 3.46Å; I675-E679 WeakPolarHBondContact O-CG 3.13Å; I675-E679 PolarHBondContact O-N 2.9Å; R676-E679 PolarHBondContact O-N 2.95Å; E679-R681 VanDerWaalsContact C-N 3.32Å; E679-R681 PolarHBondContact O-N 2.99Å; E679-A682 PolarHBondContact O-N 2.82Å; E679-K683 WeakPolarHBondContact O-CG 3.34Å; E679-K683 PolarHBondContact O-N 3Å; E679-V690 HydrophobicContact CG-CG2 4.14Å
680	A	93.7	Very high	92.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.1	-39.4	177.4	0	0	0	0	0	111.9	F419 I441 R676 L677 K683 I684	F419-A680 HydrophobicContact CB-CB 4.11Å; F419-A680 HydrophobicContact CD1-CB 4.4Å; F419-A680 HydrophobicContact CG-CB 4.4Å; I441-A680 HydrophobicContact CD1-CB 3.91Å; R676-A680 WeakPolarHBondContact O-CB 3.44Å; R676-A680 PolarHBondContact O-N 3.41Å; L677-A680 PolarHBondContact O-N 3.13Å; A680-K683 WeakPolarHBondContact O-CB 3.3Å; A680-K683 PolarHBondContact O-N 3.31Å; A680-I684 WeakPolarHBondContact O-CG1 3.14Å; A680-I684 PolarHBondContact O-N 3.24Å; A680-I684 VanDerWaalsContact O-N 3.12Å
681	R	93.6	Very high	92.5	Very high	38 Å²	38	30.6 Å²	30.6	14%	0.143	16%	0.159	C	C	.	.	H	α-helix	trans	-65.8	-42.1	174.2	-177.1	168	154.6	139	-27.3	112.5	F419 L677 S678 E679 K683 I684 R685 L693 D694 E697	F419-R681 HydrophobicContact CE1-CB 3.8Å; F419-R681 HydrophobicContact CE1-CG 4.27Å; F419-R681 HydrophobicContact CZ-CB 3.97Å; F419-R681 HydrophobicContact CZ-CG 4.38Å; L677-R681 PolarHBondContact O-N 3.07Å; S678-R681 PolarHBondContact O-N 3.35Å; E679-R681 VanDerWaalsContact C-N 3.32Å; E679-R681 PolarHBondContact O-N 2.99Å; R681-K683 VanDerWaalsContact C-N 3.27Å; R681-K683 PolarHBondContact O-N 3.28Å; R681-I684 WeakPolarHBondContact O-CB 3.37Å; R681-I684 PolarHBondContact O-N 3.39Å; R681-I684 VanDerWaalsContact O-N 3.16Å; R681-R685 PolarHBondContact O-N 2.73Å; R681-L693 PolarHBondContact NH2-O 3.2Å; R681-L693 VanDerWaalsContact NH2-O 3.1Å; R681-D694 HydrophobicContact CB-CB 4.34Å; R681-D694 HydrophobicContact CG-CB 4.27Å; R681-D694 WeakPolarHBondContact CG-OD1 3.49Å; R681-D694 IonicContact NE-OD1 2.75Å; R681-D694 PolarHBondContact NE-OD1 2.94Å; R681-E697 IonicContact CZ-OE2 3.04Å; R681-E697 IonicContact NH1-OE1 3.32Å; R681-E697 IonicContact NH1-OE2 3.43Å; R681-E697 PolarHBondContact NH1-OE2 2.91Å; R681-E697 IonicContact NH2-OE2 2.7Å
682	A	93.4	Very high	92.7	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-60	-39.3	174.7	0	0	0	0	0	111.7	P637 S678 E679 I684 R685 L686 C687 V690	P637-A682 HydrophobicContact CB-CB 3.77Å; P637-A682 HydrophobicContact CG-CB 4.09Å; S678-A682 PolarHBondContact O-N 2.83Å; S678-A682 VanDerWaalsContact O-N 3.08Å; E679-A682 PolarHBondContact O-N 2.82Å; A682-I684 PolarHBondContact O-N 2.89Å; A682-R685 PolarHBondContact O-N 2.82Å; A682-L686 PolarHBondContact O-N 3.32Å; A682-C687 PolarHBondContact O-N 3.43Å; A682-V690 HydrophobicContact CB-CG2 4.08Å
683	K	92.7	Very high	92.9	Very high	13 Å²	13	33.6 Å²	33.6	6%	0.057	18%	0.175	C	C	.	.	H	α-helix	trans	-63.4	-36.1	174.2	-72.2	-171	-172.1	173.7	0	113.9	F422 G423 G424 C635 P637 E679 A680 R681 R685 L686	F422-K683 HydrophobicContact CB-CB 4.4Å; F422-K683 HydrophobicContact CD1-CB 4.35Å; G423-K683 WeakPolarHBondContact O-CD 3.49Å; G423-K683 WeakPolarHBondContact O-CE 3.24Å; G423-K683 PolarHBondContact O-NZ 2.91Å; G424-K683 VanDerWaalsContact C-NZ 3.28Å; G424-K683 PolarHBondContact O-NZ 3.42Å; C635-K683 HydrophobicContact CB-CG 4.27Å; C635-K683 WeakPolarHBondContact O-CE 3.48Å; P637-K683 HydrophobicContact CG-CG 3.8Å; E679-K683 WeakPolarHBondContact O-CG 3.34Å; E679-K683 PolarHBondContact O-N 3Å; A680-K683 WeakPolarHBondContact O-CB 3.3Å; A680-K683 PolarHBondContact O-N 3.31Å; R681-K683 VanDerWaalsContact C-N 3.27Å; R681-K683 PolarHBondContact O-N 3.28Å; K683-R685 PolarHBondContact O-N 2.97Å; K683-L686 PolarHBondContact O-N 3.33Å
684	I	92.7	Very high	93.1	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-61.5	-29.8	175.9	-71.8	162	0	0	0	111.5	V395 Y396 L399 L418 F419 F422 Y627 A680 R681 A682 L686	V395-I684 HydrophobicContact CG1-CG2 4.18Å; Y396-I684 HydrophobicContact CD2-CD1 4.36Å; L399-I684 HydrophobicContact CD1-CG2 4.14Å; L418-I684 HydrophobicContact CD2-CD1 3.76Å; L418-I684 HydrophobicContact CD2-CG1 4.36Å; L418-I684 HydrophobicContact CD2-CG2 4.45Å; L418-I684 HydrophobicContact CG-CD1 3.85Å; L418-I684 HydrophobicContact CG-CG1 4.41Å; F419-I684 HydrophobicContact CD1-CD1 3.45Å; F419-I684 VanDerWaalsContact CD1-CD1 3.45Å; F419-I684 HydrophobicContact CE1-CD1 3.58Å; F422-I684 HydrophobicContact CD1-CG1 4.31Å; F422-I684 HydrophobicContact CD2-CD1 3.96Å; F422-I684 HydrophobicContact CD2-CG1 3.35Å; F422-I684 HydrophobicContact CE1-CG1 4.33Å; F422-I684 HydrophobicContact CE2-CD1 4.21Å; F422-I684 HydrophobicContact CE2-CG1 3.44Å; F422-I684 VanDerWaalsContact CE2-CG1 3.44Å; F422-I684 HydrophobicContact CG-CG1 3.84Å; F422-I684 HydrophobicContact CZ-CG1 3.93Å; Y627-I684 PolarHBondContact OH-O 3.2Å; A680-I684 WeakPolarHBondContact O-CG1 3.14Å; A680-I684 PolarHBondContact O-N 3.24Å; A680-I684 VanDerWaalsContact O-N 3.12Å; R681-I684 WeakPolarHBondContact O-CB 3.37Å; R681-I684 PolarHBondContact O-N 3.39Å; R681-I684 VanDerWaalsContact O-N 3.16Å; A682-I684 PolarHBondContact O-N 2.89Å; I684-L686 VanDerWaalsContact C-N 3.34Å
685	R	90.9	Very high	93.2	Very high	72 Å²	72	33.4 Å²	33.4	27%	0.272	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.7	0	176.1	-59.3	-172.3	-64.3	152.1	5.8	113	R681 A682 K683 C687 E691 D694	R681-R685 PolarHBondContact O-N 2.73Å; A682-R685 PolarHBondContact O-N 2.82Å; K683-R685 PolarHBondContact O-N 2.97Å; R685-C687 HydrophobicContact CB-CB 4.49Å; R685-C687 PolarHBondContact O-N 3.3Å; R685-E691 IonicContact CZ-OE2 3.71Å; R685-E691 VanDerWaalsContact CZ-OE2 3.31Å; R685-E691 IonicContact NH1-OE2 2.71Å; R685-E691 PolarHBondContact NH1-OE2 3.44Å; R685-E691 IonicContact NH2-OE2 3.1Å; R685-E691 PolarHBondContact NH2-OE2 3.47Å; R685-D694 IonicContact CZ-OD1 2.66Å; R685-D694 VanDerWaalsContact CZ-OD1 3.22Å; R685-D694 IonicContact CZ-OD2 2.86Å; R685-D694 IonicContact NE-OD1 3.5Å; R685-D694 PolarHBondContact NE-OD1 2.82Å; R685-D694 IonicContact NH2-OD1 2.71Å; R685-D694 PolarHBondContact NH2-OD1 2.83Å; R685-D694 IonicContact NH2-OD2 3.9Å; R685-D694 PolarHBondContact NH2-OD2 3.1Å
686	L	91.1	Very high	93.3	Very high	43 Å²	43	35.8 Å²	35.8	23%	0.225	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	56	29.2	-168.9	-56.1	175	0	0	0	113.3	I386 A390 Y630 A631 A682 K683 I684	I386-L686 HydrophobicContact CG2-CD1 4.02Å; A390-L686 HydrophobicContact CB-CD1 3.56Å; A390-L686 HydrophobicContact CB-CG 4.05Å; Y630-L686 HydrophobicContact CD1-CD1 4.29Å; Y630-L686 HydrophobicContact CD1-CD2 4.19Å; Y630-L686 HydrophobicContact CE1-CD1 4.06Å; Y630-L686 HydrophobicContact CE1-CD2 4.41Å; A631-L686 HydrophobicContact CB-CD2 3.58Å; A682-L686 PolarHBondContact O-N 3.32Å; K683-L686 PolarHBondContact O-N 3.33Å; I684-L686 VanDerWaalsContact C-N 3.34Å
687	C	90.4	Very high	93.2	Very high	35 Å²	35	37.4 Å²	37.4	24%	0.236	19%	0.192	C	C	.	.			trans	-85.2	131.5	178.7	-68	0	0	0	0	111.3	C635 A682 R685 T689	C635-C687 PolarHBondContact SG-O 2.99Å; A682-C687 PolarHBondContact O-N 3.43Å; R685-C687 HydrophobicContact CB-CB 4.49Å; R685-C687 PolarHBondContact O-N 3.3Å; C687-T689 VanDerWaalsContact C-N 3.29Å; C687-T689 PolarHBondContact O-N 3.2Å
688	S	90.5	Very high	93.2	Very high	84 Å²	84	37.4 Å²	37.4	59%	0.587	19%	0.192	S	C	*	.	S	Bend	trans	-78.2	-9.2	176.7	57.6	0	0	0	0	114.1	P637 V638	P637-S688 CarbonylContact C-O 3.41Å; P637-S688 VanDerWaalsContact CA-O 3.25Å; P637-S688 WeakPolarHBondContact CA-O 3.48Å; V638-S688 PolarHBondContact N-O 2.9Å
689	T	94	Very high	93.1	Very high	71 Å²	71	38.4 Å²	38.4	44%	0.436	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	139.2	176.8	56.4	0	0	0	0	110.9	V638 C687	V638-T689 CarbonylContact O-C 3.43Å; V638-T689 VanDerWaalsContact O-CA 3.32Å; V638-T689 WeakPolarHBondContact O-CA 3.4Å; C687-T689 VanDerWaalsContact C-N 3.29Å; C687-T689 PolarHBondContact O-N 3.2Å
690	V	95	Very high	92.9	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	125.4	175.4	-175.2	0	0	0	0	109.7	P637 V638 L639 S640 A643 E679 A682 D694 V695	P637-V690 HydrophobicContact CB-CG2 3.9Å; V638-V690 PolarHBondContact O-N 3.43Å; L639-V690 HydrophobicContact CG-CG2 4.46Å; S640-V690 VanDerWaalsContact CB-O 3.27Å; S640-V690 WeakPolarHBondContact CB-O 3.28Å; S640-V690 PolarHBondContact OG-O 3.37Å; A643-V690 HydrophobicContact CB-CB 4.49Å; A643-V690 HydrophobicContact CB-CG1 4.15Å; E679-V690 HydrophobicContact CG-CG2 4.14Å; A682-V690 HydrophobicContact CB-CG2 4.08Å; V690-D694 HydrophobicContact CG1-CB 4.05Å; V690-V695 HydrophobicContact CG1-CG2 4.41Å
691	E	93.8	Very high	92.8	Very high	79 Å²	79	39.5 Å²	39.5	37%	0.369	20%	0.204	S	C	.	.			trans	-95.6	165.5	178.5	-64.6	-179.9	153.5	0	0	111.9	R685 L693 D694	R685-E691 IonicContact CZ-OE2 3.71Å; R685-E691 VanDerWaalsContact CZ-OE2 3.31Å; R685-E691 IonicContact NH1-OE2 2.71Å; R685-E691 PolarHBondContact NH1-OE2 3.44Å; R685-E691 IonicContact NH2-OE2 3.1Å; R685-E691 PolarHBondContact NH2-OE2 3.47Å; E691-L693 VanDerWaalsContact C-N 3.27Å; E691-L693 PolarHBondContact O-N 2.91Å; E691-D694 PolarHBondContact N-OD2 2.66Å; E691-D694 VanDerWaalsContact N-OD2 3.11Å; E691-D694 WeakPolarHBondContact O-CB 3.36Å; E691-D694 PolarHBondContact O-N 2.86Å
692	E	94.7	Very high	92.6	Very high	95 Å²	95	38.3 Å²	38.3	44%	0.444	20%	0.2	S	C	.	.	H	α-helix	trans	-61.6	-35.9	176.8	-65.9	-174.4	153.6	0	0	112.3	A642 D694 V695 E696	A642-E692 HydrophobicContact CB-CG 3.7Å; A642-E692 VanDerWaalsContact CB-OE1 3.27Å; A642-E692 WeakPolarHBondContact CB-OE1 3Å; E692-D694 PolarHBondContact O-N 3.22Å; E692-V695 WeakPolarHBondContact O-CB 3.24Å; E692-V695 PolarHBondContact O-N 2.68Å; E692-V695 VanDerWaalsContact O-N 3.15Å; E692-E696 PolarHBondContact O-N 3.06Å; E692-E696 VanDerWaalsContact O-N 3.07Å
693	L	92.7	Very high	92.2	Very high	102 Å²	102	43 Å²	43	53%	0.534	22%	0.217	S	C	.	.	H	α-helix	trans	-63.4	-27.1	177.9	-63.2	175.2	0	0	0	112.9	R681 E691 E697	R681-L693 PolarHBondContact NH2-O 3.2Å; R681-L693 VanDerWaalsContact NH2-O 3.1Å; E691-L693 VanDerWaalsContact C-N 3.27Å; E691-L693 PolarHBondContact O-N 2.91Å; L693-E697 PolarHBondContact O-N 3.13Å
694	D	94.3	Very high	91.7	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-71.7	-39.5	176.6	-62.6	-36.6	0	0	0	111.1	R681 R685 V690 E691 E692 A698	R681-D694 HydrophobicContact CB-CB 4.34Å; R681-D694 HydrophobicContact CG-CB 4.27Å; R681-D694 WeakPolarHBondContact CG-OD1 3.49Å; R681-D694 IonicContact NE-OD1 2.75Å; R681-D694 PolarHBondContact NE-OD1 2.94Å; R685-D694 IonicContact CZ-OD1 2.66Å; R685-D694 VanDerWaalsContact CZ-OD1 3.22Å; R685-D694 IonicContact CZ-OD2 2.86Å; R685-D694 IonicContact NE-OD1 3.5Å; R685-D694 PolarHBondContact NE-OD1 2.82Å; R685-D694 IonicContact NH2-OD1 2.71Å; R685-D694 PolarHBondContact NH2-OD1 2.83Å; R685-D694 IonicContact NH2-OD2 3.9Å; R685-D694 PolarHBondContact NH2-OD2 3.1Å; V690-D694 HydrophobicContact CG1-CB 4.05Å; E691-D694 PolarHBondContact N-OD2 2.66Å; E691-D694 VanDerWaalsContact N-OD2 3.11Å; E691-D694 WeakPolarHBondContact O-CB 3.36Å; E691-D694 PolarHBondContact O-N 2.86Å; E692-D694 PolarHBondContact O-N 3.22Å; D694-A698 VanDerWaalsContact O-CB 3.3Å; D694-A698 WeakPolarHBondContact O-CB 3.44Å; D694-A698 PolarHBondContact O-N 3.3Å
695	V	95.3	Very high	91.1	Very high	2 Å²	2	45 Å²	45	1%	0.012	23%	0.228	C	C	.	.	H	α-helix	trans	-66.3	-41.7	176.9	178	0	0	0	0	110.8	A643 N646 L647 V690 E692 A698 Y699	A643-V695 HydrophobicContact CB-CG2 3.86Å; N646-V695 HydrophobicContact CB-CG1 4.3Å; L647-V695 HydrophobicContact CD1-CG2 4.29Å; L647-V695 HydrophobicContact CD2-CB 4.45Å; L647-V695 HydrophobicContact CD2-CG1 3.58Å; L647-V695 HydrophobicContact CD2-CG2 4.12Å; L647-V695 HydrophobicContact CG-CB 4.46Å; L647-V695 HydrophobicContact CG-CG1 3.73Å; L647-V695 HydrophobicContact CG-CG2 3.83Å; V690-V695 HydrophobicContact CG1-CG2 4.41Å; E692-V695 WeakPolarHBondContact O-CB 3.24Å; E692-V695 PolarHBondContact O-N 2.68Å; E692-V695 VanDerWaalsContact O-N 3.15Å; V695-A698 PolarHBondContact O-N 2.83Å; V695-Y699 WeakPolarHBondContact O-CB 3.46Å; V695-Y699 PolarHBondContact O-N 3.07Å
696	E	94.3	Very high	90.2	Very high	97 Å²	97	43.8 Å²	43.8	45%	0.453	23%	0.226	S	C	.	.	H	α-helix	trans	-63.7	-42.5	180	-72.2	-174.5	170.7	0	0	112.6	E692 S700	E692-E696 PolarHBondContact O-N 3.06Å; E692-E696 VanDerWaalsContact O-N 3.07Å; E696-S700 PolarHBondContact O-N 3.4Å
697	E	91.5	Very high	89.2	Confident	47 Å²	47	46.4 Å²	46.4	22%	0.22	24%	0.235	C	C	.	.	H	α-helix	trans	-67.6	-48.7	174	-174.6	86.9	-170.8	0	0	111.9	Y396 R681 L693 Y699 S700 L701	Y396-E697 HydrophobicContact CE1-CG 4.27Å; Y396-E697 VanDerWaalsContact CE1-OE1 3.31Å; Y396-E697 WeakPolarHBondContact CE1-OE1 3.42Å; Y396-E697 PolarHBondContact OH-OE1 3.27Å; R681-E697 IonicContact CZ-OE2 3.04Å; R681-E697 IonicContact NH1-OE1 3.32Å; R681-E697 IonicContact NH1-OE2 3.43Å; R681-E697 PolarHBondContact NH1-OE2 2.91Å; R681-E697 IonicContact NH2-OE2 2.7Å; L693-E697 PolarHBondContact O-N 3.13Å; E697-Y699 PolarHBondContact O-N 3.26Å; E697-S700 WeakPolarHBondContact O-CA 3.35Å; E697-S700 WeakPolarHBondContact O-CB 3.27Å; E697-S700 PolarHBondContact O-N 3.3Å; E697-L701 PolarHBondContact O-N 3.42Å
698	A	93.1	Very high	87.8	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-55	-39.3	179.7	0	0	0	0	0	110.3	L677 D694 V695 Y702	L677-A698 HydrophobicContact CB-CB 3.83Å; D694-A698 VanDerWaalsContact O-CB 3.3Å; D694-A698 WeakPolarHBondContact O-CB 3.44Å; D694-A698 PolarHBondContact O-N 3.3Å; V695-A698 PolarHBondContact O-N 2.83Å; A698-Y702 WeakPolarHBondContact O-CB 3Å; A698-Y702 PolarHBondContact O-N 2.98Å
699	Y	92.8	Very high	86.3	Confident	22 Å²	22	45.4 Å²	45.4	9%	0.086	22%	0.22	C	C	.	.	H	α-helix	trans	-68.2	-39.2	172.5	-175.4	-102.4	0	0	0	113.3	K650 L674 V695 E697 Y702 R703	K650-Y699 HydrophobicContact CB-CD2 3.77Å; K650-Y699 HydrophobicContact CB-CE2 3.98Å; K650-Y699 HydrophobicContact CB-CG 4.23Å; K650-Y699 HydrophobicContact CD-CD1 3.74Å; K650-Y699 HydrophobicContact CD-CD2 4.14Å; K650-Y699 HydrophobicContact CD-CE1 3.83Å; K650-Y699 HydrophobicContact CD-CE2 4.23Å; K650-Y699 HydrophobicContact CD-CG 3.89Å; K650-Y699 HydrophobicContact CG-CD1 4.43Å; K650-Y699 HydrophobicContact CG-CD2 4.16Å; K650-Y699 HydrophobicContact CG-CG 4.09Å; L674-Y699 HydrophobicContact CD2-CD2 4.47Å; V695-Y699 WeakPolarHBondContact O-CB 3.46Å; V695-Y699 PolarHBondContact O-N 3.07Å; E697-Y699 PolarHBondContact O-N 3.26Å; Y699-Y702 PolarHBondContact O-N 2.62Å; Y699-R703 WeakPolarHBondContact O-CB 3.35Å; Y699-R703 PolarHBondContact O-N 3.14Å
700	S	91.2	Very high	84.5	Confident	29 Å²	29	43.5 Å²	43.5	20%	0.203	21%	0.212	C	C	.	.	H	α-helix	trans	-61.1	-49.8	175.8	-162.4	0	0	0	0	111.4	E696 E697 Y702 R703 E704	E696-S700 PolarHBondContact O-N 3.4Å; E697-S700 WeakPolarHBondContact O-CA 3.35Å; E697-S700 WeakPolarHBondContact O-CB 3.27Å; E697-S700 PolarHBondContact O-N 3.3Å; S700-Y702 VanDerWaalsContact C-N 3.34Å; S700-Y702 PolarHBondContact O-N 3.38Å; S700-R703 CarbonylContact O-C 3.51Å; S700-R703 PolarHBondContact O-N 2.75Å; S700-R703 VanDerWaalsContact O-N 3.14Å; S700-E704 WeakPolarHBondContact O-CG 3.47Å; S700-E704 PolarHBondContact O-N 2.91Å; S700-E704 PolarHBondContact OG-OE1 3.28Å
701	L	90.7	Very high	82.6	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-60.6	-44.4	178.1	-175.7	68.9	0	0	0	111.3	D412 A416 F419 L583 F585 E697 R703 E704 A705	D412-L701 HydrophobicContact CB-CD1 4Å; D412-L701 WeakPolarHBondContact O-CD1 3.47Å; A416-L701 HydrophobicContact CB-CD2 4.03Å; F419-L701 HydrophobicContact CD2-CD2 3.52Å; F419-L701 HydrophobicContact CE2-CD2 3.37Å; F419-L701 HydrophobicContact CZ-CD2 4.44Å; L583-L701 HydrophobicContact CD1-CD2 4.05Å; F585-L701 HydrophobicContact CE1-CD1 4.29Å; F585-L701 HydrophobicContact CZ-CD1 3.99Å; F585-L701 HydrophobicContact CZ-CG 4.23Å; E697-L701 PolarHBondContact O-N 3.42Å; L701-R703 VanDerWaalsContact C-N 3.33Å; L701-R703 PolarHBondContact O-N 3.3Å; L701-E704 PolarHBondContact O-N 3.11Å; L701-A705 PolarHBondContact O-N 3.03Å
702	Y	89.1	Confident	80.5	Confident	13 Å²	13	44.4 Å²	44.4	5%	0.051	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-41	176	-179.2	-92.2	0	0	0	112.1	L583 M654 Q670 L674 A698 Y699 S700 A705 L706	L583-Y702 HydrophobicContact CD2-CD2 3.93Å; M654-Y702 HydrophobicContact SD-CD1 4.27Å; M654-Y702 HydrophobicContact SD-CE1 3.31Å; M654-Y702 WeakPolarHBondContact SD-CE1 3.5Å; Q670-Y702 VanDerWaalsContact CG-OH 3.26Å; Q670-Y702 WeakPolarHBondContact CG-OH 3.32Å; Q670-Y702 PolarHBondContact NE2-OH 3.3Å; Q670-Y702 PolarHBondContact OE1-OH 2.77Å; L674-Y702 HydrophobicContact CD2-CD1 4.45Å; L674-Y702 HydrophobicContact CD2-CG 4.06Å; A698-Y702 WeakPolarHBondContact O-CB 3Å; A698-Y702 PolarHBondContact O-N 2.98Å; Y699-Y702 PolarHBondContact O-N 2.62Å; S700-Y702 VanDerWaalsContact C-N 3.34Å; S700-Y702 PolarHBondContact O-N 3.38Å; Y702-A705 PolarHBondContact O-N 2.79Å; Y702-L706 HydrophobicContact CD1-CD1 3.9Å; Y702-L706 HydrophobicContact CD1-CG 4.38Å; Y702-L706 HydrophobicContact CE1-CD1 3.19Å; Y702-L706 HydrophobicContact CE1-CG 3.88Å; Y702-L706 PolarHBondContact O-N 3.24Å
703	R	84.6	Confident	78.2	Confident	99 Å²	99	42.4 Å²	42.4	37%	0.374	22%	0.216	S	C	.	.	H	α-helix	trans	-69.5	-35.9	177.1	-174.3	-175.8	64.9	178.1	-4.4	111.9	Y699 S700 L701 L706 K707	Y699-R703 WeakPolarHBondContact O-CB 3.35Å; Y699-R703 PolarHBondContact O-N 3.14Å; S700-R703 CarbonylContact O-C 3.51Å; S700-R703 PolarHBondContact O-N 2.75Å; S700-R703 VanDerWaalsContact O-N 3.14Å; L701-R703 VanDerWaalsContact C-N 3.33Å; L701-R703 PolarHBondContact O-N 3.3Å; R703-L706 PolarHBondContact O-N 2.99Å; R703-K707 HydrophobicContact CG-CD 4.23Å; R703-K707 HydrophobicContact CG-CG 4.26Å; R703-K707 VanDerWaalsContact O-CB 3.3Å; R703-K707 WeakPolarHBondContact O-CB 3.38Å; R703-K707 WeakPolarHBondContact O-CG 3.3Å; R703-K707 PolarHBondContact O-N 3.35Å
704	E	82.1	Confident	75.8	Confident	52 Å²	52	44.4 Å²	44.4	24%	0.243	23%	0.226	C	C	.	.	H	α-helix	trans	-63.4	-45.6	174.2	-79	158.4	-169.1	0	0	111	S700 L701 L706 K707 Q708	S700-E704 WeakPolarHBondContact O-CG 3.47Å; S700-E704 PolarHBondContact O-N 2.91Å; S700-E704 PolarHBondContact OG-OE1 3.28Å; L701-E704 PolarHBondContact O-N 3.11Å; E704-L706 VanDerWaalsContact C-N 3.34Å; E704-L706 PolarHBondContact O-N 2.99Å; E704-K707 PolarHBondContact O-N 3.1Å; E704-Q708 WeakPolarHBondContact O-CG 3.38Å; E704-Q708 PolarHBondContact O-N 3.46Å; E704-Q708 VanDerWaalsContact O-N 3.14Å
705	A	80.4	Confident	73.5	Confident	4 Å²	4	48 Å²	48	3%	0.033	25%	0.249	C	C	.	.	H	α-helix	trans	-56.2	-46.5	171.5	0	0	0	0	0	111.8	L583 F585 L701 Y702 V709	L583-A705 HydrophobicContact CD2-CB 4.46Å; F585-A705 HydrophobicContact CD1-CB 4.15Å; F585-A705 HydrophobicContact CE1-CB 3.88Å; F585-A705 HydrophobicContact CZ-CB 4.26Å; L701-A705 PolarHBondContact O-N 3.03Å; Y702-A705 PolarHBondContact O-N 2.79Å; A705-V709 WeakPolarHBondContact O-CG2 3.4Å; A705-V709 PolarHBondContact O-N 2.81Å
706	L	73.6	Confident	71.2	Confident	46 Å²	46	51.2 Å²	51.2	24%	0.241	28%	0.282	C	S	.	.	H	α-helix	trans	-70.5	-33	177.2	-78.5	-177	0	0	0	114.7	Y702 R703 E704 V709 A710	Y702-L706 HydrophobicContact CD1-CD1 3.9Å; Y702-L706 HydrophobicContact CD1-CG 4.38Å; Y702-L706 HydrophobicContact CE1-CD1 3.19Å; Y702-L706 HydrophobicContact CE1-CG 3.88Å; Y702-L706 PolarHBondContact O-N 3.24Å; R703-L706 PolarHBondContact O-N 2.99Å; E704-L706 VanDerWaalsContact C-N 3.34Å; E704-L706 PolarHBondContact O-N 2.99Å; L706-V709 CarbonylContact O-C 3.43Å; L706-V709 WeakPolarHBondContact O-CA 3.17Å; L706-V709 VanDerWaalsContact O-CB 3.29Å; L706-V709 WeakPolarHBondContact O-CB 3.19Å; L706-V709 PolarHBondContact O-N 3.43Å; L706-V709 VanDerWaalsContact O-N 3.12Å; L706-A710 WeakPolarHBondContact O-CB 3.37Å; L706-A710 PolarHBondContact O-N 2.86Å
707	K	68.6	Low	68.7	Low	97 Å²	97	53.2 Å²	53.2	42%	0.422	29%	0.29	S	S	.	.	H	α-helix	trans	-65	-46.3	179.2	-84.6	173.1	177	-178.5	0	110.1	R703 E704 V709 A710 T711	R703-K707 HydrophobicContact CG-CD 4.23Å; R703-K707 HydrophobicContact CG-CG 4.26Å; R703-K707 VanDerWaalsContact O-CB 3.3Å; R703-K707 WeakPolarHBondContact O-CB 3.38Å; R703-K707 WeakPolarHBondContact O-CG 3.3Å; R703-K707 PolarHBondContact O-N 3.35Å; E704-K707 PolarHBondContact O-N 3.1Å; K707-V709 PolarHBondContact O-N 3.32Å; K707-V709 VanDerWaalsContact O-N 3.15Å; K707-A710 CarbonylContact O-C 3.51Å; K707-A710 PolarHBondContact O-N 3.1Å; K707-T711 VanDerWaalsContact O-CG2 3.31Å; K707-T711 WeakPolarHBondContact O-CG2 3.43Å; K707-T711 PolarHBondContact O-N 3.44Å; K707-T711 PolarHBondContact O-OG1 3.23Å
708	Q	62.2	Low	66.4	Low	66 Å²	66	54.2 Å²	54.2	31%	0.308	30%	0.298	S	S	.	.	H	α-helix	trans	-57.9	-28.9	174.4	-66.5	174	-8	0	0	111.5	L586 E704	L586-Q708 HydrophobicContact CB-CB 4.12Å; L586-Q708 WeakPolarHBondContact CD2-O 3.07Å; L586-Q708 PolarHBondContact O-OE1 2.89Å; E704-Q708 WeakPolarHBondContact O-CG 3.38Å; E704-Q708 PolarHBondContact O-N 3.46Å; E704-Q708 VanDerWaalsContact O-N 3.14Å
709	V	59	Low	63.8	Low	32 Å²	32	56.7 Å²	56.7	19%	0.194	31%	0.312	C	S	.	.	H	α-helix	trans	-76.4	-27	175.8	163.1	0	0	0	0	113	I567 I664 A705 L706 K707	I567-V709 HydrophobicContact CD1-CB 3.4Å; I567-V709 VanDerWaalsContact CD1-CB 3.4Å; I567-V709 HydrophobicContact CD1-CG1 3.27Å; I567-V709 HydrophobicContact CD1-CG2 3.5Å; I567-V709 WeakPolarHBondContact CD1-O 3.3Å; I664-V709 HydrophobicContact CD1-CG1 3.88Å; A705-V709 WeakPolarHBondContact O-CG2 3.4Å; A705-V709 PolarHBondContact O-N 2.81Å; L706-V709 CarbonylContact O-C 3.43Å; L706-V709 WeakPolarHBondContact O-CA 3.17Å; L706-V709 VanDerWaalsContact O-CB 3.29Å; L706-V709 WeakPolarHBondContact O-CB 3.19Å; L706-V709 PolarHBondContact O-N 3.43Å; L706-V709 VanDerWaalsContact O-N 3.12Å; K707-V709 PolarHBondContact O-N 3.32Å; K707-V709 VanDerWaalsContact O-N 3.15Å
710	A	55.5	Low	61.3	Low	32 Å²	32	59.1 Å²	59.1	26%	0.264	33%	0.329	S	S	.	.	H	α-helix	trans	-108.2	-4	-171.7	0	0	0	0	0	115.1	L706 K707	L706-A710 WeakPolarHBondContact O-CB 3.37Å; L706-A710 PolarHBondContact O-N 2.86Å; K707-A710 CarbonylContact O-C 3.51Å; K707-A710 PolarHBondContact O-N 3.1Å
711	T	54.8	Low	58.6	Low	42 Å²	42	60.6 Å²	60.6	26%	0.258	34%	0.339	S	S	.	.	B	Isolated β-bridge	trans	-113.2	129.7	-176.7	57.4	0	0	0	0	111.7	K707 P713 V718	K707-T711 VanDerWaalsContact O-CG2 3.31Å; K707-T711 WeakPolarHBondContact O-CG2 3.43Å; K707-T711 PolarHBondContact O-N 3.44Å; K707-T711 PolarHBondContact O-OG1 3.23Å; T711-P713 WeakPolarHBondContact O-CD 3.32Å; T711-V718 HydrophobicContact CG2-CB 4.23Å; T711-V718 HydrophobicContact CG2-CG2 3.68Å
712	D	50.1	Low	56.3	Low	56 Å²	56	63.5 Å²	63.5	30%	0.299	35%	0.354	S	S	.	.			trans	-66.3	121.7	171.1	-91	-8.6	0	0	0	110.8	L714 T715 G716	D712-L714 VanDerWaalsContact C-N 3.32Å; D712-L714 PolarHBondContact O-N 2.77Å; D712-T715 PolarHBondContact O-N 2.82Å; D712-G716 PolarHBondContact O-N 3.38Å
713	P	47.4	Very low	53.8	Low	52 Å²	52	68 Å²	68	34%	0.338	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-30	-174.1	-17.7	26	0	0	0	114.6	Q563 V588 T711	Q563-P713 HydrophobicContact CG-CB 4.43Å; Q563-P713 HydrophobicContact CG-CG 3.92Å; V588-P713 HydrophobicContact CG1-CB 4.43Å; V588-P713 HydrophobicContact CG2-CG 4.18Å; T711-P713 WeakPolarHBondContact O-CD 3.32Å
714	L	40.9	Very low	51.5	Low	144 Å²	144	66 Å²	66	75%	0.754	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-25	-179	-85.4	158.4	0	0	0	113.3	Q563 D712	Q563-L714 VanDerWaalsContact CD-CD1 3.46Å; Q563-L714 VanDerWaalsContact CD-CG 3.47Å; Q563-L714 HydrophobicContact CG-CD1 4.42Å; D712-L714 VanDerWaalsContact C-N 3.32Å; D712-L714 PolarHBondContact O-N 2.77Å
715	T	46.1	Very low	49.4	Very low	76 Å²	76	68.8 Å²	68.8	47%	0.466	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-17.6	-174	67.3	0	0	0	0	113	D712 K717	D712-T715 PolarHBondContact O-N 2.82Å; T715-K717 PolarHBondContact O-N 2.99Å; T715-K717 PolarHBondContact OG1-N 2.99Å
716	G	46.8	Very low	47.4	Very low	70 Å²	70	70.8 Å²	70.8	72%	0.722	42%	0.42	S	S	*	.			trans	57.7	8.2	-172.5	0	0	0	0	0	112.9	D712	D712-G716 PolarHBondContact O-N 3.38Å
717	K	42.3	Very low	46.1	Very low	139 Å²	139	70.2 Å²	70.2	60%	0.604	42%	0.416	S	S	*	.			trans	-93.4	121.1	175	-68.8	176.3	-176.3	175.7	0	104.3	T715 D719	T715-K717 PolarHBondContact O-N 2.99Å; T715-K717 PolarHBondContact OG1-N 2.99Å; K717-D719 PolarHBondContact O-N 3.38Å
718	V	42.9	Very low	45.1	Very low	67 Å²	67	68.5 Å²	68.5	41%	0.406	42%	0.416	S	S	.	.	B	Isolated β-bridge	trans	-40.9	139.4	141.2	-178.3	0	0	0	0	104.8	T711 V720	T711-V718 HydrophobicContact CG2-CB 4.23Å; T711-V718 HydrophobicContact CG2-CG2 3.68Å; V718-V720 HydrophobicContact CB-CG2 4.09Å; V718-V720 HydrophobicContact CG1-CG2 4.46Å; V718-V720 WeakPolarHBondContact O-CG2 3.48Å; V718-V720 PolarHBondContact O-N 2.96Å
719	D	38.9	Very low	44.7	Very low	52 Å²	52	68.1 Å²	68.1	28%	0.278	42%	0.424	S	S	.	.	S	Bend	trans	-67	71.7	174.2	-120.7	-14.1	0	0	0	109.9	K717 S721 I722 L723	K717-D719 PolarHBondContact O-N 3.38Å; D719-S721 PolarHBondContact O-N 3.36Å; D719-S721 WeakPolarHBondContact OD1-CB 3.28Å; D719-S721 PolarHBondContact OD1-OG 3.24Å; D719-I722 WeakPolarHBondContact O-CA 3.23Å; D719-I722 WeakPolarHBondContact O-CB 3.26Å; D719-I722 PolarHBondContact O-N 2.8Å; D719-L723 PolarHBondContact O-N 3.22Å
720	V	39.7	Very low	44.9	Very low	74 Å²	74	69.7 Å²	69.7	45%	0.448	44%	0.441	S	S	.	.	H	α-helix	trans	-68.5	6.7	153	-161.4	0	0	0	0	107.5	V718 I722 L723 A724	V718-V720 HydrophobicContact CB-CG2 4.09Å; V718-V720 HydrophobicContact CG1-CG2 4.46Å; V718-V720 WeakPolarHBondContact O-CG2 3.48Å; V718-V720 PolarHBondContact O-N 2.96Å; V720-I722 VanDerWaalsContact C-N 3.27Å; V720-L723 HydrophobicContact CB-CB 4.19Å; V720-L723 HydrophobicContact CG1-CB 3.76Å; V720-L723 CarbonylContact O-C 3.51Å; V720-A724 HydrophobicContact CG1-CB 4.31Å; V720-A724 WeakPolarHBondContact O-CA 3.48Å; V720-A724 WeakPolarHBondContact O-CB 3.26Å; V720-A724 PolarHBondContact O-N 2.87Å
721	S	35.7	Very low	45.3	Very low	60 Å²	60	70.3 Å²	70.3	42%	0.42	44%	0.441	S	S	.	.	H	α-helix	trans	-70.4	-31.5	153.7	77.4	0	0	0	0	110.1	D719 L725	D719-S721 PolarHBondContact O-N 3.36Å; D719-S721 WeakPolarHBondContact OD1-CB 3.28Å; D719-S721 PolarHBondContact OD1-OG 3.24Å; S721-L725 WeakPolarHBondContact O-CB 3.34Å; S721-L725 VanDerWaalsContact O-CD1 3.25Å; S721-L725 WeakPolarHBondContact O-CD1 3.49Å; S721-L725 WeakPolarHBondContact O-CG 3.47Å; S721-L725 PolarHBondContact O-N 3.03Å
722	I	41.5	Very low	45.8	Very low	60 Å²	60	74.3 Å²	74.3	31%	0.308	45%	0.452	S	S	.	.	H	α-helix	trans	-83.8	-30.5	171.3	-58.6	174.9	0	0	0	111.9	D719 V720 L725 G726	D719-I722 WeakPolarHBondContact O-CA 3.23Å; D719-I722 WeakPolarHBondContact O-CB 3.26Å; D719-I722 PolarHBondContact O-N 2.8Å; V720-I722 VanDerWaalsContact C-N 3.27Å; I722-L725 CarbonylContact O-C 3.58Å; I722-G726 PolarHBondContact O-N 2.91Å
723	L	37.9	Very low	47	Very low	109 Å²	109	79.9 Å²	79.9	57%	0.571	47%	0.468	S	S	*	.	H	α-helix	trans	-83.6	-12.9	167	-74.3	145.9	0	0	0	114.9	D719 V720 G726 M727	D719-L723 PolarHBondContact O-N 3.22Å; V720-L723 HydrophobicContact CB-CB 4.19Å; V720-L723 HydrophobicContact CG1-CB 3.76Å; V720-L723 CarbonylContact O-C 3.51Å; L723-G726 VanDerWaalsContact C-N 3.3Å; L723-G726 CarbonylContact O-C 3.59Å; L723-G726 WeakPolarHBondContact O-CA 3.47Å; L723-G726 PolarHBondContact O-N 3.1Å; L723-M727 PolarHBondContact O-N 3.25Å
724	A	36	Very low	48.3	Very low	55 Å²	55	79.2 Å²	79.2	46%	0.455	47%	0.467	S	S	.	.	H	α-helix	trans	-94.8	-19.2	166.3	0	0	0	0	0	111.9	V720 M727	V720-A724 HydrophobicContact CG1-CB 4.31Å; V720-A724 WeakPolarHBondContact O-CA 3.48Å; V720-A724 WeakPolarHBondContact O-CB 3.26Å; V720-A724 PolarHBondContact O-N 2.87Å; A724-M727 PolarHBondContact O-N 3.22Å
725	L	37.5	Very low	50	Low	112 Å²	112	72.8 Å²	72.8	59%	0.586	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-16.3	150.5	-77.1	156.6	0	0	0	111.2	S721 I722 M727 R732	S721-L725 WeakPolarHBondContact O-CB 3.34Å; S721-L725 VanDerWaalsContact O-CD1 3.25Å; S721-L725 WeakPolarHBondContact O-CD1 3.49Å; S721-L725 WeakPolarHBondContact O-CG 3.47Å; S721-L725 PolarHBondContact O-N 3.03Å; I722-L725 CarbonylContact O-C 3.58Å; L725-M727 VanDerWaalsContact C-N 3.31Å; L725-R732 PolarHBondContact O-NH2 2.72Å
726	G	38.7	Very low	51.7	Low	46 Å²	46	71.5 Å²	71.5	47%	0.474	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	10.3	165.6	0	0	0	0	0	114.8	I722 L723 S728	I722-G726 PolarHBondContact O-N 2.91Å; L723-G726 VanDerWaalsContact C-N 3.3Å; L723-G726 CarbonylContact O-C 3.59Å; L723-G726 WeakPolarHBondContact O-CA 3.47Å; L723-G726 PolarHBondContact O-N 3.1Å; G726-S728 PolarHBondContact O-N 2.79Å
727	M	45.5	Very low	53.4	Low	34 Å²	34	72.6 Å²	72.6	17%	0.167	42%	0.422	C	S	.	.	S	Bend	trans	-55.6	104.7	144.2	-82.8	-158.9	161.2	0	0	105.8	L723 A724 L725 T731 R732 A735 L776	L723-M727 PolarHBondContact O-N 3.25Å; A724-M727 PolarHBondContact O-N 3.22Å; L725-M727 VanDerWaalsContact C-N 3.31Å; M727-T731 HydrophobicContact CE-CG2 4.38Å; M727-T731 HydrophobicContact CG-CG2 4.33Å; M727-R732 HydrophobicContact CB-CB 4.27Å; M727-R732 HydrophobicContact CB-CG 3.86Å; M727-R732 PolarHBondContact O-NE 3.22Å; M727-R732 HydrophobicContact SD-CG 4.14Å; M727-A735 HydrophobicContact CE-CB 4.12Å; M727-A735 HydrophobicContact SD-CB 4.11Å; M727-L776 HydrophobicContact CE-CD1 3.45Å; M727-L776 VanDerWaalsContact CE-CD1 3.45Å
728	S	47	Very low	55.4	Low	60 Å²	60	66.3 Å²	66.3	42%	0.42	40%	0.395	S	S	.	.			trans	-41.4	150.3	169.2	75.6	0	0	0	0	108.1	G726 A730 T731 R732	G726-S728 PolarHBondContact O-N 2.79Å; S728-A730 CarbonylContact O-C 3.56Å; S728-A730 PolarHBondContact O-N 3.25Å; S728-A730 WeakPolarHBondContact OG-CB 3.23Å; S728-A730 PolarHBondContact OG-N 3.1Å; S728-T731 PolarHBondContact N-OG1 3.45Å; S728-T731 WeakPolarHBondContact O-CA 3.4Å; S728-T731 PolarHBondContact O-N 3.34Å; S728-T731 PolarHBondContact O-OG1 3.43Å; S728-T731 PolarHBondContact OG-N 3.25Å; S728-T731 PolarHBondContact OG-OG1 2.95Å; S728-R732 PolarHBondContact O-N 3.26Å
729	A	55.5	Low	57.4	Low	58 Å²	58	67.2 Å²	67.2	48%	0.479	39%	0.391	S	S	.	.	H	α-helix	trans	-49	-25.9	175.1	0	0	0	0	0	111.9	R733	A729-R733 VanDerWaalsContact O-CB 3.29Å; A729-R733 WeakPolarHBondContact O-CB 3.28Å; A729-R733 VanDerWaalsContact O-CD 3.31Å; A729-R733 WeakPolarHBondContact O-CD 3.33Å; A729-R733 WeakPolarHBondContact O-CG 3.4Å; A729-R733 PolarHBondContact O-N 2.81Å; A729-R733 VanDerWaalsContact O-N 3.11Å
730	A	63	Low	59.4	Low	65 Å²	65	70.5 Å²	70.5	54%	0.537	41%	0.405	S	S	.	.	H	α-helix	trans	-72.1	-40.2	170.5	0	0	0	0	0	114.9	S728 A734	S728-A730 CarbonylContact O-C 3.56Å; S728-A730 PolarHBondContact O-N 3.25Å; S728-A730 WeakPolarHBondContact OG-CB 3.23Å; S728-A730 PolarHBondContact OG-N 3.1Å; A730-A734 WeakPolarHBondContact O-CB 3.16Å; A730-A734 PolarHBondContact O-N 3.07Å
731	T	64.1	Low	61.5	Low	45 Å²	45	70.4 Å²	70.4	28%	0.276	40%	0.401	S	S	.	.	H	α-helix	trans	-71.4	-36.5	176.9	-9.3	0	0	0	0	111.9	M727 S728 A734 A735 L776	M727-T731 HydrophobicContact CE-CG2 4.38Å; M727-T731 HydrophobicContact CG-CG2 4.33Å; S728-T731 PolarHBondContact N-OG1 3.45Å; S728-T731 WeakPolarHBondContact O-CA 3.4Å; S728-T731 PolarHBondContact O-N 3.34Å; S728-T731 PolarHBondContact O-OG1 3.43Å; S728-T731 PolarHBondContact OG-N 3.25Å; S728-T731 PolarHBondContact OG-OG1 2.95Å; T731-A734 PolarHBondContact O-N 3.11Å; T731-A735 WeakPolarHBondContact O-CB 3.37Å; T731-A735 PolarHBondContact O-N 3.45Å; T731-L776 HydrophobicContact CG2-CD1 4.23Å
732	R	65.4	Low	63.8	Low	127 Å²	127	67.5 Å²	67.5	48%	0.479	38%	0.381	S	S	.	.	H	α-helix	trans	-66.6	-42.1	173.4	-109.5	-177.4	-77.6	160.7	-10.3	111.7	L725 M727 S728 A735 A736	L725-R732 PolarHBondContact O-NH2 2.72Å; M727-R732 HydrophobicContact CB-CB 4.27Å; M727-R732 HydrophobicContact CB-CG 3.86Å; M727-R732 PolarHBondContact O-NE 3.22Å; M727-R732 HydrophobicContact SD-CG 4.14Å; S728-R732 PolarHBondContact O-N 3.26Å; R732-A735 PolarHBondContact O-N 2.86Å; R732-A736 WeakPolarHBondContact O-CB 3.4Å; R732-A736 PolarHBondContact O-N 3.33Å
733	R	74.1	Confident	65.9	Low	172 Å²	172	66.5 Å²	66.5	65%	0.649	37%	0.374	S	S	*	.	H	α-helix	trans	-62.4	-47.7	171.5	-76	170.7	-167.6	166.8	3.1	111.2	A729 A735 A736 D737	A729-R733 VanDerWaalsContact O-CB 3.29Å; A729-R733 WeakPolarHBondContact O-CB 3.28Å; A729-R733 VanDerWaalsContact O-CD 3.31Å; A729-R733 WeakPolarHBondContact O-CD 3.33Å; A729-R733 WeakPolarHBondContact O-CG 3.4Å; A729-R733 PolarHBondContact O-N 2.81Å; A729-R733 VanDerWaalsContact O-N 3.11Å; R733-A735 VanDerWaalsContact C-N 3.31Å; R733-A735 PolarHBondContact O-N 3.21Å; R733-A736 PolarHBondContact O-N 3.22Å; R733-A736 VanDerWaalsContact O-N 3.13Å; R733-D737 WeakPolarHBondContact O-CB 3.21Å; R733-D737 PolarHBondContact O-N 2.85Å
734	A	75.9	Confident	68	Low	38 Å²	38	66.2 Å²	66.2	31%	0.314	37%	0.373	S	S	.	.	H	α-helix	trans	-61	-38.5	178	0	0	0	0	0	112.6	A730 T731 L738 L776	A730-A734 WeakPolarHBondContact O-CB 3.16Å; A730-A734 PolarHBondContact O-N 3.07Å; T731-A734 PolarHBondContact O-N 3.11Å; A734-L738 WeakPolarHBondContact O-CB 3.16Å; A734-L738 PolarHBondContact O-N 2.78Å; A734-L776 HydrophobicContact CB-CD2 4.33Å
735	A	76.5	Confident	70.2	Confident	9 Å²	9	68.4 Å²	68.4	7%	0.074	37%	0.37	C	S	.	.	H	α-helix	trans	-66.2	-42.2	174.2	0	0	0	0	0	111.9	M727 T731 R732 R733 L738 R739 V780	M727-A735 HydrophobicContact CE-CB 4.12Å; M727-A735 HydrophobicContact SD-CB 4.11Å; T731-A735 WeakPolarHBondContact O-CB 3.37Å; T731-A735 PolarHBondContact O-N 3.45Å; R732-A735 PolarHBondContact O-N 2.86Å; R733-A735 VanDerWaalsContact C-N 3.31Å; R733-A735 PolarHBondContact O-N 3.21Å; A735-L738 PolarHBondContact O-N 3.47Å; A735-R739 WeakPolarHBondContact O-CB 3.47Å; A735-R739 PolarHBondContact O-N 3.25Å; A735-V780 HydrophobicContact CB-CG2 3.87Å
736	A	80.9	Confident	72.1	Confident	50 Å²	50	63.5 Å²	63.5	41%	0.413	34%	0.344	S	S	.	.	H	α-helix	trans	-65.8	-44.3	175.9	0	0	0	0	0	112.6	R732 R733 L738 R739 Q740	R732-A736 WeakPolarHBondContact O-CB 3.4Å; R732-A736 PolarHBondContact O-N 3.33Å; R733-A736 PolarHBondContact O-N 3.22Å; R733-A736 VanDerWaalsContact O-N 3.13Å; A736-L738 VanDerWaalsContact C-N 3.31Å; A736-L738 PolarHBondContact O-N 3.18Å; A736-R739 WeakPolarHBondContact O-CB 3.32Å; A736-R739 PolarHBondContact O-N 3.27Å; A736-Q740 PolarHBondContact O-N 3.44Å
737	D	82.8	Confident	74.1	Confident	92 Å²	92	64.7 Å²	64.7	49%	0.492	34%	0.339	S	S	.	.	H	α-helix	trans	-61.1	-43	175.6	-65.5	-18.9	0	0	0	110.4	R733 Q740 L741	R733-D737 WeakPolarHBondContact O-CB 3.21Å; R733-D737 PolarHBondContact O-N 2.85Å; D737-Q740 PolarHBondContact O-N 2.94Å; D737-L741 WeakPolarHBondContact O-CB 3.45Å; D737-L741 PolarHBondContact O-N 3.26Å
738	L	84.3	Confident	75.8	Confident	8 Å²	8	67.1 Å²	67.1	4%	0.042	37%	0.365	C	S	.	.	H	α-helix	trans	-67.4	-37.8	177.4	-168	134.9	0	0	0	111.9	A734 A735 A736 L741 I742 V772 F777 V780	A734-L738 WeakPolarHBondContact O-CB 3.16Å; A734-L738 PolarHBondContact O-N 2.78Å; A735-L738 PolarHBondContact O-N 3.47Å; A736-L738 VanDerWaalsContact C-N 3.31Å; A736-L738 PolarHBondContact O-N 3.18Å; L738-L741 PolarHBondContact O-N 2.99Å; L738-I742 HydrophobicContact CD2-CD1 3.51Å; L738-I742 HydrophobicContact CD2-CG1 4.32Å; L738-I742 HydrophobicContact CG-CD1 4.36Å; L738-I742 VanDerWaalsContact O-CG1 3.27Å; L738-I742 WeakPolarHBondContact O-CG1 3.32Å; L738-I742 PolarHBondContact O-N 3.08Å; L738-V772 HydrophobicContact CD1-CB 4.31Å; L738-V772 HydrophobicContact CD1-CG1 3.38Å; L738-V772 HydrophobicContact CD1-CG2 3.91Å; L738-F777 HydrophobicContact CD2-CD2 4.11Å; L738-V780 HydrophobicContact CD2-CB 3.55Å; L738-V780 HydrophobicContact CD2-CG1 3.64Å; L738-V780 HydrophobicContact CD2-CG2 3.83Å
739	R	84.1	Confident	77.3	Confident	85 Å²	85	66.8 Å²	66.8	32%	0.321	36%	0.356	S	S	.	.	H	α-helix	trans	-61.6	-43.1	173.4	-174.3	175.4	178.5	176.9	-1.5	111.6	A735 A736 K743 V780 M784 D787	A735-R739 WeakPolarHBondContact O-CB 3.47Å; A735-R739 PolarHBondContact O-N 3.25Å; A736-R739 WeakPolarHBondContact O-CB 3.32Å; A736-R739 PolarHBondContact O-N 3.27Å; R739-K743 WeakPolarHBondContact O-CB 3.02Å; R739-K743 PolarHBondContact O-N 3.38Å; R739-V780 HydrophobicContact CB-CG1 3.93Å; R739-M784 HydrophobicContact CG-CE 4.36Å; R739-M784 HydrophobicContact CG-CG 3.99Å; R739-M784 HydrophobicContact CG-SD 3.92Å; R739-D787 IonicContact CZ-OD2 3.6Å; R739-D787 IonicContact NH1-OD2 3.87Å; R739-D787 PolarHBondContact NH1-OD2 3.33Å; R739-D787 IonicContact NH2-OD2 3Å; R739-D787 PolarHBondContact NH2-OD2 2.9Å
740	Q	82.5	Confident	78.1	Confident	122 Å²	122	72.1 Å²	72.1	57%	0.57	37%	0.371	S	S	*	.	H	α-helix	trans	-66.9	-42.3	175.1	-70.9	-174.8	-8.3	0	0	112.2	A736 D737 I742 K743 N744	A736-Q740 PolarHBondContact O-N 3.44Å; D737-Q740 PolarHBondContact O-N 2.94Å; Q740-I742 PolarHBondContact O-N 3.03Å; Q740-K743 PolarHBondContact O-N 3.48Å; Q740-N744 WeakPolarHBondContact O-CB 3.39Å; Q740-N744 PolarHBondContact O-N 3.23Å; Q740-N744 PolarHBondContact O-ND2 2.98Å
741	L	82.9	Confident	78.1	Confident	71 Å²	71	74.9 Å²	74.9	37%	0.372	38%	0.376	S	S	.	.	H	α-helix	trans	-58.8	-45.6	174.6	-92.9	153.9	0	0	0	112.1	D737 L738 R745	D737-L741 WeakPolarHBondContact O-CB 3.45Å; D737-L741 PolarHBondContact O-N 3.26Å; L738-L741 PolarHBondContact O-N 2.99Å; L741-R745 WeakPolarHBondContact O-CB 2.85Å; L741-R745 VanDerWaalsContact O-CG 3.26Å; L741-R745 WeakPolarHBondContact O-CG 3.46Å; L741-R745 PolarHBondContact O-N 3.47Å
742	I	84.9	Confident	78.3	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-63.8	-46.2	176	-66.1	170.1	0	0	0	110.4	L738 Q740 N744 R745 M746 L760 I764 F777 V780 M784 L790	L738-I742 HydrophobicContact CD2-CD1 3.51Å; L738-I742 HydrophobicContact CD2-CG1 4.32Å; L738-I742 HydrophobicContact CG-CD1 4.36Å; L738-I742 VanDerWaalsContact O-CG1 3.27Å; L738-I742 WeakPolarHBondContact O-CG1 3.32Å; L738-I742 PolarHBondContact O-N 3.08Å; Q740-I742 PolarHBondContact O-N 3.03Å; I742-N744 PolarHBondContact O-N 2.93Å; I742-R745 PolarHBondContact O-N 3.03Å; I742-M746 HydrophobicContact CG2-CG 4.15Å; I742-M746 WeakPolarHBondContact O-CB 3.35Å; I742-M746 VanDerWaalsContact O-CG 3.27Å; I742-M746 WeakPolarHBondContact O-CG 3.19Å; I742-M746 PolarHBondContact O-N 3.1Å; I742-L760 HydrophobicContact CG1-CD2 4.04Å; I742-L760 HydrophobicContact CG2-CD2 4.39Å; I742-I764 HydrophobicContact CG1-CD1 3.75Å; I742-F777 HydrophobicContact CD1-CD2 4.11Å; I742-F777 HydrophobicContact CD1-CE2 3.8Å; I742-F777 HydrophobicContact CG1-CE2 4.21Å; I742-V780 HydrophobicContact CD1-CG1 4.16Å; I742-M784 HydrophobicContact CB-CE 4.36Å; I742-M784 HydrophobicContact CB-SD 3.91Å; I742-M784 HydrophobicContact CD1-SD 4.19Å; I742-M784 HydrophobicContact CG2-CE 3.96Å; I742-M784 HydrophobicContact CG2-SD 3.72Å; I742-L790 HydrophobicContact CG2-CD1 4.12Å
743	K	83.7	Confident	78.9	Confident	38 Å²	38	70.3 Å²	70.3	17%	0.165	37%	0.374	C	S	.	.	H	α-helix	trans	-56.6	-49	177.6	-172.8	-179.8	178.6	-176.4	0	111	R739 Q740 M746 L747 M784 D808	R739-K743 WeakPolarHBondContact O-CB 3.02Å; R739-K743 PolarHBondContact O-N 3.38Å; Q740-K743 PolarHBondContact O-N 3.48Å; K743-M746 PolarHBondContact O-N 3.31Å; K743-L747 HydrophobicContact CG-CD1 4.05Å; K743-L747 WeakPolarHBondContact O-CB 3.26Å; K743-L747 WeakPolarHBondContact O-CD1 3.16Å; K743-L747 WeakPolarHBondContact O-CG 3.46Å; K743-L747 PolarHBondContact O-N 3.02Å; K743-M784 HydrophobicContact CB-CE 4.45Å; K743-D808 IonicContact NZ-OD2 2.83Å; K743-D808 PolarHBondContact NZ-OD2 2.84Å
744	N	83.2	Confident	79.3	Confident	104 Å²	104	67.4 Å²	67.4	56%	0.556	36%	0.363	S	S	*	.	H	α-helix	trans	-65.1	-41.1	-179.8	-68.5	-14.1	0	0	0	112.5	Q740 I742 L747 A748	Q740-N744 WeakPolarHBondContact O-CB 3.39Å; Q740-N744 PolarHBondContact O-N 3.23Å; Q740-N744 PolarHBondContact O-ND2 2.98Å; I742-N744 PolarHBondContact O-N 2.93Å; N744-L747 PolarHBondContact O-N 3.31Å; N744-A748 PolarHBondContact O-N 3.03Å; N744-A748 VanDerWaalsContact O-N 3.15Å
745	R	81.3	Confident	79.6	Confident	101 Å²	101	66.2 Å²	66.2	38%	0.381	35%	0.351	S	S	.	.	H	α-helix	trans	-70.1	-35.3	178.2	-73	-73.7	171	-179.8	-4.1	112.8	L741 I742 A748 S767	L741-R745 WeakPolarHBondContact O-CB 2.85Å; L741-R745 VanDerWaalsContact O-CG 3.26Å; L741-R745 WeakPolarHBondContact O-CG 3.46Å; L741-R745 PolarHBondContact O-N 3.47Å; I742-R745 PolarHBondContact O-N 3.03Å; R745-A748 PolarHBondContact O-N 2.77Å; R745-S767 PolarHBondContact NH2-OG 2.86Å
746	M	78.8	Confident	80	Confident	9 Å²	9	67.8 Å²	67.8	4%	0.044	37%	0.365	C	S	.	.	H	α-helix	trans	-73.6	-30.8	175.3	-71.9	-62.3	-152.3	0	0	112.5	I742 K743 A748 V755 L760 L790 V798 L800	I742-M746 HydrophobicContact CG2-CG 4.15Å; I742-M746 WeakPolarHBondContact O-CB 3.35Å; I742-M746 VanDerWaalsContact O-CG 3.27Å; I742-M746 WeakPolarHBondContact O-CG 3.19Å; I742-M746 PolarHBondContact O-N 3.1Å; K743-M746 PolarHBondContact O-N 3.31Å; M746-A748 VanDerWaalsContact C-N 3.34Å; M746-V755 HydrophobicContact CE-CB 4.33Å; M746-V755 HydrophobicContact SD-CG2 4.16Å; M746-L760 HydrophobicContact CE-CD1 3.09Å; M746-L760 HydrophobicContact CG-CD1 4.16Å; M746-L760 HydrophobicContact SD-CD1 3.55Å; M746-L760 VanDerWaalsContact SD-CD1 3.55Å; M746-L790 HydrophobicContact CE-CD2 4.15Å; M746-L790 HydrophobicContact CG-CD2 4.19Å; M746-V798 HydrophobicContact CE-CB 4.06Å; M746-V798 HydrophobicContact CE-CG1 4.04Å; M746-L800 HydrophobicContact CB-CB 4.22Å; M746-L800 HydrophobicContact CB-CD1 3.81Å; M746-L800 HydrophobicContact CB-CG 4.42Å
747	L	80.7	Confident	80	Confident	71 Å²	71	67.2 Å²	67.2	37%	0.372	36%	0.357	S	S	.	.	H	α-helix	trans	-68.2	-32.1	172	-80.8	160.4	0	0	0	112.7	K743 N744 K749 L800 I805	K743-L747 HydrophobicContact CG-CD1 4.05Å; K743-L747 WeakPolarHBondContact O-CB 3.26Å; K743-L747 WeakPolarHBondContact O-CD1 3.16Å; K743-L747 WeakPolarHBondContact O-CG 3.46Å; K743-L747 PolarHBondContact O-N 3.02Å; N744-L747 PolarHBondContact O-N 3.31Å; L747-K749 VanDerWaalsContact C-N 3.31Å; L747-K749 PolarHBondContact O-N 2.91Å; L747-L800 HydrophobicContact CD2-CD2 3.98Å; L747-L800 HydrophobicContact CG-CD2 4.11Å; L747-I805 HydrophobicContact CD2-CD1 4.17Å
748	A	80.1	Confident	80	Confident	85 Å²	85	70.7 Å²	70.7	70%	0.702	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-13.5	178.9	0	0	0	0	0	114.3	N744 R745 M746	N744-A748 PolarHBondContact O-N 3.03Å; N744-A748 VanDerWaalsContact O-N 3.15Å; R745-A748 PolarHBondContact O-N 2.77Å; M746-A748 VanDerWaalsContact C-N 3.34Å
749	K	77.9	Confident	80	Confident	53 Å²	53	72.2 Å²	72.2	23%	0.23	38%	0.382	C	S	.	.	S	Bend	trans	-89	152.9	178.7	-75.4	-176.7	174.9	-179.1	0	111.6	L747 V755 E763	L747-K749 VanDerWaalsContact C-N 3.31Å; L747-K749 PolarHBondContact O-N 2.91Å; K749-V755 HydrophobicContact CD-CG2 3.53Å; K749-E763 VanDerWaalsContact CE-OE2 3.23Å; K749-E763 WeakPolarHBondContact CE-OE2 3.01Å; K749-E763 IonicContact NZ-OE1 3.79Å; K749-E763 PolarHBondContact NZ-OE1 3.34Å; K749-E763 IonicContact NZ-OE2 3.29Å; K749-E763 PolarHBondContact NZ-OE2 3.38Å
750	E	73.2	Confident	79.9	Confident	170 Å²	170	68.3 Å²	68.3	79%	0.794	37%	0.367	S	S	*	.			trans	-54.1	143.9	179.4	-66.4	-176.8	170.7	0	0	112.6	G752 A753	E750-G752 PolarHBondContact O-N 2.97Å; E750-A753 WeakPolarHBondContact O-CB 3.4Å; E750-A753 PolarHBondContact O-N 3.33Å; E750-A753 VanDerWaalsContact O-N 3.11Å
751	D	63.8	Low	80	Confident	122 Å²	122	63.4 Å²	63.4	65%	0.652	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	111	-178.1	-71.3	16.8	0	0	0	111.1	R802	D751-R802 IonicContact OD1-CZ 2.82Å; D751-R802 IonicContact OD1-NH1 2.8Å; D751-R802 PolarHBondContact OD1-NH1 2.86Å; D751-R802 IonicContact OD1-NH2 3.34Å; D751-R802 PolarHBondContact OD1-NH2 3.11Å; D751-R802 IonicContact OD2-CZ 3.31Å; D751-R802 IonicContact OD2-NH1 2.81Å; D751-R802 PolarHBondContact OD2-NH1 3.03Å
752	G	68.4	Low	80	Confident	34 Å²	34	65.8 Å²	65.8	35%	0.351	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	95	4	175.8	0	0	0	0	0	116	E750 W754	E750-G752 PolarHBondContact O-N 2.97Å; G752-W754 PolarHBondContact O-N 3.41Å
753	A	77.6	Confident	79.8	Confident	43 Å²	43	68.5 Å²	68.5	36%	0.355	37%	0.368	S	S	.	.			trans	-66.3	126.7	176.8	0	0	0	0	0	112.3	E750	E750-A753 WeakPolarHBondContact O-CB 3.4Å; E750-A753 PolarHBondContact O-N 3.33Å; E750-A753 VanDerWaalsContact O-N 3.11Å
754	W	81.8	Confident	79.7	Confident	111 Å²	111	66.9 Å²	66.9	42%	0.42	36%	0.361	S	S	.	.			trans	-84.9	118.7	171.9	-73.5	97.4	0	0	0	110.2	G752 R797 R799	G752-W754 PolarHBondContact O-N 3.41Å; W754-R797 HydrophobicContact CB-CB 4.1Å; W754-R797 HydrophobicContact CE3-CB 3.89Å; W754-R799 HydrophobicContact CD2-CB 4.1Å; W754-R799 HydrophobicContact CE3-CB 3.76Å; W754-R799 HydrophobicContact CH2-CB 4.14Å; W754-R799 HydrophobicContact CZ2-CB 4.45Å; W754-R799 HydrophobicContact CZ3-CB 3.75Å
755	V	82.4	Confident	79.7	Confident	12 Å²	12	68 Å²	68	7%	0.073	36%	0.357	C	S	.	.	B	Isolated β-bridge	trans	-106.3	135.2	-176.8	-173.6	0	0	0	0	110.8	M746 K749 L760 R797 V798	M746-V755 HydrophobicContact CE-CB 4.33Å; M746-V755 HydrophobicContact SD-CG2 4.16Å; K749-V755 HydrophobicContact CD-CG2 3.53Å; V755-L760 HydrophobicContact CG1-CB 3.98Å; V755-L760 HydrophobicContact CG1-CD1 4.08Å; V755-R797 CarbonylContact O-C 3.53Å; V755-R797 WeakPolarHBondContact O-CA 3.13Å; V755-V798 PolarHBondContact N-O 2.96Å; V755-V798 PolarHBondContact O-N 3.34Å
756	A	84.2	Confident	79.7	Confident	43 Å²	43	70.8 Å²	70.8	36%	0.355	38%	0.375	S	S	.	.			trans	-74	133.6	171.7	0	0	0	0	0	110.4	K758 A759 L760	A756-K758 PolarHBondContact O-N 2.71Å; A756-K758 VanDerWaalsContact O-N 3.13Å; A756-A759 HydrophobicContact CB-CB 4.33Å; A756-A759 WeakPolarHBondContact O-CB 3.4Å; A756-A759 PolarHBondContact O-N 2.79Å; A756-L760 PolarHBondContact O-N 3.38Å
757	P	81.1	Confident	79.5	Confident	37 Å²	37	73 Å²	73	24%	0.24	39%	0.391	C	S	.	.	H	α-helix	trans	-55.2	-34.1	179.4	-27.1	33.1	0	0	0	113.6	L760 L761 F777 L781 G796 V798	P757-L760 PolarHBondContact O-N 3.23Å; P757-L761 WeakPolarHBondContact O-CB 3.14Å; P757-L761 PolarHBondContact O-N 3.45Å; P757-F777 HydrophobicContact CB-CE1 4.32Å; P757-L781 HydrophobicContact CB-CD1 4.39Å; P757-G796 WeakPolarHBondContact CD-O 3.26Å; P757-G796 WeakPolarHBondContact CG-O 3.12Å; P757-V798 HydrophobicContact CG-CG2 4.06Å
758	K	83.7	Confident	78.8	Confident	165 Å²	165	70.9 Å²	70.9	72%	0.717	39%	0.387	S	S	*	.	H	α-helix	trans	-64.7	-41.4	175.9	-67.8	-174.8	177.4	-178.9	0	112.7	A756 M762	A756-K758 PolarHBondContact O-N 2.71Å; A756-K758 VanDerWaalsContact O-N 3.13Å; K758-M762 WeakPolarHBondContact O-CG 2.91Å; K758-M762 PolarHBondContact O-N 3.4Å; K758-M762 VanDerWaalsContact O-N 3.09Å
759	A	83.8	Confident	77.8	Confident	41 Å²	41	71.5 Å²	71.5	34%	0.339	40%	0.401	S	S	.	.	H	α-helix	trans	-68	-41.6	177.1	0	0	0	0	0	110.5	A756 L761 M762 E763	A756-A759 HydrophobicContact CB-CB 4.33Å; A756-A759 WeakPolarHBondContact O-CB 3.4Å; A756-A759 PolarHBondContact O-N 2.79Å; A759-L761 PolarHBondContact O-N 2.69Å; A759-M762 PolarHBondContact O-N 3.24Å; A759-E763 WeakPolarHBondContact O-CG 3.46Å; A759-E763 PolarHBondContact O-N 3.04Å
760	L	82.2	Confident	77	Confident	3 Å²	3	72.2 Å²	72.2	2%	0.016	42%	0.417	C	S	.	.	H	α-helix	trans	-65.2	-38.1	177.7	-162.8	140.8	0	0	0	112.6	I742 M746 V755 A756 P757 I764 F777	I742-L760 HydrophobicContact CG1-CD2 4.04Å; I742-L760 HydrophobicContact CG2-CD2 4.39Å; M746-L760 HydrophobicContact CE-CD1 3.09Å; M746-L760 HydrophobicContact CG-CD1 4.16Å; M746-L760 HydrophobicContact SD-CD1 3.55Å; M746-L760 VanDerWaalsContact SD-CD1 3.55Å; V755-L760 HydrophobicContact CG1-CB 3.98Å; V755-L760 HydrophobicContact CG1-CD1 4.08Å; A756-L760 PolarHBondContact O-N 3.38Å; P757-L760 PolarHBondContact O-N 3.23Å; L760-I764 HydrophobicContact CD2-CD1 3.47Å; L760-I764 VanDerWaalsContact CD2-CD1 3.47Å; L760-I764 HydrophobicContact CD2-CG1 4.33Å; L760-I764 HydrophobicContact CG-CD1 4.46Å; L760-I764 VanDerWaalsContact O-CG1 3.27Å; L760-I764 WeakPolarHBondContact O-CG1 3.41Å; L760-I764 PolarHBondContact O-N 3.01Å; L760-F777 HydrophobicContact CB-CZ 4.32Å; L760-F777 HydrophobicContact CD2-CE2 3.39Å; L760-F777 HydrophobicContact CD2-CZ 3.42Å; L760-F777 VanDerWaalsContact CD2-CZ 3.42Å; L760-F777 HydrophobicContact CG-CZ 4.47Å
761	L	83.8	Confident	76.7	Confident	18 Å²	18	70.9 Å²	70.9	9%	0.094	42%	0.42	C	S	.	.	H	α-helix	trans	-64.9	-40.2	173.2	-177.7	67.4	0	0	0	112	P757 A759 I764 R765 V772 F777	P757-L761 WeakPolarHBondContact O-CB 3.14Å; P757-L761 PolarHBondContact O-N 3.45Å; A759-L761 PolarHBondContact O-N 2.69Å; L761-I764 PolarHBondContact O-N 3.19Å; L761-R765 WeakPolarHBondContact O-CB 3.47Å; L761-R765 VanDerWaalsContact O-CG 3.31Å; L761-R765 WeakPolarHBondContact O-CG 3.4Å; L761-R765 PolarHBondContact O-N 3.08Å; L761-V772 HydrophobicContact CD1-CG1 4.18Å; L761-F777 HydrophobicContact CB-CD1 4.32Å; L761-F777 HydrophobicContact CB-CE1 4.02Å; L761-F777 HydrophobicContact CB-CZ 4.21Å; L761-F777 HydrophobicContact CD1-CB 4Å; L761-F777 HydrophobicContact CD1-CD1 3.95Å; L761-F777 HydrophobicContact CD1-CD2 4.01Å; L761-F777 HydrophobicContact CD1-CE1 4.44Å; L761-F777 HydrophobicContact CD1-CG 3.7Å
762	M	82.7	Confident	77	Confident	122 Å²	122	66.1 Å²	66.1	60%	0.601	40%	0.396	S	S	*	.	H	α-helix	trans	-66	-45.3	176.5	-69.8	-125.3	-85.4	0	0	111.4	K758 A759 I764 R765 E766	K758-M762 WeakPolarHBondContact O-CG 2.91Å; K758-M762 PolarHBondContact O-N 3.4Å; K758-M762 VanDerWaalsContact O-N 3.09Å; A759-M762 PolarHBondContact O-N 3.24Å; M762-I764 VanDerWaalsContact C-N 3.31Å; M762-I764 PolarHBondContact O-N 2.72Å; M762-R765 PolarHBondContact O-N 3.23Å; M762-R765 VanDerWaalsContact O-N 3.13Å; M762-E766 WeakPolarHBondContact O-CG 3.32Å; M762-E766 PolarHBondContact O-N 3.22Å
763	E	82	Confident	77.4	Confident	56 Å²	56	73.7 Å²	73.7	26%	0.262	41%	0.414	S	S	.	.	H	α-helix	trans	-59.3	-40	175.9	-72.7	169.9	-161.1	0	0	112.3	K749 A759 E766 S767	K749-E763 VanDerWaalsContact CE-OE2 3.23Å; K749-E763 WeakPolarHBondContact CE-OE2 3.01Å; K749-E763 IonicContact NZ-OE1 3.79Å; K749-E763 PolarHBondContact NZ-OE1 3.34Å; K749-E763 IonicContact NZ-OE2 3.29Å; K749-E763 PolarHBondContact NZ-OE2 3.38Å; A759-E763 WeakPolarHBondContact O-CG 3.46Å; A759-E763 PolarHBondContact O-N 3.04Å; E763-E766 PolarHBondContact O-N 2.59Å; E763-S767 VanDerWaalsContact O-CB 3.23Å; E763-S767 WeakPolarHBondContact O-CB 3.37Å; E763-S767 PolarHBondContact O-N 3.08Å; E763-S767 PolarHBondContact O-OG 3.39Å
764	I	81.5	Confident	77.5	Confident	5 Å²	5	78.3 Å²	78.3	3%	0.026	42%	0.422	C	S	.	.	H	α-helix	trans	-67.6	-39.8	176.6	-71	172.4	0	0	0	111.2	I742 L760 L761 M762 S767 G768 V772 F777	I742-I764 HydrophobicContact CG1-CD1 3.75Å; L760-I764 HydrophobicContact CD2-CD1 3.47Å; L760-I764 VanDerWaalsContact CD2-CD1 3.47Å; L760-I764 HydrophobicContact CD2-CG1 4.33Å; L760-I764 HydrophobicContact CG-CD1 4.46Å; L760-I764 VanDerWaalsContact O-CG1 3.27Å; L760-I764 WeakPolarHBondContact O-CG1 3.41Å; L760-I764 PolarHBondContact O-N 3.01Å; L761-I764 PolarHBondContact O-N 3.19Å; M762-I764 VanDerWaalsContact C-N 3.31Å; M762-I764 PolarHBondContact O-N 2.72Å; I764-S767 PolarHBondContact O-N 3.12Å; I764-G768 PolarHBondContact O-N 3.27Å; I764-V772 HydrophobicContact CG2-CG2 4.13Å; I764-F777 HydrophobicContact CD1-CD2 4.31Å; I764-F777 HydrophobicContact CD1-CE2 3.77Å
765	R	83.5	Confident	77.3	Confident	127 Å²	127	78.2 Å²	78.2	48%	0.479	43%	0.43	S	S	.	.	H	α-helix	trans	-67.5	-34.8	177.1	-76.3	175.8	175.5	-172.5	-3.1	112.9	L761 M762 V772	L761-R765 WeakPolarHBondContact O-CB 3.47Å; L761-R765 VanDerWaalsContact O-CG 3.31Å; L761-R765 WeakPolarHBondContact O-CG 3.4Å; L761-R765 PolarHBondContact O-N 3.08Å; M762-R765 PolarHBondContact O-N 3.23Å; M762-R765 VanDerWaalsContact O-N 3.13Å; R765-V772 PolarHBondContact NH2-O 3.41Å; R765-V772 VanDerWaalsContact NH2-O 3.15Å
766	E	80.7	Confident	77.1	Confident	159 Å²	159	79 Å²	79	74%	0.743	43%	0.433	S	S	*	.	H	α-helix	trans	-72.9	-33.9	175.5	-72.6	174.3	-178.9	0	0	111.9	M762 E763	M762-E766 WeakPolarHBondContact O-CG 3.32Å; M762-E766 PolarHBondContact O-N 3.22Å; E763-E766 PolarHBondContact O-N 2.59Å
767	S	74	Confident	77.2	Confident	57 Å²	57	77.1 Å²	77.1	40%	0.399	42%	0.417	S	S	.	.	H	α-helix	trans	-87	-24	-175.9	-57.3	0	0	0	0	114.2	R745 E763 I764	R745-S767 PolarHBondContact NH2-OG 2.86Å; E763-S767 VanDerWaalsContact O-CB 3.23Å; E763-S767 WeakPolarHBondContact O-CB 3.37Å; E763-S767 PolarHBondContact O-N 3.08Å; E763-S767 PolarHBondContact O-OG 3.39Å; I764-S767 PolarHBondContact O-N 3.12Å
768	G	67.4	Low	77.3	Confident	26 Å²	26	79.3 Å²	79.3	27%	0.268	42%	0.424	S	S	.	.			trans	-127	119.4	-176.8	0	0	0	0	0	110.9	I764 A770	I764-G768 PolarHBondContact O-N 3.27Å; G768-A770 PolarHBondContact O-N 2.72Å
769	G	59	Low	77.2	Confident	97 Å²	97	76.2 Å²	76.2	100%	1	41%	0.412	S	S	*	.	S	Bend	trans	-64.9	12.6	178.1	0	0	0	0	0	115.8
770	A	61.3	Low	77.2	Confident	68 Å²	68	74.3 Å²	74.3	56%	0.562	40%	0.396	S	S	*	.	S	Bend	trans	-98.3	130.2	177.4	0	0	0	0	0	110.7	G768 V772	G768-A770 PolarHBondContact O-N 2.72Å; A770-V772 VanDerWaalsContact C-N 3.32Å; A770-V772 PolarHBondContact O-N 3.38Å
771	T	66.9	Low	77.4	Confident	142 Å²	142	74.4 Å²	74.4	87%	0.871	40%	0.397	S	S	*	.			trans	-69.8	85.1	175.7	43.4	0	0	0	0	110.8	R773	T771-R773 PolarHBondContact O-N 3.11Å
772	V	70.1	Confident	77.3	Confident	23 Å²	23	76.4 Å²	76.4	14%	0.139	41%	0.408	C	S	.	.			trans	-66.7	117.2	174.8	177.1	0	0	0	0	109.9	L738 L761 I764 R765 A770 F777	L738-V772 HydrophobicContact CD1-CB 4.31Å; L738-V772 HydrophobicContact CD1-CG1 3.38Å; L738-V772 HydrophobicContact CD1-CG2 3.91Å; L761-V772 HydrophobicContact CD1-CG1 4.18Å; I764-V772 HydrophobicContact CG2-CG2 4.13Å; R765-V772 PolarHBondContact NH2-O 3.41Å; R765-V772 VanDerWaalsContact NH2-O 3.15Å; A770-V772 VanDerWaalsContact C-N 3.32Å; A770-V772 PolarHBondContact O-N 3.38Å; V772-F777 HydrophobicContact CG1-CB 3.96Å
773	R	75.6	Confident	77.3	Confident	192 Å²	192	75 Å²	75	73%	0.725	40%	0.399	S	S	*	.			trans	-63.8	136.8	170.2	-69.4	-176.1	-179.4	152	0.4	109.5	T771 D775 L776 F777	T771-R773 PolarHBondContact O-N 3.11Å; R773-D775 VanDerWaalsContact C-N 3.25Å; R773-D775 PolarHBondContact O-N 3.16Å; R773-L776 HydrophobicContact CB-CB 4.38Å; R773-L776 PolarHBondContact O-N 2.79Å; R773-F777 PolarHBondContact O-N 2.88Å
774	R	79.9	Confident	77.3	Confident	140 Å²	140	72.3 Å²	72.3	53%	0.528	39%	0.387	S	S	.	.	H	α-helix	trans	-60.9	-38.1	-178.7	-177.8	176.6	172.8	-168	-11.3	111.7	F777 E778	R774-F777 PolarHBondContact O-N 3.02Å; R774-E778 HydrophobicContact CG-CG 4.46Å; R774-E778 IonicContact CZ-OE1 3.82Å; R774-E778 IonicContact NE-OE1 3.81Å; R774-E778 PolarHBondContact NE-OE1 3.39Å; R774-E778 IonicContact NH2-OE1 3.78Å; R774-E778 PolarHBondContact NH2-OE1 3.11Å; R774-E778 WeakPolarHBondContact O-CG 3.49Å; R774-E778 PolarHBondContact O-N 2.9Å
775	D	77.8	Confident	77.3	Confident	110 Å²	110	73.4 Å²	73.4	59%	0.588	40%	0.395	S	S	*	.	H	α-helix	trans	-66.2	-47.2	-176.5	-45.2	-39.7	0	0	0	111	R773 F777 E778 E779	R773-D775 VanDerWaalsContact C-N 3.25Å; R773-D775 PolarHBondContact O-N 3.16Å; D775-F777 VanDerWaalsContact C-N 3.28Å; D775-F777 PolarHBondContact O-N 3.16Å; D775-E778 PolarHBondContact O-N 2.86Å; D775-E779 WeakPolarHBondContact O-CB 3.32Å; D775-E779 WeakPolarHBondContact O-CG 3.1Å; D775-E779 PolarHBondContact O-N 3.13Å
776	L	78.8	Confident	77.2	Confident	28 Å²	28	75.3 Å²	75.3	15%	0.147	41%	0.407	C	S	.	.	H	α-helix	trans	-60	-37.5	175.4	-170.4	74.4	0	0	0	112.1	M727 T731 A734 R773 V780	M727-L776 HydrophobicContact CE-CD1 3.45Å; M727-L776 VanDerWaalsContact CE-CD1 3.45Å; T731-L776 HydrophobicContact CG2-CD1 4.23Å; A734-L776 HydrophobicContact CB-CD2 4.33Å; R773-L776 HydrophobicContact CB-CB 4.38Å; R773-L776 PolarHBondContact O-N 2.79Å; L776-V780 VanDerWaalsContact O-CG2 3.32Å; L776-V780 WeakPolarHBondContact O-CG2 3.42Å; L776-V780 PolarHBondContact O-N 3.07Å
777	F	85.1	Confident	77.1	Confident	4 Å²	4	71.4 Å²	71.4	2%	0.018	39%	0.391	C	S	.	.	H	α-helix	trans	-68.4	-43.3	176.9	173.8	-97.5	0	0	0	112.2	L738 I742 P757 L760 L761 I764 V772 R773 R774 D775 E779 L781	L738-F777 HydrophobicContact CD2-CD2 4.11Å; I742-F777 HydrophobicContact CD1-CD2 4.11Å; I742-F777 HydrophobicContact CD1-CE2 3.8Å; I742-F777 HydrophobicContact CG1-CE2 4.21Å; P757-F777 HydrophobicContact CB-CE1 4.32Å; L760-F777 HydrophobicContact CB-CZ 4.32Å; L760-F777 HydrophobicContact CD2-CE2 3.39Å; L760-F777 HydrophobicContact CD2-CZ 3.42Å; L760-F777 VanDerWaalsContact CD2-CZ 3.42Å; L760-F777 HydrophobicContact CG-CZ 4.47Å; L761-F777 HydrophobicContact CB-CD1 4.32Å; L761-F777 HydrophobicContact CB-CE1 4.02Å; L761-F777 HydrophobicContact CB-CZ 4.21Å; L761-F777 HydrophobicContact CD1-CB 4Å; L761-F777 HydrophobicContact CD1-CD1 3.95Å; L761-F777 HydrophobicContact CD1-CD2 4.01Å; L761-F777 HydrophobicContact CD1-CE1 4.44Å; L761-F777 HydrophobicContact CD1-CG 3.7Å; I764-F777 HydrophobicContact CD1-CD2 4.31Å; I764-F777 HydrophobicContact CD1-CE2 3.77Å; V772-F777 HydrophobicContact CG1-CB 3.96Å; R773-F777 PolarHBondContact O-N 2.88Å; R774-F777 PolarHBondContact O-N 3.02Å; D775-F777 VanDerWaalsContact C-N 3.28Å; D775-F777 PolarHBondContact O-N 3.16Å; F777-E779 VanDerWaalsContact C-N 3.34Å; F777-L781 HydrophobicContact CE1-CD1 3.89Å; F777-L781 HydrophobicContact CE2-CD1 4.5Å; F777-L781 HydrophobicContact CZ-CD1 3.74Å; F777-L781 WeakPolarHBondContact O-CB 3.28Å; F777-L781 PolarHBondContact O-N 3.28Å
778	E	83.7	Confident	77.3	Confident	83 Å²	83	74.2 Å²	74.2	39%	0.388	40%	0.398	S	S	.	.	H	α-helix	trans	-67.4	-35.9	177.1	-71.3	-176.4	-170.6	0	0	111.4	R774 D775 N782	R774-E778 HydrophobicContact CG-CG 4.46Å; R774-E778 IonicContact CZ-OE1 3.82Å; R774-E778 IonicContact NE-OE1 3.81Å; R774-E778 PolarHBondContact NE-OE1 3.39Å; R774-E778 IonicContact NH2-OE1 3.78Å; R774-E778 PolarHBondContact NH2-OE1 3.11Å; R774-E778 WeakPolarHBondContact O-CG 3.49Å; R774-E778 PolarHBondContact O-N 2.9Å; D775-E778 PolarHBondContact O-N 2.86Å; E778-N782 WeakPolarHBondContact O-CB 3.25Å; E778-N782 PolarHBondContact O-N 3.13Å; E778-N782 PolarHBondContact O-ND2 3.33Å; E778-N782 VanDerWaalsContact O-ND2 3.08Å
779	E	81.9	Confident	77.8	Confident	99 Å²	99	74.5 Å²	74.5	46%	0.463	39%	0.392	S	S	.	.	H	α-helix	trans	-60	-57	171.9	-76.3	172.4	-177.1	0	0	112	D775 F777 L781 N782 E783	D775-E779 WeakPolarHBondContact O-CB 3.32Å; D775-E779 WeakPolarHBondContact O-CG 3.1Å; D775-E779 PolarHBondContact O-N 3.13Å; F777-E779 VanDerWaalsContact C-N 3.34Å; E779-L781 VanDerWaalsContact C-N 3.26Å; E779-L781 PolarHBondContact O-N 3.01Å; E779-N782 WeakPolarHBondContact O-CB 3.43Å; E779-N782 PolarHBondContact O-N 3.36Å; E779-N782 VanDerWaalsContact O-N 3.08Å; E779-E783 PolarHBondContact O-N 3.13Å
780	V	83.5	Confident	78.9	Confident	1 Å²	1	70 Å²	70	1%	0.006	35%	0.345	C	S	.	.	H	α-helix	trans	-61.7	-36.2	-179.8	174.8	0	0	0	0	111.2	A735 L738 R739 I742 L776 E783 M784	A735-V780 HydrophobicContact CB-CG2 3.87Å; L738-V780 HydrophobicContact CD2-CB 3.55Å; L738-V780 HydrophobicContact CD2-CG1 3.64Å; L738-V780 HydrophobicContact CD2-CG2 3.83Å; R739-V780 HydrophobicContact CB-CG1 3.93Å; I742-V780 HydrophobicContact CD1-CG1 4.16Å; L776-V780 VanDerWaalsContact O-CG2 3.32Å; L776-V780 WeakPolarHBondContact O-CG2 3.42Å; L776-V780 PolarHBondContact O-N 3.07Å; V780-E783 PolarHBondContact O-N 3.44Å; V780-M784 HydrophobicContact CG1-CG 4.37Å; V780-M784 HydrophobicContact CG1-SD 4.26Å; V780-M784 WeakPolarHBondContact O-CB 3.4Å; V780-M784 VanDerWaalsContact O-CG 3.29Å; V780-M784 WeakPolarHBondContact O-CG 3.43Å; V780-M784 PolarHBondContact O-N 2.92Å
781	L	85.3	Confident	79.9	Confident	5 Å²	5	70.3 Å²	70.3	3%	0.026	34%	0.337	C	S	.	.	H	α-helix	trans	-67	-37.8	176.7	-168.8	143	0	0	0	112	P757 F777 E779 C785 L790 V798	P757-L781 HydrophobicContact CB-CD1 4.39Å; F777-L781 HydrophobicContact CE1-CD1 3.89Å; F777-L781 HydrophobicContact CE2-CD1 4.5Å; F777-L781 HydrophobicContact CZ-CD1 3.74Å; F777-L781 WeakPolarHBondContact O-CB 3.28Å; F777-L781 PolarHBondContact O-N 3.28Å; E779-L781 VanDerWaalsContact C-N 3.26Å; E779-L781 PolarHBondContact O-N 3.01Å; L781-C785 PolarHBondContact O-N 2.8Å; L781-C785 PolarHBondContact O-SG 3.31Å; L781-L790 HydrophobicContact CG-CD1 4.49Å; L781-V798 HydrophobicContact CD1-CG2 4.22Å; L781-V798 HydrophobicContact CD2-CG2 3.97Å; L781-V798 HydrophobicContact CG-CG2 4.45Å
782	N	82.9	Confident	80.5	Confident	60 Å²	60	70.5 Å²	70.5	32%	0.321	32%	0.322	S	S	.	.	H	α-helix	trans	-68.9	-38.7	173.7	-72.8	-32.8	0	0	0	111.6	E778 E779 C785 K786 R792	E778-N782 WeakPolarHBondContact O-CB 3.25Å; E778-N782 PolarHBondContact O-N 3.13Å; E778-N782 PolarHBondContact O-ND2 3.33Å; E778-N782 VanDerWaalsContact O-ND2 3.08Å; E779-N782 WeakPolarHBondContact O-CB 3.43Å; E779-N782 PolarHBondContact O-N 3.36Å; E779-N782 VanDerWaalsContact O-N 3.08Å; N782-C785 PolarHBondContact O-N 2.83Å; N782-K786 WeakPolarHBondContact O-CG 3.23Å; N782-K786 PolarHBondContact O-N 2.71Å; N782-R792 PolarHBondContact OD1-NH1 2.85Å
783	E	82	Confident	80.9	Confident	92 Å²	92	70.4 Å²	70.4	43%	0.43	33%	0.325	S	S	.	.	H	α-helix	trans	-61.1	-47.1	172.8	-72.9	-176.7	166.1	0	0	111.5	E779 V780 C785 K786 D787	E779-E783 PolarHBondContact O-N 3.13Å; V780-E783 PolarHBondContact O-N 3.44Å; E783-C785 PolarHBondContact O-N 2.91Å; E783-K786 WeakPolarHBondContact O-CB 3.26Å; E783-K786 PolarHBondContact O-N 3.4Å; E783-D787 PolarHBondContact O-N 3.33Å
784	M	81.7	Confident	80.7	Confident	0 Å²	0	72.5 Å²	72.5	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-64.3	-26	176.2	-70.2	-176.3	78	0	0	113.4	R739 I742 K743 V780 M789 L790	R739-M784 HydrophobicContact CG-CE 4.36Å; R739-M784 HydrophobicContact CG-CG 3.99Å; R739-M784 HydrophobicContact CG-SD 3.92Å; I742-M784 HydrophobicContact CB-CE 4.36Å; I742-M784 HydrophobicContact CB-SD 3.91Å; I742-M784 HydrophobicContact CD1-SD 4.19Å; I742-M784 HydrophobicContact CG2-CE 3.96Å; I742-M784 HydrophobicContact CG2-SD 3.72Å; K743-M784 HydrophobicContact CB-CE 4.45Å; V780-M784 HydrophobicContact CG1-CG 4.37Å; V780-M784 HydrophobicContact CG1-SD 4.26Å; V780-M784 WeakPolarHBondContact O-CB 3.4Å; V780-M784 VanDerWaalsContact O-CG 3.29Å; V780-M784 WeakPolarHBondContact O-CG 3.43Å; V780-M784 PolarHBondContact O-N 2.92Å; M784-M789 PolarHBondContact O-N 2.82Å; M784-M789 VanDerWaalsContact O-N 3.11Å; M784-L790 HydrophobicContact CB-CB 4.41Å; M784-L790 HydrophobicContact CB-CD1 3.55Å; M784-L790 HydrophobicContact CB-CG 3.91Å; M784-L790 HydrophobicContact CE-CD1 3.98Å; M784-L790 HydrophobicContact CE-CG 4.13Å; M784-L790 HydrophobicContact CG-CD1 4.36Å; M784-L790 PolarHBondContact O-N 3.46Å; M784-L790 VanDerWaalsContact O-N 3.07Å; M784-L790 HydrophobicContact SD-CD1 3.92Å
785	C	82.2	Confident	80.2	Confident	29 Å²	29	73.6 Å²	73.6	20%	0.196	35%	0.349	C	S	.	.	H	α-helix	trans	-75.2	-36.2	171.5	-68.4	0	0	0	0	112.1	L781 N782 E783 E788 L790	L781-C785 PolarHBondContact O-N 2.8Å; L781-C785 PolarHBondContact O-SG 3.31Å; N782-C785 PolarHBondContact O-N 2.83Å; E783-C785 PolarHBondContact O-N 2.91Å; C785-E788 PolarHBondContact O-N 2.87Å; C785-L790 WeakPolarHBondContact CA-O 3.37Å
786	K	81.5	Confident	80	Confident	167 Å²	167	69.5 Å²	69.5	73%	0.726	33%	0.332	S	S	*	.	H	α-helix	trans	-67.7	-38.3	174.5	-72.4	175.1	-178.9	178.3	0	111.8	N782 E783 E788	N782-K786 WeakPolarHBondContact O-CG 3.23Å; N782-K786 PolarHBondContact O-N 2.71Å; E783-K786 WeakPolarHBondContact O-CB 3.26Å; E783-K786 PolarHBondContact O-N 3.4Å; K786-E788 PolarHBondContact O-N 3.43Å; K786-E788 VanDerWaalsContact O-N 3.15Å
787	D	79.3	Confident	80.2	Confident	76 Å²	76	74 Å²	74	41%	0.406	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	7.1	175.2	-65.8	-13.4	0	0	0	112.9	R739 E783 M789	R739-D787 IonicContact CZ-OD2 3.6Å; R739-D787 IonicContact NH1-OD2 3.87Å; R739-D787 PolarHBondContact NH1-OD2 3.33Å; R739-D787 IonicContact NH2-OD2 3Å; R739-D787 PolarHBondContact NH2-OD2 2.9Å; E783-D787 PolarHBondContact O-N 3.33Å; D787-M789 HydrophobicContact CB-CG 4.43Å; D787-M789 PolarHBondContact O-N 2.94Å
788	E	77.8	Confident	80.1	Confident	116 Å²	116	73.9 Å²	73.9	54%	0.542	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	12.9	-178.5	-60.4	-173.7	165.7	0	0	115.5	C785 K786 L790 N801 N804	C785-E788 PolarHBondContact O-N 2.87Å; K786-E788 PolarHBondContact O-N 3.43Å; K786-E788 VanDerWaalsContact O-N 3.15Å; E788-L790 VanDerWaalsContact C-N 3.31Å; E788-N801 WeakPolarHBondContact O-CB 3.15Å; E788-N801 PolarHBondContact O-ND2 2.86Å; E788-N801 VanDerWaalsContact O-ND2 3.09Å; E788-N804 VanDerWaalsContact CB-ND2 3.27Å; E788-N804 WeakPolarHBondContact CB-ND2 3.35Å; E788-N804 PolarHBondContact OE2-ND2 2.83Å
789	M	77.3	Confident	80.1	Confident	32 Å²	32	74.9 Å²	74.9	16%	0.158	35%	0.347	C	S	.	.	S	Bend	trans	-73	-28.1	173.9	-69.7	-157.2	177.4	0	0	111.8	M784 D787 N801	M784-M789 PolarHBondContact O-N 2.82Å; M784-M789 VanDerWaalsContact O-N 3.11Å; D787-M789 HydrophobicContact CB-CG 4.43Å; D787-M789 PolarHBondContact O-N 2.94Å; M789-N801 PolarHBondContact O-N 3.22Å
790	L	82.6	Confident	80.2	Confident	3 Å²	3	71.2 Å²	71.2	2%	0.016	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	133	176.9	-65.4	178.8	0	0	0	110.6	I742 M746 L781 M784 C785 E788 V798 R799 L800	I742-L790 HydrophobicContact CG2-CD1 4.12Å; M746-L790 HydrophobicContact CE-CD2 4.15Å; M746-L790 HydrophobicContact CG-CD2 4.19Å; L781-L790 HydrophobicContact CG-CD1 4.49Å; M784-L790 HydrophobicContact CB-CB 4.41Å; M784-L790 HydrophobicContact CB-CD1 3.55Å; M784-L790 HydrophobicContact CB-CG 3.91Å; M784-L790 HydrophobicContact CE-CD1 3.98Å; M784-L790 HydrophobicContact CE-CG 4.13Å; M784-L790 HydrophobicContact CG-CD1 4.36Å; M784-L790 PolarHBondContact O-N 3.46Å; M784-L790 VanDerWaalsContact O-N 3.07Å; M784-L790 HydrophobicContact SD-CD1 3.92Å; C785-L790 WeakPolarHBondContact CA-O 3.37Å; E788-L790 VanDerWaalsContact C-N 3.31Å; L790-V798 HydrophobicContact CB-CG1 3.58Å; L790-V798 HydrophobicContact CD1-CG1 3.8Å; L790-V798 HydrophobicContact CD2-CG1 3.95Å; L790-V798 HydrophobicContact CG-CG1 3.96Å; L790-R799 CarbonylContact C-O 3.6Å; L790-R799 WeakPolarHBondContact CA-O 3.46Å; L790-L800 HydrophobicContact CD2-CD1 4.08Å
791	L	82.1	Confident	79.9	Confident	75 Å²	75	72.3 Å²	72.3	39%	0.393	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	133.5	171.9	-68.4	167.4	0	0	0	109.8	V798 R799 N801	L791-V798 CarbonylContact O-C 3.56Å; L791-V798 WeakPolarHBondContact O-CA 3.5Å; L791-R799 PolarHBondContact N-O 2.89Å; L791-R799 PolarHBondContact O-N 3.46Å; L791-N801 HydrophobicContact CD1-CB 4.21Å; L791-N801 HydrophobicContact CG-CB 4.1Å
792	R	80.7	Confident	79.2	Confident	146 Å²	146	77.5 Å²	77.5	55%	0.551	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	121.7	177.8	-153.2	173.5	-169	162.2	4.9	110.2	N782 R797	N782-R792 PolarHBondContact OD1-NH1 2.85Å; R792-R797 CarbonylContact C-O 3.55Å; R792-R797 WeakPolarHBondContact CA-O 3.44Å
793	G	78.5	Confident	78.4	Confident	20 Å²	20	83.1 Å²	83.1	21%	0.206	38%	0.38	C	S	.	.			trans	-98.7	-179.6	-179	0	0	0	0	0	112.9	G796 R797	G793-G796 PolarHBondContact O-N 3.15Å; G793-R797 PolarHBondContact N-O 2.8Å
794	R	70.5	Confident	77.5	Confident	237 Å²	237	81.6 Å²	81.6	89%	0.894	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-56.5	140.5	171.8	-66.2	-177.5	180	177.7	-0.1	109.8	G796	R794-G796 VanDerWaalsContact C-N 3.3Å; R794-G796 PolarHBondContact O-N 2.92Å
795	L	70	Confident	76.5	Confident	163 Å²	163	83.9 Å²	83.9	85%	0.853	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	68.2	18.7	-174.7	-53.9	165.7	0	0	0	115.4	R797	L795-R797 VanDerWaalsContact C-N 3.26Å; L795-R797 PolarHBondContact O-N 2.77Å
796	G	72.2	Confident	75.4	Confident	23 Å²	23	87.3 Å²	87.3	24%	0.237	41%	0.406	C	S	.	.	G	3₁₀ helix	trans	72.4	16.5	175.8	0	0	0	0	0	114.2	P757 G793 R794	P757-G796 WeakPolarHBondContact CD-O 3.26Å; P757-G796 WeakPolarHBondContact CG-O 3.12Å; G793-G796 PolarHBondContact O-N 3.15Å; R794-G796 VanDerWaalsContact C-N 3.3Å; R794-G796 PolarHBondContact O-N 2.92Å
797	R	83.3	Confident	74	Confident	123 Å²	123	84.2 Å²	84.2	46%	0.464	40%	0.403	S	S	.	.			trans	-69.9	151.3	172	-62.4	-174.7	-178.6	-175.5	-0.7	110.4	W754 V755 R792 G793 L795	W754-R797 HydrophobicContact CB-CB 4.1Å; W754-R797 HydrophobicContact CE3-CB 3.89Å; V755-R797 CarbonylContact O-C 3.53Å; V755-R797 WeakPolarHBondContact O-CA 3.13Å; R792-R797 CarbonylContact C-O 3.55Å; R792-R797 WeakPolarHBondContact CA-O 3.44Å; G793-R797 PolarHBondContact N-O 2.8Å; L795-R797 VanDerWaalsContact C-N 3.26Å; L795-R797 PolarHBondContact O-N 2.77Å
798	V	84.2	Confident	72.4	Confident	1 Å²	1	87.4 Å²	87.4	1%	0.006	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	139.5	-173.1	-167.6	0	0	0	0	109.9	M746 V755 P757 L781 L790 L791	M746-V798 HydrophobicContact CE-CB 4.06Å; M746-V798 HydrophobicContact CE-CG1 4.04Å; V755-V798 PolarHBondContact N-O 2.96Å; V755-V798 PolarHBondContact O-N 3.34Å; P757-V798 HydrophobicContact CG-CG2 4.06Å; L781-V798 HydrophobicContact CD1-CG2 4.22Å; L781-V798 HydrophobicContact CD2-CG2 3.97Å; L781-V798 HydrophobicContact CG-CG2 4.45Å; L790-V798 HydrophobicContact CB-CG1 3.58Å; L790-V798 HydrophobicContact CD1-CG1 3.8Å; L790-V798 HydrophobicContact CD2-CG1 3.95Å; L790-V798 HydrophobicContact CG-CG1 3.96Å; L791-V798 CarbonylContact O-C 3.56Å; L791-V798 WeakPolarHBondContact O-CA 3.5Å
799	R	83.7	Confident	70.4	Confident	105 Å²	105	90 Å²	90	40%	0.396	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	143.7	178.4	171.8	-178	173.6	-178.4	4.3	109.6	W754 L790 L791	W754-R799 HydrophobicContact CD2-CB 4.1Å; W754-R799 HydrophobicContact CE3-CB 3.76Å; W754-R799 HydrophobicContact CH2-CB 4.14Å; W754-R799 HydrophobicContact CZ2-CB 4.45Å; W754-R799 HydrophobicContact CZ3-CB 3.75Å; L790-R799 CarbonylContact C-O 3.6Å; L790-R799 WeakPolarHBondContact CA-O 3.46Å; L791-R799 PolarHBondContact N-O 2.89Å; L791-R799 PolarHBondContact O-N 3.46Å
800	L	82.6	Confident	68.4	Low	21 Å²	21	94 Å²	94	11%	0.11	46%	0.463	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	129	172.2	-167	78.7	0	0	0	111.3	M746 L747 L790 R802 I805	M746-L800 HydrophobicContact CB-CB 4.22Å; M746-L800 HydrophobicContact CB-CD1 3.81Å; M746-L800 HydrophobicContact CB-CG 4.42Å; L747-L800 HydrophobicContact CD2-CD2 3.98Å; L747-L800 HydrophobicContact CG-CD2 4.11Å; L790-L800 HydrophobicContact CD2-CD1 4.08Å; L800-R802 HydrophobicContact CD2-CG 3.82Å; L800-R802 HydrophobicContact CG-CG 4.4Å; L800-I805 HydrophobicContact CD1-CD1 4.48Å; L800-I805 HydrophobicContact CD2-CD1 3.75Å; L800-I805 HydrophobicContact CG-CD1 4.16Å
801	N	78.6	Confident	66.3	Low	24 Å²	24	101 Å²	101	13%	0.128	51%	0.506	C	S	.	.			trans	-90.8	97.8	169.7	-169.5	8	0	0	0	109.8	E788 M789 L791 Q803 N804	E788-N801 WeakPolarHBondContact O-CB 3.15Å; E788-N801 PolarHBondContact O-ND2 2.86Å; E788-N801 VanDerWaalsContact O-ND2 3.09Å; M789-N801 PolarHBondContact O-N 3.22Å; L791-N801 HydrophobicContact CD1-CB 4.21Å; L791-N801 HydrophobicContact CG-CB 4.1Å; N801-Q803 PolarHBondContact O-N 3.27Å; N801-Q803 PolarHBondContact OD1-N 3.49Å; N801-N804 PolarHBondContact O-N 3.48Å
802	R	69.5	Low	64	Low	115 Å²	115	100.4 Å²	100.4	43%	0.434	52%	0.518	S	S	.	.	G	3₁₀ helix	trans	-70.7	-11.8	-178.2	-73.1	-168.2	175.6	166.7	7	114.5	D751 L800 N804 I805	D751-R802 IonicContact OD1-CZ 2.82Å; D751-R802 IonicContact OD1-NH1 2.8Å; D751-R802 PolarHBondContact OD1-NH1 2.86Å; D751-R802 IonicContact OD1-NH2 3.34Å; D751-R802 PolarHBondContact OD1-NH2 3.11Å; D751-R802 IonicContact OD2-CZ 3.31Å; D751-R802 IonicContact OD2-NH1 2.81Å; D751-R802 PolarHBondContact OD2-NH1 3.03Å; L800-R802 HydrophobicContact CD2-CG 3.82Å; L800-R802 HydrophobicContact CG-CG 4.4Å; R802-N804 VanDerWaalsContact C-N 3.31Å; R802-N804 PolarHBondContact O-N 2.91Å; R802-I805 HydrophobicContact CB-CD1 4.27Å; R802-I805 HydrophobicContact CG-CD1 3.93Å
803	Q	66.2	Low	61.8	Low	177 Å²	177	100.4 Å²	100.4	83%	0.827	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-73.4	-23.2	179.7	-66.1	-179.1	-10.6	0	0	112.9	N801	N801-Q803 PolarHBondContact O-N 3.27Å; N801-Q803 PolarHBondContact OD1-N 3.49Å
804	N	63.1	Low	59.9	Low	61 Å²	61	104.5 Å²	104.5	33%	0.326	57%	0.566	S	S	.	*	G	3₁₀ helix	trans	-109.2	17.8	-177.4	-74.9	0.8	0	0	0	113.8	E788 N801 R802 V806	E788-N804 VanDerWaalsContact CB-ND2 3.27Å; E788-N804 WeakPolarHBondContact CB-ND2 3.35Å; E788-N804 PolarHBondContact OE2-ND2 2.83Å; N801-N804 PolarHBondContact O-N 3.48Å; R802-N804 VanDerWaalsContact C-N 3.31Å; R802-N804 PolarHBondContact O-N 2.91Å; N804-V806 PolarHBondContact O-N 3.3Å; N804-V806 VanDerWaalsContact O-N 3.16Å
805	I	61.7	Low	58.2	Low	47 Å²	47	97.7 Å²	97.7	24%	0.241	56%	0.561	C	S	.	*			trans	-83	95.7	175.2	-58.2	175.9	0	0	0	108	L747 L800 R802 P807	L747-I805 HydrophobicContact CD2-CD1 4.17Å; L800-I805 HydrophobicContact CD1-CD1 4.48Å; L800-I805 HydrophobicContact CD2-CD1 3.75Å; L800-I805 HydrophobicContact CG-CD1 4.16Å; R802-I805 HydrophobicContact CB-CD1 4.27Å; R802-I805 HydrophobicContact CG-CD1 3.93Å; I805-P807 WeakPolarHBondContact O-CD 3.27Å
806	V	58.2	Low	56.4	Low	101 Å²	101	103 Å²	103	61%	0.612	58%	0.581	S	S	*	*			trans	-63.8	125.6	168.5	-172.5	0	0	0	0	108	N804 D808	N804-V806 PolarHBondContact O-N 3.3Å; N804-V806 VanDerWaalsContact O-N 3.16Å; V806-D808 PolarHBondContact O-N 3.13Å
807	P	53.3	Low	55.6	Low	103 Å²	103	107 Å²	107	67%	0.669	60%	0.598	S	S	*	*			trans	-67.2	120.8	168.2	26.4	-29.4	0	0	0	108.6	I805 E809	I805-P807 WeakPolarHBondContact O-CD 3.27Å; P807-E809 PolarHBondContact O-N 3.44Å
808	D	43.7	Very low	54.1	Low	143 Å²	143	106.2 Å²	106.2	77%	0.765	61%	0.605	S	S	*	*			trans	-66.9	94.2	178	-72.9	-50	0	0	0	109.9	K743 V806 S810	K743-D808 IonicContact NZ-OD2 2.83Å; K743-D808 PolarHBondContact NZ-OD2 2.84Å; V806-D808 PolarHBondContact O-N 3.13Å; D808-S810 PolarHBondContact O-N 3.01Å
809	E	37.4	Very low	52.4	Low	171 Å²	171	112 Å²	112	80%	0.799	64%	0.638	S	S	*	*			trans	-80.4	108.4	166.5	-76.9	-172.5	163.3	0	0	110.3	P807 V811	P807-E809 PolarHBondContact O-N 3.44Å; E809-V811 PolarHBondContact O-N 3.31Å
810	S	35.3	Very low	50.6	Low	115 Å²	115	112.4 Å²	112.4	80%	0.804	65%	0.653	S	S	*	*			trans	20.2	90.9	149.7	56.9	0	0	0	0	118.4	D808 G812	D808-S810 PolarHBondContact O-N 3.01Å; S810-G812 PolarHBondContact O-N 3.4Å
811	V	36.7	Very low	48.6	Very low	149 Å²	149	118.1 Å²	118.1	90%	0.903	69%	0.687	S	S	*	*			trans	-86.5	100.3	158.2	179.9	0	0	0	0	108.3	E809	E809-V811 PolarHBondContact O-N 3.31Å
812	G	35.6	Very low	46.6	Very low	64 Å²	64	124.4 Å²	124.4	66%	0.66	72%	0.724	S	S	*	*			trans	-67.7	136.3	170.4	0	0	0	0	0	111.9	S810 A814	S810-G812 PolarHBondContact O-N 3.4Å; G812-A814 PolarHBondContact O-N 3.14Å
813	V	34.4	Very low	45	Very low	146 Å²	146	125.1 Å²	125.1	89%	0.885	75%	0.745	S	S	*	*			trans	-23.3	115.3	160.4	-176.2	0	0	0	0	113.9
814	A	37.2	Very low	43.3	Very low	105 Å²	105	121.1 Å²	121.1	87%	0.868	74%	0.738	S	S	*	*			trans	-136.4	99.7	152.5	0	0	0	0	0	107.3	G812	G812-A814 PolarHBondContact O-N 3.14Å
815	A	35	Very low	41.7	Very low	95 Å²	95	126.1 Å²	126.1	79%	0.785	77%	0.773	S	S	*	*			trans	-100.1	111.5	165.2	0	0	0	0	0	106.9
816	E	31.6	Very low	39.9	Very low	274 Å²	274	133.3 Å²	133.3	100%	1.28	82%	0.821	S	S	*	*			trans	-150.5	0	147	-100.6	-174.4	178.1	0	0	107.8

Retrieved 816 of 816 residues in 351.9 ms (Link to these results)

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